*HEADER    TOXIN                                   06-FEB-19   6NW8              
*TITLE     SOLUTION STRUCTURE OF CN29, A TOXIN FROM CENTRUROIDES NOXIUS SCORPION 
*TITLE    2 VENOM                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CN29;                                                      
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES;                                                     
*COMPND   5 OTHER_DETAILS: THE MOLECULE CONTAINS THREE DISULPHIDE BRIDGES: 2-23, 
*COMPND   6 5-18, 12-25                                                          
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: CENTRUROIDES NOXIUS;                            
*SOURCE   4 ORGANISM_TAXID: 6878;                                                
*SOURCE   5 OTHER_DETAILS: VENOM                                                 
*KEYWDS    SCORPION TOXIN, TOXIN                                                 
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    10                                                                    
*AUTHOR    M.DELEPIERRE,G.B.GURROLA,L.D.POSSANI,J.I.GUIJARRO                     
*REVDAT   1   03-JUL-19 6NW8    0                                                
# Restraints file 1: unambig.tbl
! 1
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HA) 2.049 0.525 0.525 weight 1.000
! 2
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   18 and name   HA) 2.994 1.121 1.121 weight 1.000
! 3
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name   HA) 2.789 0.973 0.973 weight 1.000
! 4
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   18 and name   HA) 3.609 1.628 1.628 weight 1.000
! 5
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   22 and name   HA) 4.192 2.197 2.197 weight 1.000
! 6
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HA) 2.062 0.532 0.532 weight 1.000
! 7
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name   HA) 2.713 0.920 0.920 weight 1.000
! 8
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid    5 and name   HA) 3.933 1.934 1.934 weight 1.000
! 9
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name   HA) 2.595 0.842 0.842 weight 1.000
! 10
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name   HA) 2.715 0.922 0.922 weight 1.000
! 11
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   25 and name   HA) 3.718 1.728 1.728 weight 1.000
! 12
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name   HA) 2.140 0.572 0.572 weight 1.000
! 13
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HA) 2.261 0.639 0.639 weight 1.000
! 14
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name   HA) 2.694 0.907 0.907 weight 1.000
! 15
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name   HA) 2.666 0.889 0.889 weight 1.000
! 16
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    9 and name   HA) 3.886 1.887 1.887 weight 1.000
! 17
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name   HA) 2.146 0.576 0.576 weight 1.000
! 18
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   19 and name   HA) 3.532 1.559 1.559 weight 1.000
! 19
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    3 and name   HA) 3.990 1.990 1.990 weight 1.000
! 20
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HA) 3.182 1.265 1.265 weight 1.000
! 21
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HA) 2.761 0.953 0.953 weight 1.000
! 22
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid    7 and name  HA1) 3.224 1.299 1.299 weight 1.000
! 23
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HA1) 2.519 0.793 0.793 weight 1.000
! 24
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name   HA) 2.694 0.907 0.907 weight 1.000
! 25
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HA) 2.105 0.554 0.554 weight 1.000
! 26
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name   HA) 2.791 0.973 0.973 weight 1.000
! 27
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HA) 3.062 1.172 1.172 weight 1.000
! 28
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HA) 4.154 2.157 2.157 weight 1.000
! 29
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HA) 2.080 0.541 0.541 weight 1.000
! 30
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HA) 2.790 0.973 0.973 weight 1.000
! 31
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name   HA) 2.823 0.996 0.996 weight 1.000
! 32
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    2 and name   HA) 3.624 1.641 1.641 weight 1.000
! 33
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name   HA) 2.200 0.605 0.605 weight 1.000
! 34
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name   HA) 2.185 0.597 0.597 weight 1.000
! 35
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name   HA) 2.530 0.800 0.800 weight 1.000
! 36
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HA1) 2.349 0.690 0.690 weight 1.000
! 37
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HA1) 2.638 0.870 0.870 weight 1.000
! 38
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name  HA1) 4.195 2.200 2.200 weight 1.000
! 39
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   16 and name  HA1) 3.553 1.578 1.578 weight 1.000
! 40
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name   HA) 3.220 1.296 1.296 weight 1.000
! 41
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HA2) 2.529 0.800 0.800 weight 1.000
! 42
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HA2) 3.017 1.138 1.138 weight 1.000
! 43
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   11 and name   HA) 2.883 1.039 1.039 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   11 and name   HA)
! 44
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   11 and name   HA) 3.700 1.711 1.711 weight 1.000
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   11 and name   HA)
! 45
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name   HA) 2.205 0.608 0.608 weight 1.000
! 46
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HA) 3.014 1.136 1.136 weight 1.000
! 47
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HA) 2.014 0.507 0.507 weight 1.000
! 48
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HA1) 2.670 0.891 0.891 weight 1.000
! 49
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HA1) 2.501 0.782 0.782 weight 1.000
! 50
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HA) 2.705 0.914 0.914 weight 1.000
! 51
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   13 and name   HA) 3.152 1.242 1.242 weight 1.000
! 52
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid   13 and name   HA) 3.038 1.153 1.153 weight 1.000
! 53
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   13 and name   HA) 3.222 1.298 1.298 weight 1.000
! 54
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HA1) 2.641 0.872 0.872 weight 1.000
! 55
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name  HA1) 3.165 1.252 1.252 weight 1.000
! 56
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   10 and name   HA) 3.793 1.799 1.799 weight 1.000
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   10 and name   HA)
! 57
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name   HA) 2.518 0.793 0.793 weight 1.000
! 58
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   10 and name   HA) 3.905 1.906 1.906 weight 1.000
! 59
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   10 and name   HA) 3.945 1.945 1.945 weight 1.000
! 60
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   10 and name   HA) 2.549 0.812 0.812 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   10 and name   HA)
! 61
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB1) 3.723 1.732 1.732 weight 1.000
! 62
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HB) 2.818 0.993 0.993 weight 1.000
! 63
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name   HB) 2.818 0.993 0.993 weight 1.000
! 64
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   26 and name  HA2) 2.592 0.840 0.840 weight 1.000
! 65
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   26 and name  HA2) 3.191 1.273 1.273 weight 1.000
! 66
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    4 and name  HB2) 3.788 1.794 1.794 weight 1.000
! 67
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HA) 2.596 0.842 0.842 weight 1.000
! 68
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid   14 and name   HA) 3.400 1.445 1.445 weight 1.000
! 69
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   16 and name  HA2) 3.984 1.984 1.984 weight 1.000
! 70
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   16 and name  HA2) 4.222 2.228 2.228 weight 1.000
! 71
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name  HA2) 2.383 0.710 0.710 weight 1.000
! 72
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   16 and name  HA2) 2.269 0.644 0.644 weight 1.000
! 73
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    8 and name  HA2) 2.186 0.597 0.597 weight 1.000
! 74
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HA2) 2.358 0.695 0.695 weight 1.000
! 75
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   21 and name  HA1) 2.247 0.631 0.631 weight 1.000
! 76
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid   21 and name  HA1) 4.015 2.015 2.015 weight 1.000
! 77
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   21 and name  HA1) 3.050 1.163 1.163 weight 1.000
! 78
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB2) 2.859 1.022 1.022 weight 1.000
! 79
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB2) 3.223 1.298 1.298 weight 1.000
! 80
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name  HB1) 2.056 0.528 0.528 weight 1.000
! 81
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   12 and name  HB1) 2.332 0.680 0.680 weight 1.000
! 82
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   13 and name  HD1) 3.975 1.975 1.975 weight 1.000
! 83
assign (segid "   A" and resid   13 and name   HE) (segid "   A" and resid   13 and name  HD1) 2.638 0.870 0.870 weight 1.000
! 84
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name  HB2) 2.935 1.077 1.077 weight 1.000
! 85
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB2) 3.357 1.409 1.409 weight 1.000
! 86
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid    5 and name  HB1) 4.152 2.155 2.155 weight 1.000
! 87
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid    5 and name  HB1) 4.020 2.020 2.020 weight 1.000
! 88
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid    5 and name  HB1) 3.764 1.771 1.771 weight 1.000
! 89
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HB1) 2.863 1.024 1.024 weight 1.000
! 90
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HB1) 2.926 1.070 1.070 weight 1.000
! 91
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.847 1.013 1.013 weight 1.000
! 92
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   10 and name  HB2) 2.311 0.668 0.668 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   10 and name  HB2)
! 93
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   10 and name  HB2) 3.491 1.524 1.524 weight 1.000
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   10 and name  HB2)
! 94
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   25 and name  HB1) 3.235 1.308 1.308 weight 1.000
! 95
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB1) 2.751 0.946 0.946 weight 1.000
! 96
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   25 and name  HB1) 3.054 1.166 1.166 weight 1.000
! 97
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid   18 and name  HB1) 4.190 2.195 2.195 weight 1.000
! 98
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB2) 3.376 1.424 1.424 weight 1.000
! 99
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   10 and name  HB1) 3.559 1.583 1.583 weight 1.000
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   10 and name  HB1)
! 100
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB1) 2.324 0.675 0.675 weight 1.000
! 101
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HB1) 2.416 0.730 0.730 weight 1.000
! 102
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   10 and name  HB1) 2.294 0.658 0.658 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   10 and name  HB1)
! 103
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name  HB2) 3.477 1.511 1.511 weight 1.000
! 104
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   18 and name  HB2) 2.309 0.666 0.666 weight 1.000
! 105
assign (segid "   A" and resid   13 and name   HE) (segid "   A" and resid   13 and name  HD2) 2.361 0.697 0.697 weight 1.000
! 106
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB1) 2.647 0.876 0.876 weight 1.000
! 107
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid    9 and name  HB1) 2.599 0.845 0.845 weight 1.000
! 108
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    2 and name  HB1) 2.497 0.780 0.780 weight 1.000
! 109
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    2 and name  HB1) 3.966 1.966 1.966 weight 1.000
! 110
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   20 and name  HB1) 3.186 1.269 1.269 weight 1.000
! 111
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   20 and name  HB1) 3.123 1.219 1.219 weight 1.000
! 112
assign (segid "   A" and resid   20 and name HD21) (segid "   A" and resid   20 and name  HB1) 3.575 1.598 1.598 weight 1.000
! 113
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   20 and name  HB1) 3.664 1.678 1.678 weight 1.000
! 114
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid    5 and name  HB2) 4.077 2.078 2.078 weight 1.000
! 115
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name  HB2) 2.387 0.712 0.712 weight 1.000
! 116
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.380 1.428 1.428 weight 1.000
! 117
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    5 and name  HB2) 3.250 1.320 1.320 weight 1.000
! 118
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB1) 2.345 0.687 0.687 weight 1.000
! 119
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   11 and name  HB1) 3.775 1.781 1.781 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   11 and name  HB1)
! 120
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HB2) 3.744 1.752 1.752 weight 1.000
! 121
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   11 and name  HB2) 4.168 2.172 2.172 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   11 and name  HB2)
! 122
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.652 0.879 0.879 weight 1.000
! 123
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name  HB2) 2.856 1.020 1.020 weight 1.000
! 124
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   23 and name  HB1) 3.565 1.588 1.588 weight 1.000
! 125
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB1) 2.404 0.722 0.722 weight 1.000
! 126
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HG1) 4.020 2.020 2.020 weight 1.000
! 127
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HG1) 3.448 1.486 1.486 weight 1.000
! 128
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HG2) 3.651 1.666 1.666 weight 1.000
! 129
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HG2) 3.899 1.901 1.901 weight 1.000
! 130
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name   HB) 4.032 2.033 2.033 weight 1.000
! 131
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name   HB) 2.459 0.756 0.756 weight 1.000
! 132
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name   HB) 3.341 1.395 1.395 weight 1.000
! 133
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name   HB) 3.128 1.223 1.223 weight 1.000
! 134
assign (segid "   A" and resid   20 and name HD22) (segid "   A" and resid   19 and name  HB1) 4.213 2.219 2.219 weight 1.000
! 135
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.345 1.398 1.398 weight 1.000
! 136
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB1) 3.009 1.132 1.132 weight 1.000
! 137
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name   HB) 2.310 0.667 0.667 weight 1.000
! 138
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HB) 2.392 0.715 0.715 weight 1.000
! 139
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name   HB) 3.889 1.890 1.890 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name   HB)
! 140
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name   HB) 3.911 1.912 1.912 weight 1.000
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name   HB)
! 141
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   19 and name  HB2) 3.654 1.669 1.669 weight 1.000
! 142
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   19 and name  HB2) 4.058 2.059 2.059 weight 1.000
! 143
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name  HB2) 2.767 0.957 0.957 weight 1.000
! 144
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HB2) 2.707 0.916 0.916 weight 1.000
! 145
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name  HB1) 3.952 1.953 1.953 weight 1.000
! 146
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB1) 2.391 0.715 0.715 weight 1.000
! 147
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HB1) 2.517 0.792 0.792 weight 1.000
! 148
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   22 and name  HB2) 4.179 2.183 2.183 weight 1.000
! 149
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name  HB2) 2.901 1.052 1.052 weight 1.000
! 150
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name  HB1) 2.672 0.892 0.892 weight 1.000
! 151
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HB1) 3.086 1.190 1.190 weight 1.000
! 152
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   22 and name  HB1) 3.945 1.945 1.945 weight 1.000
! 153
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HG2) 3.526 1.554 1.554 weight 1.000
! 154
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HG2) 2.769 0.958 0.958 weight 1.000
! 155
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name  HG2) 4.208 2.213 2.213 weight 1.000
! 156
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HG) 4.150 2.152 2.152 weight 1.000
! 157
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name   HG) 2.954 1.091 1.091 weight 1.000
! 158
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HG1) 3.649 1.664 1.664 weight 1.000
! 159
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HG1) 2.926 1.070 1.070 weight 1.000
! 160
assign (segid "   A" and resid   13 and name HH12) (segid "   A" and resid   13 and name  HD1) 3.114 1.212 1.212 weight 1.000
! 161
assign (segid "   A" and resid   13 and name HH12) (segid "   A" and resid   13 and name  HD2) 3.650 1.666 1.666 weight 1.000
! 162
assign (segid "   A" and resid   13 and name HH12) (segid "   A" and resid    6 and name  HB2) 3.589 1.610 1.610 weight 1.000
! 163
assign (segid "   A" and resid   13 and name HH12) (segid "   A" and resid    6 and name   HA) 3.638 1.654 1.654 weight 1.000
! 164
assign (segid "   A" and resid   18 and name   HA) (segid "   A" and resid   23 and name   HA) 2.821 0.995 0.995 weight 1.000
! 165
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   17 and name  HG1) 3.039 1.155 1.155 weight 1.000
! 166
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   17 and name  HG1) 4.020 2.020 2.020 weight 1.000
! 167
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG22) 2.952 1.089 1.089 weight 1.000
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG23)
! 168
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG22) 2.613 0.853 0.853 weight 1.000
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG23)
! 169
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG22) 3.353 1.405 1.405 weight 1.000
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG23)
! 170
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name HD22) 2.908 1.057 1.057 weight 1.000
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name HD23)
! 171
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG12) 3.948 1.948 1.948 weight 1.000
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name HG13)
! 172
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG12) 3.340 1.394 1.394 weight 1.000
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   24 and name HG13)
! 173
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG12) 2.757 0.950 0.950 weight 1.000
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   24 and name HG13)
! 174
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG12) 3.682 1.694 1.694 weight 1.000
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG13)
! 175
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   24 and name HG12) 3.047 1.161 1.161 weight 1.000
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   24 and name HG13)
! 176
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG22) 3.000 1.125 1.125 weight 1.000
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG23)
! 177
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG22) 3.104 1.205 1.205 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG23)
! 178
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG22) 3.842 1.845 1.845 weight 1.000
    or (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG23)
! 179
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG22) 3.460 1.496 1.496 weight 1.000
    or (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG23)
! 180
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG12) 2.426 0.736 0.736 weight 1.000
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   14 and name HG13)
! 181
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG12) 3.190 1.272 1.272 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name HG13)
! 182
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG12) 3.110 1.209 1.209 weight 1.000
    or (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   14 and name HG13)
! 183
assign (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG12) 2.763 0.954 0.954 weight 1.000
    or (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name  HE1) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name  HE2) (segid "   A" and resid   14 and name HG13)
! 184
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   13 and name HH12) 3.429 1.469 1.469 weight 1.000
! 185
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    5 and name   HN) 3.029 1.147 1.147 weight 1.000
! 186
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    5 and name   HN) 3.993 1.993 1.993 weight 1.000
! 187
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid   13 and name   HE) 3.903 1.904 1.904 weight 1.000
! 188
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name   HN) 2.366 0.699 0.699 weight 1.000
! 189
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name   HN) 2.502 0.783 0.783 weight 1.000
! 190
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HD1) 3.222 1.297 1.297 weight 1.000
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HD2)
! 191
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HD1) 2.907 1.056 1.056 weight 1.000
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HD2)
! 192
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   17 and name   HN) 2.740 0.938 0.938 weight 1.000
! 193
assign (segid "   A" and resid   18 and name   HN) (segid "   A" and resid   17 and name   HN) 3.833 1.836 1.836 weight 1.000
! 194
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid   16 and name   HN) 3.708 1.719 1.719 weight 1.000
! 195
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   22 and name   HN) 2.725 0.928 0.928 weight 1.000
! 196
assign (segid "   A" and resid   21 and name   HN) (segid "   A" and resid   22 and name   HN) 2.608 0.851 0.851 weight 1.000
! 197
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   22 and name   HN) 3.880 1.882 1.882 weight 1.000
! 198
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    3 and name   HN) 3.966 1.966 1.966 weight 1.000
! 199
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   11 and name   HN) 2.704 0.914 0.914 weight 1.000
! 200
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name   HN) 3.725 1.735 1.735 weight 1.000
! 201
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   12 and name   HN) 3.958 1.958 1.958 weight 1.000
! 202
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    8 and name   HN) 3.440 1.479 1.479 weight 1.000
! 203
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name   HN) 3.800 1.805 1.805 weight 1.000
! 204
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   16 and name   HN) 3.573 1.596 1.596 weight 1.000
! 205
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name   HN) 3.835 1.839 1.839 weight 1.000
! 206
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name   HN) 2.720 0.925 0.925 weight 1.000
! 207
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name   HN) 2.565 0.823 0.823 weight 1.000
! 208
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   24 and name   HN) 3.395 1.441 1.441 weight 1.000
! 209
assign (segid "   A" and resid   20 and name   HN) (segid "   A" and resid   21 and name   HN) 2.827 0.999 0.999 weight 1.000
! 210
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid   18 and name   HA) 3.862 1.864 1.864 weight 1.000
! 211
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   18 and name   HA) 2.550 0.813 0.813 weight 1.000
! 212
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   18 and name   HA) 2.746 0.942 0.942 weight 1.000
! 213
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   18 and name   HA) 3.796 1.801 1.801 weight 1.000
! 214
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   18 and name   HA) 3.882 1.884 1.884 weight 1.000
! 215
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   22 and name   HA) 3.621 1.639 1.639 weight 1.000
! 216
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid    5 and name   HA) 3.723 1.733 1.733 weight 1.000
! 217
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    5 and name   HA) 2.461 0.757 0.757 weight 1.000
! 218
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid    5 and name   HA) 2.486 0.773 0.773 weight 1.000
! 219
assign (segid "   A" and resid   16 and name  HA1) (segid "   A" and resid   25 and name   HA) 3.261 1.329 1.329 weight 1.000
! 220
assign (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   25 and name   HA) 3.043 1.157 1.157 weight 1.000
! 221
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name   HA) 2.626 0.862 0.862 weight 1.000
! 222
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   25 and name   HA) 2.509 0.787 0.787 weight 1.000
! 223
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name   HA) 2.799 0.979 0.979 weight 1.000
! 224
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name   HA) 2.784 0.969 0.969 weight 1.000
! 225
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    5 and name   HA) 3.800 1.805 1.805 weight 1.000
! 226
assign (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   22 and name   HA) 2.857 1.020 1.020 weight 1.000
! 227
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid    9 and name   HA) 3.759 1.767 1.767 weight 1.000
! 228
assign (segid "   A" and resid    7 and name  HA2) (segid "   A" and resid    7 and name  HA1) 1.894 0.449 0.449 weight 1.000
! 229
assign (segid "   A" and resid    4 and name  HB1) (segid "   A" and resid    4 and name   HA) 2.442 0.746 0.746 weight 1.000
! 230
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    4 and name   HA) 2.512 0.789 0.789 weight 1.000
! 231
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   17 and name   HA) 2.529 0.800 0.800 weight 1.000
! 232
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid   23 and name   HA) 3.513 1.543 1.543 weight 1.000
! 233
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid    9 and name   HA) 2.463 0.758 0.758 weight 1.000
! 234
assign (segid "   A" and resid    9 and name  HB1) (segid "   A" and resid    9 and name   HA) 2.476 0.766 0.766 weight 1.000
! 235
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   23 and name   HA) 2.632 0.866 0.866 weight 1.000
! 236
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid   23 and name   HA) 2.573 0.827 0.827 weight 1.000
! 237
assign (segid "   A" and resid   20 and name  HB1) (segid "   A" and resid   19 and name   HA) 3.873 1.875 1.875 weight 1.000
! 238
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    3 and name   HA) 4.096 2.097 2.097 weight 1.000
! 239
assign (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   23 and name   HA) 3.799 1.804 1.804 weight 1.000
! 240
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name   HA) 3.186 1.269 1.269 weight 1.000
! 241
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name   HA) 3.161 1.249 1.249 weight 1.000
! 242
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid    7 and name  HA1) 3.508 1.538 1.538 weight 1.000
! 243
assign (segid "   A" and resid   23 and name  HB1) (segid "   A" and resid    7 and name  HA1) 3.633 1.650 1.650 weight 1.000
! 244
assign (segid "   A" and resid    2 and name  HB2) (segid "   A" and resid    2 and name   HA) 2.519 0.793 0.793 weight 1.000
! 245
assign (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    2 and name   HA) 3.003 1.127 1.127 weight 1.000
! 246
assign (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   20 and name   HA) 2.467 0.761 0.761 weight 1.000
! 247
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   19 and name   HA) 2.672 0.892 0.892 weight 1.000
! 248
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   19 and name   HA) 2.780 0.966 0.966 weight 1.000
! 249
assign (segid "   A" and resid    3 and name   HG) (segid "   A" and resid    3 and name   HA) 3.267 1.334 1.334 weight 1.000
! 250
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name   HA) 2.608 0.850 0.850 weight 1.000
! 251
assign (segid "   A" and resid   15 and name  HG1) (segid "   A" and resid   15 and name   HA) 3.317 1.376 1.376 weight 1.000
! 252
assign (segid "   A" and resid    3 and name   HG) (segid "   A" and resid    2 and name   HA) 3.696 1.707 1.707 weight 1.000
! 253
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name   HA) 3.476 1.511 1.511 weight 1.000
! 254
assign (segid "   A" and resid   15 and name  HG2) (segid "   A" and resid   15 and name   HA) 3.170 1.256 1.256 weight 1.000
! 255
assign (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   16 and name  HA1) 2.011 0.505 0.505 weight 1.000
! 256
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   16 and name  HA1) 3.830 1.834 1.834 weight 1.000
! 257
assign (segid "   A" and resid   14 and name HG22) (segid "   A" and resid   15 and name   HA) 3.172 1.257 1.257 weight 1.000
    or (segid "   A" and resid   14 and name HG21) (segid "   A" and resid   15 and name   HA)
    or (segid "   A" and resid   14 and name HG23) (segid "   A" and resid   15 and name   HA)
! 258
assign (segid "   A" and resid    3 and name HD12) (segid "   A" and resid    3 and name   HA) 2.501 0.782 0.782 weight 1.000
    or (segid "   A" and resid    3 and name HD11) (segid "   A" and resid    3 and name   HA)
    or (segid "   A" and resid    3 and name HD13) (segid "   A" and resid    3 and name   HA)
! 259
assign (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid   23 and name  HB1) 3.413 1.456 1.456 weight 1.000
! 260
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   17 and name  HG1) 2.378 0.707 0.707 weight 1.000
! 261
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG22) 3.925 1.926 1.926 weight 1.000
    or (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG23)
! 262
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name HD22) 2.464 0.759 0.759 weight 1.000
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name HD23)
! 263
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG12) 2.630 0.865 0.865 weight 1.000
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG13)
! 264
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG22) 2.513 0.789 0.789 weight 1.000
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG23)
! 265
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG12) 2.931 1.074 1.074 weight 1.000
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG13)
! 266
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG12) 2.411 0.727 0.727 weight 1.000
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name HG13)
! 267
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   19 and name  HG1) 3.812 1.816 1.816 weight 1.000
! 268
assign (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name   HB) 2.704 0.914 0.914 weight 1.000
! 269
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name   HB) 3.447 1.485 1.485 weight 1.000
! 270
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name   HB) 2.944 1.083 1.083 weight 1.000
! 271
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   14 and name   HB) 2.707 0.916 0.916 weight 1.000
! 272
assign (segid "   A" and resid    7 and name  HA2) (segid "   A" and resid    6 and name  HB2) 3.807 1.811 1.811 weight 1.000
! 273
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name   HG) 3.570 1.593 1.593 weight 1.000
! 274
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name   HG) 3.787 1.793 1.793 weight 1.000
! 275
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   15 and name  HG1) 3.604 1.623 1.623 weight 1.000
! 276
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG22) 2.588 0.837 0.837 weight 1.000
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG23)
! 277
assign (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG12) 2.408 0.725 0.725 weight 1.000
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   14 and name   HB) (segid "   A" and resid   14 and name HG13)
! 278
assign (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    1 and name HD22) 2.358 0.695 0.695 weight 1.000
    or (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    1 and name HD23)
! 279
assign (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    3 and name HD12) 3.113 1.212 1.212 weight 1.000
    or (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    3 and name HD11)
    or (segid "   A" and resid    1 and name   HG) (segid "   A" and resid    3 and name HD13)
! 280
assign (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   24 and name HG22) 2.820 0.994 0.994 weight 1.000
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   19 and name  HB1) (segid "   A" and resid   24 and name HG23)
! 281
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   24 and name HG22) 2.730 0.931 0.931 weight 1.000
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   24 and name HG23)
! 282
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   24 and name HG22) 3.365 1.415 1.415 weight 1.000
    or (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   24 and name HG23)
! 283
assign (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG22) 2.401 0.720 0.720 weight 1.000
    or (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG23)
! 284
assign (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG12) 2.346 0.688 0.688 weight 1.000
    or (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   24 and name   HB) (segid "   A" and resid   24 and name HG13)
! 285
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   24 and name HG22) 3.401 1.446 1.446 weight 1.000
    or (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   24 and name HG23)
! 286
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   17 and name  HG1) 3.371 1.420 1.420 weight 1.000
! 287
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   17 and name  HG1) 3.429 1.470 1.470 weight 1.000
! 288
assign (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid   13 and name  HB2) 2.618 0.857 0.857 weight 1.000
! 289
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   15 and name  HG2) 4.130 2.132 2.132 weight 1.000
! 290
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid    1 and name HD22) 4.328 2.342 2.342 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid    1 and name HD23)
! 291
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG22) 4.188 2.192 2.192 weight 1.000
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG23)
! 292
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   15 and name  HG1) 4.301 2.312 2.312 weight 1.000
! 293
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    1 and name HD22) 4.162 2.165 2.165 weight 1.000
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid    1 and name HD23)
! 294
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   11 and name  HB2) 4.035 2.035 2.035 weight 1.000
! 295
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name  HG1) 2.298 0.660 0.660 weight 1.000
! 296
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name  HG2) 2.522 0.795 0.795 weight 1.000
! 297
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name  HB1) 2.803 0.982 0.982 weight 1.000
! 298
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HB1) 2.788 0.971 0.971 weight 1.000
! 299
assign (segid "   A" and resid   19 and name  HG1) (segid "   A" and resid   19 and name  HB2) 2.929 1.072 1.072 weight 1.000
! 300
assign (segid "   A" and resid   19 and name  HG2) (segid "   A" and resid   19 and name  HB2) 2.662 0.886 0.886 weight 1.000
! 301
assign (segid "   A" and resid    5 and name  HB1) (segid "   A" and resid    5 and name  HB2) 1.963 0.482 0.482 weight 1.000
! 302
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name  HB1) 2.577 0.830 0.830 weight 1.000
! 303
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid    2 and name  HB1) 2.454 0.753 0.753 weight 1.000
! 304
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name  HB1) 2.741 0.939 0.939 weight 1.000
! 305
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   11 and name  HB2) 2.561 0.820 0.820 weight 1.000
! 306
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   25 and name  HB1) 2.948 1.087 1.087 weight 1.000
! 307
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   10 and name  HB2) 2.437 0.742 0.742 weight 1.000
! 308
assign (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   25 and name  HB1) 3.035 1.152 1.152 weight 1.000
! 309
assign (segid "   A" and resid   25 and name  HB2) (segid "   A" and resid   25 and name  HB1) 1.949 0.475 0.475 weight 1.000
! 310
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid    2 and name  HB2) 3.088 1.192 1.192 weight 1.000
! 311
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   25 and name  HB2) 2.994 1.121 1.121 weight 1.000
! 312
assign (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    1 and name HD22) 4.146 2.148 2.148 weight 1.000
    or (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    2 and name  HB1) (segid "   A" and resid    1 and name HD23)
! 313
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   14 and name HG12) 4.119 2.121 2.121 weight 1.000
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   14 and name HG13)
! 314
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   14 and name HG12) 4.205 2.210 2.210 weight 1.000
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   14 and name HG13)
! 315
assign (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   25 and name  HB2) 3.777 1.784 1.784 weight 1.000
! 316
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   15 and name  HG1) 4.057 2.058 2.058 weight 1.000
! 317
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG22) 3.628 1.645 1.645 weight 1.000
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG23)
! 318
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG12) 3.920 1.921 1.921 weight 1.000
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   14 and name HG13)
! 319
assign (segid "   A" and resid   15 and name  HG2) (segid "   A" and resid   14 and name HG22) 3.934 1.934 1.934 weight 1.000
    or (segid "   A" and resid   15 and name  HG2) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   15 and name  HG2) (segid "   A" and resid   14 and name HG23)
! 320
assign (segid "   A" and resid   25 and name  HB1) (segid "   A" and resid   16 and name  HA1) 3.259 1.328 1.328 weight 1.000
! 321
assign (segid "   A" and resid   19 and name  HB2) (segid "   A" and resid   18 and name   HA) 4.075 2.075 2.075 weight 1.000
! 322
assign (segid "   A" and resid   21 and name  HA1) (segid "   A" and resid   21 and name  HA2) 2.012 0.506 0.506 weight 1.000
! 323
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    7 and name  HA1) 2.655 0.881 0.881 weight 1.000
! 324
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name   HA) 2.551 0.813 0.813 weight 1.000
! 325
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    9 and name  HB2) 3.297 1.359 1.359 weight 1.000
! 326
assign (segid "   A" and resid   25 and name   HN) (segid "   A" and resid   26 and name   HN) 2.976 1.107 1.107 weight 1.000
# Restraints file 2: ambig.tbl
! 1
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name   HA) 3.982 1.982 1.982 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   18 and name   HA)
! 2
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    5 and name   HA) 2.171 0.589 0.589 weight 1.000
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name   HA)
! 3
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name   HA) 3.663 1.677 1.677 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    9 and name   HA)
! 4
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   19 and name   HA) 2.630 0.865 0.865 weight 1.000
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   23 and name   HA)
! 5
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    4 and name   HA) 2.694 0.907 0.907 weight 1.000
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name   HA)
! 6
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   11 and name   HA) 2.505 0.784 0.784 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HA)
! 7
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   12 and name   HA) 2.983 1.112 1.112 weight 1.000
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   11 and name   HA)
! 8
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   11 and name   HA) 3.204 1.283 1.283 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   12 and name   HA)
! 9
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   11 and name   HA) 2.434 0.740 0.740 weight 1.000
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   12 and name   HA)
! 10
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name   HA) 3.893 1.894 1.894 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name   HA)
! 11
assign (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   12 and name   HA) 3.782 1.788 1.788 weight 1.000
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   24 and name   HA)
! 12
assign (segid "   A" and resid   13 and name   HE) (segid "   A" and resid   13 and name   HA) 3.517 1.546 1.546 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   13 and name   HA)
! 13
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   10 and name   HA) 2.806 0.984 0.984 weight 1.000
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name   HA)
! 14
assign (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB1) 3.934 1.935 1.935 weight 1.000
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   27 and name  HB2)
! 15
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   14 and name   HA) 3.034 1.151 1.151 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   16 and name  HA2)
! 16
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name   HA) 3.966 1.966 1.966 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   16 and name  HA2)
! 17
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    8 and name  HA2) 2.106 0.554 0.554 weight 1.000
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid    7 and name  HA2)
! 18
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   25 and name  HB2) 3.844 1.847 1.847 weight 1.000
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   25 and name  HB2)
! 19
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name  HB1) 2.379 0.708 0.708 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name  HB2)
! 20
assign (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   12 and name  HB1) 3.891 1.893 1.893 weight 1.000
    or (segid "   A" and resid   14 and name   HN) (segid "   A" and resid   12 and name  HB2)
! 21
assign (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   12 and name  HB2) 4.182 2.186 2.186 weight 1.000
    or (segid "   A" and resid    8 and name   HN) (segid "   A" and resid   12 and name  HB1)
! 22
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid    2 and name  HB2) 4.075 2.075 2.075 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid    2 and name  HB2)
! 23
assign (segid "   A" and resid    6 and name   HE) (segid "   A" and resid    6 and name  HD2) 3.369 1.419 1.419 weight 1.000
    or (segid "   A" and resid    6 and name   HE) (segid "   A" and resid    6 and name  HD1)
! 24
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HD1) 4.051 2.051 2.051 weight 1.000
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HD2)
! 25
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.003 0.501 0.501 weight 1.000
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   10 and name  HB2)
! 26
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name  HB2) 2.677 0.896 0.896 weight 1.000
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   10 and name  HB2)
! 27
assign (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   18 and name  HB1) 4.193 2.197 2.197 weight 1.000
    or (segid "   A" and resid   24 and name   HN) (segid "   A" and resid   25 and name  HB1)
! 28
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.728 1.738 1.738 weight 1.000
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   25 and name  HB1)
! 29
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.239 1.312 1.312 weight 1.000
    or (segid "   A" and resid   26 and name   HN) (segid "   A" and resid   25 and name  HB1)
! 30
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid   18 and name  HB1) 3.480 1.514 1.514 weight 1.000
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   20 and name  HB2)
! 31
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   10 and name  HB1) 3.961 1.961 1.961 weight 1.000
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   15 and name  HE2)
! 32
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid    9 and name  HB1) 3.229 1.303 1.303 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid    2 and name  HB1)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HD2)
! 33
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid    9 and name  HB1) 3.767 1.774 1.774 weight 1.000
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid    2 and name  HB1)
! 34
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid    5 and name  HB2) 2.348 0.689 0.689 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   23 and name  HB2)
! 35
assign (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name   HB) 3.740 1.748 1.748 weight 1.000
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name   HB)
! 36
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB1) 2.712 0.920 0.920 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HB2)
! 37
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   19 and name  HB2) 4.222 2.228 2.228 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid    6 and name  HB2)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   19 and name  HB2)
! 38
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HB2) 3.159 1.247 1.247 weight 1.000
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name  HB1)
! 39
assign (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   13 and name  HG2) 3.938 1.938 1.938 weight 1.000
    or (segid "   A" and resid   10 and name   HN) (segid "   A" and resid   13 and name  HG1)
! 40
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HG1) 2.152 0.579 0.579 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name  HG2)
! 41
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name  HG2) 3.408 1.452 1.452 weight 1.000
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   13 and name  HG1)
! 42
assign (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   13 and name  HG2) 3.829 1.833 1.833 weight 1.000
    or (segid "   A" and resid    9 and name   HN) (segid "   A" and resid   13 and name  HG1)
! 43
assign (segid "   A" and resid   13 and name   HE) (segid "   A" and resid   13 and name  HG1) 2.789 0.972 0.972 weight 1.000
    or (segid "   A" and resid   13 and name   HE) (segid "   A" and resid   13 and name  HG2)
! 44
assign (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   13 and name  HG2) 4.000 2.000 2.000 weight 1.000
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   13 and name  HG2)
    or (segid "   A" and resid   10 and name  HD1) (segid "   A" and resid   13 and name  HG1)
    or (segid "   A" and resid   10 and name  HD2) (segid "   A" and resid   13 and name  HG1)
! 45
assign (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HG2) 3.333 1.389 1.389 weight 1.000
    or (segid "   A" and resid    7 and name   HN) (segid "   A" and resid    6 and name  HG1)
! 46
assign (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HG1) 2.650 0.878 0.878 weight 1.000
    or (segid "   A" and resid    6 and name   HN) (segid "   A" and resid    6 and name  HG2)
! 47
assign (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HD1) 3.675 1.688 1.688 weight 1.000
    or (segid "   A" and resid   15 and name   HN) (segid "   A" and resid   15 and name  HB2)
! 48
assign (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB1) 2.608 0.850 0.850 weight 1.000
    or (segid "   A" and resid    4 and name   HN) (segid "   A" and resid    3 and name  HB2)
! 49
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB1) 2.421 0.732 0.732 weight 1.000
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name  HB2)
! 50
assign (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    3 and name  HB1) 4.132 2.134 2.134 weight 1.000
    or (segid "   A" and resid    5 and name   HN) (segid "   A" and resid    3 and name  HB2)
! 51
assign (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    1 and name   HG) 3.374 1.423 1.423 weight 1.000
    or (segid "   A" and resid    2 and name   HN) (segid "   A" and resid    3 and name   HG)
! 52
assign (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HG1) 3.342 1.396 1.396 weight 1.000
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   22 and name  HG2)
! 53
assign (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name  HG1) 3.152 1.242 1.242 weight 1.000
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   22 and name  HG2)
! 54
assign (segid "   A" and resid   13 and name HH12) (segid "   A" and resid   13 and name  HG1) 3.961 1.961 1.961 weight 1.000
    or (segid "   A" and resid   13 and name HH12) (segid "   A" and resid   13 and name  HG2)
! 55
assign (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG22) 3.407 1.451 1.451 weight 1.000
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   17 and name   HN) (segid "   A" and resid   24 and name HG23)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name HG22)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   23 and name   HN) (segid "   A" and resid   24 and name HG23)
! 56
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    1 and name HD22) 3.688 1.701 1.701 weight 1.000
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   24 and name HG22)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   22 and name   HN) (segid "   A" and resid   24 and name HG23)
! 57
assign (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD22) 3.490 1.522 1.522 weight 1.000
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD21)
    or (segid "   A" and resid    3 and name   HN) (segid "   A" and resid    3 and name HD23)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   24 and name HG12)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   27 and name   HN) (segid "   A" and resid   24 and name HG13)
! 58
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name HG12) 3.582 1.604 1.604 weight 1.000
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   14 and name HG13)
! 59
assign (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   13 and name   HE) 3.444 1.483 1.483 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   15 and name   HN)
! 60
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name   HN) 3.731 1.740 1.740 weight 1.000
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name   HN)
! 61
assign (segid "   A" and resid   11 and name   HN) (segid "   A" and resid   12 and name   HN) 2.298 0.660 0.660 weight 1.000
    or (segid "   A" and resid   13 and name   HN) (segid "   A" and resid   12 and name   HN)
! 62
assign (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   18 and name   HN) 3.491 1.523 1.523 weight 1.000
    or (segid "   A" and resid   19 and name   HN) (segid "   A" and resid   21 and name   HN)
! 63
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   25 and name   HA) 3.362 1.412 1.412 weight 1.000
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   25 and name   HA)
! 64
assign (segid "   A" and resid   15 and name  HE2) (segid "   A" and resid   25 and name   HA) 3.858 1.861 1.861 weight 1.000
    or (segid "   A" and resid   15 and name  HE1) (segid "   A" and resid   25 and name   HA)
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid    5 and name   HA)
! 65
assign (segid "   A" and resid    8 and name  HA2) (segid "   A" and resid    9 and name   HA) 3.540 1.566 1.566 weight 1.000
    or (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   23 and name   HA)
! 66
assign (segid "   A" and resid   14 and name   HA) (segid "   A" and resid   15 and name   HA) 3.947 1.947 1.947 weight 1.000
    or (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   15 and name   HA)
! 67
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid    9 and name   HA) 3.643 1.659 1.659 weight 1.000
    or (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid    9 and name   HA)
    or (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid    9 and name   HA)
! 68
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid    9 and name   HA) 3.604 1.623 1.623 weight 1.000
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   19 and name   HA)
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   23 and name   HA)
! 69
assign (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   19 and name   HA) 3.397 1.443 1.443 weight 1.000
    or (segid "   A" and resid   18 and name  HB1) (segid "   A" and resid   23 and name   HA)
    or (segid "   A" and resid   20 and name  HB2) (segid "   A" and resid   19 and name   HA)
! 70
assign (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid    7 and name  HA1) 4.049 2.050 2.050 weight 1.000
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid    7 and name  HA1)
! 71
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name   HA) 3.486 1.519 1.519 weight 1.000
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name   HA)
! 72
assign (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid    2 and name   HA) 3.653 1.668 1.668 weight 1.000
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid   17 and name   HA)
! 73
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name   HA) 2.340 0.684 0.684 weight 1.000
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name   HA)
! 74
assign (segid "   A" and resid   22 and name  HD2) (segid "   A" and resid   23 and name   HA) 3.884 1.886 1.886 weight 1.000
    or (segid "   A" and resid   22 and name  HD1) (segid "   A" and resid   23 and name   HA)
! 75
assign (segid "   A" and resid   15 and name  HB1) (segid "   A" and resid   15 and name   HA) 2.264 0.641 0.641 weight 1.000
    or (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name   HA)
! 76
assign (segid "   A" and resid    6 and name  HG1) (segid "   A" and resid    6 and name   HA) 2.825 0.998 0.998 weight 1.000
    or (segid "   A" and resid    6 and name  HG2) (segid "   A" and resid    6 and name   HA)
! 77
assign (segid "   A" and resid   22 and name  HG2) (segid "   A" and resid   22 and name   HA) 3.186 1.269 1.269 weight 1.000
    or (segid "   A" and resid   22 and name  HG1) (segid "   A" and resid   22 and name   HA)
! 78
assign (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   19 and name   HA) 3.764 1.771 1.771 weight 1.000
    or (segid "   A" and resid   17 and name  HG1) (segid "   A" and resid   23 and name   HA)
! 79
assign (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    2 and name   HA) 3.351 1.404 1.404 weight 1.000
    or (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    2 and name   HA)
! 80
assign (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    2 and name   HA) 3.718 1.728 1.728 weight 1.000
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    2 and name   HA)
! 81
assign (segid "   A" and resid   10 and name  HB1) (segid "   A" and resid   11 and name  HB1) 3.403 1.448 1.448 weight 1.000
    or (segid "   A" and resid   18 and name  HB2) (segid "   A" and resid    5 and name  HB2)
! 82
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name HD22) 2.420 0.732 0.732 weight 1.000
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG22)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   24 and name   HA) (segid "   A" and resid   24 and name HG23)
! 83
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   14 and name HG22) 3.499 1.531 1.531 weight 1.000
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   14 and name HG23)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG22)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG21)
    or (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   14 and name HG23)
! 84
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   15 and name  HB1) 3.608 1.627 1.627 weight 1.000
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name  HB1)
! 85
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name  HB1) 2.603 0.847 0.847 weight 1.000
    or (segid "   A" and resid    1 and name   HA) (segid "   A" and resid    1 and name  HB2)
! 86
assign (segid "   A" and resid   16 and name  HA2) (segid "   A" and resid   13 and name  HG2) 3.351 1.404 1.404 weight 1.000
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name  HB1)
    or (segid "   A" and resid   14 and name   HA) (segid "   A" and resid    1 and name  HB2)
! 87
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HG2) 2.453 0.752 0.752 weight 1.000
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HG1)
! 88
assign (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   13 and name  HG2) 2.836 1.006 1.006 weight 1.000
    or (segid "   A" and resid   10 and name   HA) (segid "   A" and resid   13 and name  HG1)
! 89
assign (segid "   A" and resid    8 and name  HA2) (segid "   A" and resid   13 and name  HG2) 3.764 1.771 1.771 weight 1.000
    or (segid "   A" and resid    8 and name  HA2) (segid "   A" and resid   13 and name  HG1)
! 90
assign (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    3 and name  HB1) 3.811 1.816 1.816 weight 1.000
    or (segid "   A" and resid    4 and name  HB2) (segid "   A" and resid    3 and name  HB2)
! 91
assign (segid "   A" and resid   11 and name   HA) (segid "   A" and resid   15 and name  HG2) 3.349 1.402 1.402 weight 1.000
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   15 and name  HG2)
! 92
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD22) 2.419 0.732 0.732 weight 1.000
    or (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD21)
    or (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD23)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD22)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD21)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD23)
! 93
assign (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    1 and name HD22) 2.551 0.813 0.813 weight 1.000
    or (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    1 and name HD23)
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name HD22)
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name HD21)
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name HD23)
! 94
assign (segid "   A" and resid   13 and name  HD2) (segid "   A" and resid   13 and name  HG2) 2.477 0.767 0.767 weight 1.000
    or (segid "   A" and resid   13 and name  HD2) (segid "   A" and resid   13 and name  HG1)
! 95
assign (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid   13 and name  HB1) 2.734 0.934 0.934 weight 1.000
    or (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid   13 and name  HB2)
! 96
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HB2) 2.831 1.002 1.002 weight 1.000
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HB2)
! 97
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HB1) 3.001 1.125 1.125 weight 1.000
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HB1)
! 98
assign (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid   13 and name  HG2) 2.450 0.750 0.750 weight 1.000
    or (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid   13 and name  HG1)
! 99
assign (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HG1) 2.489 0.774 0.774 weight 1.000
    or (segid "   A" and resid    6 and name  HD2) (segid "   A" and resid    6 and name  HG2)
    or (segid "   A" and resid    6 and name  HD1) (segid "   A" and resid    6 and name  HG2)
! 100
assign (segid "   A" and resid   15 and name  HE2) (segid "   A" and resid   15 and name  HG2) 3.376 1.425 1.425 weight 1.000
    or (segid "   A" and resid   15 and name  HE1) (segid "   A" and resid   15 and name  HG2)
! 101
assign (segid "   A" and resid   15 and name  HE2) (segid "   A" and resid   15 and name  HG1) 3.406 1.450 1.450 weight 1.000
    or (segid "   A" and resid   15 and name  HE1) (segid "   A" and resid   15 and name  HG1)
! 102
assign (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   22 and name  HD1) 2.530 0.800 0.800 weight 1.000
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   22 and name  HD2)
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   22 and name  HD2)
! 103
assign (segid "   A" and resid   15 and name  HE1) (segid "   A" and resid   15 and name  HD2) 2.497 0.779 0.779 weight 1.000
    or (segid "   A" and resid   15 and name  HE1) (segid "   A" and resid   15 and name  HD1)
    or (segid "   A" and resid   15 and name  HE2) (segid "   A" and resid   15 and name  HD2)
    or (segid "   A" and resid   15 and name  HE2) (segid "   A" and resid   15 and name  HD1)
! 104
assign (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   13 and name  HG2) 4.070 2.070 2.070 weight 1.000
    or (segid "   A" and resid    9 and name  HB2) (segid "   A" and resid   13 and name  HG1)
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   13 and name  HG2)
    or (segid "   A" and resid   10 and name  HB2) (segid "   A" and resid   13 and name  HG1)
! 105
assign (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name HG12) 4.112 2.113 2.113 weight 1.000
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   12 and name   HN) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   16 and name   HN) (segid "   A" and resid   14 and name HG13)
! 106
assign (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG12) 4.026 2.026 2.026 weight 1.000
    or (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   17 and name   HB) (segid "   A" and resid   24 and name HG13)
    or (segid "   A" and resid   26 and name  HA2) (segid "   A" and resid   24 and name HG12)
    or (segid "   A" and resid   26 and name  HA2) (segid "   A" and resid   24 and name HG11)
    or (segid "   A" and resid   26 and name  HA2) (segid "   A" and resid   24 and name HG13)
! 107
assign (segid "   A" and resid   12 and name  HB1) (segid "   A" and resid   23 and name  HB2) 3.622 1.640 1.640 weight 1.000
    or (segid "   A" and resid   12 and name  HB2) (segid "   A" and resid   23 and name  HB2)
    or (segid "   A" and resid   13 and name  HD1) (segid "   A" and resid   23 and name  HB2)
! 108
assign (segid "   A" and resid    8 and name  HA2) (segid "   A" and resid   12 and name  HB1) 3.054 1.166 1.166 weight 1.000
    or (segid "   A" and resid    8 and name  HA2) (segid "   A" and resid   12 and name  HB2)
! 109
assign (segid "   A" and resid    1 and name  HB1) (segid "   A" and resid    1 and name   HG) 2.680 0.898 0.898 weight 1.000
    or (segid "   A" and resid    1 and name  HB2) (segid "   A" and resid    1 and name   HG)
! 110
assign (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name  HG1) 2.467 0.761 0.761 weight 1.000
    or (segid "   A" and resid   22 and name  HB2) (segid "   A" and resid   22 and name  HG2)
! 111
assign (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name  HG1) 2.481 0.769 0.769 weight 1.000
    or (segid "   A" and resid   22 and name  HB1) (segid "   A" and resid   22 and name  HG2)
! 112
assign (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB1) 2.343 0.686 0.686 weight 1.000
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   12 and name  HB2)
! 113
assign (segid "   A" and resid    8 and name  HA1) (segid "   A" and resid   12 and name  HB1) 2.980 1.110 1.110 weight 1.000
    or (segid "   A" and resid    8 and name  HA1) (segid "   A" and resid   12 and name  HB2)
! 114
assign (segid "   A" and resid    8 and name  HA1) (segid "   A" and resid   12 and name  HB1) 2.911 1.060 1.060 weight 1.000
    or (segid "   A" and resid    8 and name  HA1) (segid "   A" and resid   12 and name  HB2)
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   12 and name  HB2)
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HD1)
! 115
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name   HG) 1.884 0.444 0.444 weight 1.000
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name   HG)
! 116
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name  HG2) 2.051 0.526 0.526 weight 1.000
    or (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   15 and name  HG2)
    or (segid "   A" and resid   15 and name  HD1) (segid "   A" and resid   15 and name  HG2)
! 117
assign (segid "   A" and resid   15 and name  HB2) (segid "   A" and resid   15 and name  HG1) 2.333 0.680 0.680 weight 1.000
    or (segid "   A" and resid   15 and name  HD2) (segid "   A" and resid   15 and name  HG1)
    or (segid "   A" and resid   15 and name  HD1) (segid "   A" and resid   15 and name  HG1)
! 118
assign (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name  HG2) 1.948 0.474 0.474 weight 1.000
    or (segid "   A" and resid   13 and name  HB1) (segid "   A" and resid   13 and name  HG1)
    or (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HG2)
    or (segid "   A" and resid   13 and name  HB2) (segid "   A" and resid   13 and name  HG1)
! 119
assign (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name  HG1) 2.182 0.595 0.595 weight 1.000
    or (segid "   A" and resid    6 and name  HB2) (segid "   A" and resid    6 and name  HG2)
! 120
assign (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name  HG1) 2.087 0.545 0.545 weight 1.000
    or (segid "   A" and resid    6 and name  HB1) (segid "   A" and resid    6 and name  HG2)
! 121
assign (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   24 and name HG22) 3.859 1.862 1.862 weight 1.000
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   24 and name HG23)
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   24 and name HG22)
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   24 and name HG21)
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   24 and name HG23)
! 122
assign (segid "   A" and resid    1 and name   HA) (segid "   A" and resid   14 and name   HA) 2.983 1.112 1.112 weight 1.000
    or (segid "   A" and resid   12 and name   HA) (segid "   A" and resid   16 and name  HA2)
! 123
assign (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   22 and name  HG1) 3.586 1.607 1.607 weight 1.000
    or (segid "   A" and resid   22 and name  HE1) (segid "   A" and resid   22 and name  HG2)
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   22 and name  HG1)
    or (segid "   A" and resid   22 and name  HE2) (segid "   A" and resid   22 and name  HG2)
! 124
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   13 and name  HG2) 3.972 1.972 1.972 weight 1.000
    or (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   13 and name  HG1)
! 125
assign (segid "   A" and resid   23 and name  HB2) (segid "   A" and resid   22 and name  HD1) 3.966 1.966 1.966 weight 1.000
    or (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   22 and name  HD1)
    or (segid "   A" and resid    5 and name  HB2) (segid "   A" and resid   22 and name  HD2)
! 126
assign (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD12) 3.812 1.817 1.817 weight 1.000
    or (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD11)
    or (segid "   A" and resid    3 and name  HB1) (segid "   A" and resid    3 and name HD13)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD12)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD11)
    or (segid "   A" and resid    3 and name  HB2) (segid "   A" and resid    3 and name HD13)
! 127
assign (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   14 and name HG12) 3.807 1.812 1.812 weight 1.000
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   13 and name  HG2) (segid "   A" and resid   14 and name HG13)
    or (segid "   A" and resid   13 and name  HG1) (segid "   A" and resid   14 and name HG12)
    or (segid "   A" and resid   13 and name  HG1) (segid "   A" and resid   14 and name HG11)
    or (segid "   A" and resid   13 and name  HG1) (segid "   A" and resid   14 and name HG13)
! 128
assign (segid "   A" and resid    2 and name   HA) (segid "   A" and resid   18 and name   HA) 3.768 1.775 1.775 weight 1.000
    or (segid "   A" and resid   17 and name   HA) (segid "   A" and resid   18 and name   HA)
! 129
assign (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB1) 2.533 0.802 0.802 weight 1.000
    or (segid "   A" and resid   13 and name   HA) (segid "   A" and resid   13 and name  HB2)
# Restraints file 3: hbonds.tbl
! 1
assign (segid "   A" and resid 10  and name   O ) ( segid "   A" and resid  13  and name  HN ) 1.90 0.35 0.35
! 2
assign (segid "   A" and resid 13  and name   O ) ( segid "   A" and resid   2  and name  HN ) 1.90 0.35 0.35
! 3
assign (segid "   A" and resid 17  and name   O ) ( segid "   A" and resid  24  and name  HN ) 1.90 0.35 0.35
! 4
assign (segid "   A" and resid 24  and name   O ) ( segid "   A" and resid  17  and name  HN ) 1.90 0.35 0.35
! 5
assign (segid "   A" and resid 19  and name   O ) ( segid "   A" and resid  22  and name  HN ) 1.90 0.35 0.35
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LEU   1           H1       LEU   1   2.773   1.076   6.131
    2    H2   LEU   1           H2       LEU   1   2.049   1.740   4.757
    3    H3   LEU   1           H3       LEU   1   3.487   2.399   5.357
    4    HA   LEU   1           HA       LEU   1   3.929   1.078   3.411
    5    HB2  LEU   1           HB2      LEU   1   5.617   1.147   5.191
    6    HB3  LEU   1           HB3      LEU   1   4.852  -0.216   5.981
    7    HG   LEU   1           HG       LEU   1   5.407  -1.622   3.996
    8   HD11  LEU   1          HD11      LEU   1   7.139  -0.778   2.448
    9   HD12  LEU   1          HD12      LEU   1   6.947   0.829   3.149
   10   HD13  LEU   1          HD13      LEU   1   5.604   0.073   2.294
   11   HD21  LEU   1          HD21      LEU   1   7.708  -0.275   5.398
   12   HD22  LEU   1          HD22      LEU   1   7.796  -1.804   4.527
   13   HD23  LEU   1          HD23      LEU   1   6.799  -1.671   5.973
   14    H    CYS   2           H        CYS   2   3.321  -0.546   2.146
   15    HA   CYS   2           HA       CYS   2   1.598  -2.628   3.292
   16    HB2  CYS   2           HB2      CYS   2   1.675  -1.598   0.453
   17    HB3  CYS   2           HB3      CYS   2   0.485  -2.699   1.143
   18    H    LEU   3           H        LEU   3   2.352  -4.636   3.241
   19    HA   LEU   3           HA       LEU   3   4.428  -5.293   1.261
   20    HB2  LEU   3           HB2      LEU   3   4.187  -6.292   4.097
   21    HB3  LEU   3           HB3      LEU   3   5.366  -6.862   2.932
   22    HG   LEU   3           HG       LEU   3   5.192  -4.045   4.006
   23   HD11  LEU   3          HD11      LEU   3   7.147  -6.256   4.613
   24   HD12  LEU   3          HD12      LEU   3   5.923  -5.618   5.709
   25   HD13  LEU   3          HD13      LEU   3   7.259  -4.594   5.188
   26   HD21  LEU   3          HD21      LEU   3   7.403  -3.782   2.921
   27   HD22  LEU   3          HD22      LEU   3   6.092  -4.036   1.772
   28   HD23  LEU   3          HD23      LEU   3   7.186  -5.361   2.166
   29    H    SER   4           H        SER   4   2.043  -6.815   3.433
   30    HA   SER   4           HA       SER   4   1.795  -9.024   1.539
   31    HB2  SER   4           HB2      SER   4   0.682  -8.713   4.334
   32    HB3  SER   4           HB3      SER   4   0.608 -10.174   3.348
   33    HG   SER   4           HG       SER   4   2.669  -9.175   4.843
   34    H    CYS   5           H        CYS   5   0.759  -6.659   0.617
   35    HA   CYS   5           HA       CYS   5  -1.993  -7.404   0.206
   36    HB2  CYS   5           HB2      CYS   5  -2.664  -4.946   0.692
   37    HB3  CYS   5           HB3      CYS   5  -2.498  -6.068   2.036
   38    H    ARG   6           H        ARG   6  -2.965  -6.280  -1.564
   39    HA   ARG   6           HA       ARG   6  -0.949  -5.554  -3.542
   40    HB2  ARG   6           HB2      ARG   6  -3.912  -6.058  -3.860
   41    HB3  ARG   6           HB3      ARG   6  -2.764  -5.831  -5.172
   42    HG2  ARG   6           HG2      ARG   6  -1.562  -7.865  -4.367
   43    HG3  ARG   6           HG3      ARG   6  -2.879  -8.117  -3.221
   44    HD2  ARG   6           HD2      ARG   6  -3.332  -9.480  -5.114
   45    HD3  ARG   6           HD3      ARG   6  -4.451  -8.119  -5.178
   46    HE   ARG   6           HE       ARG   6  -2.149  -7.490  -6.669
   47   HH11  ARG   6          HH11      ARG   6  -4.954  -9.577  -6.792
   48   HH12  ARG   6          HH12      ARG   6  -4.965  -9.678  -8.523
   49   HH21  ARG   6          HH21      ARG   6  -2.145  -7.631  -8.948
   50   HH22  ARG   6          HH22      ARG   6  -3.372  -8.561  -9.748
   51    H    GLY   7           H        GLY   7  -1.033  -3.648  -4.750
   52    HA2  GLY   7           HA2      GLY   7  -2.941  -1.602  -4.111
   53    HA3  GLY   7           HA3      GLY   7  -1.371  -1.329  -3.370
   54    H    GLY   8           H        GLY   8  -1.589   0.641  -4.718
   55    HA2  GLY   8           HA2      GLY   8  -1.322   0.356  -7.563
   56    HA3  GLY   8           HA3      GLY   8  -1.248   1.851  -6.651
   57    H    ASP   9           H        ASP   9   0.544   2.805  -7.278
   58    HA   ASP   9           HA       ASP   9   2.865   1.460  -8.173
   59    HB2  ASP   9           HB2      ASP   9   2.267   3.711  -8.947
   60    HB3  ASP   9           HB3      ASP   9   2.498   4.339  -7.322
   61    H    TYR  10           H        TYR  10   5.024   1.599  -7.220
   62    HA   TYR  10           HA       TYR  10   5.273   0.572  -4.707
   63    HB2  TYR  10           HB2      TYR  10   7.117   0.574  -6.275
   64    HB3  TYR  10           HB3      TYR  10   7.225   2.327  -6.193
   65    HD1  TYR  10           HD1      TYR  10   8.575   3.368  -4.587
   66    HD2  TYR  10           HD2      TYR  10   7.602  -0.748  -4.157
   67    HE1  TYR  10           HE1      TYR  10  10.179   3.190  -2.735
   68    HE2  TYR  10           HE2      TYR  10   9.204  -0.940  -2.301
   69    HH   TYR  10           HH       TYR  10  11.200   0.206  -1.461
   70    H    ASP  11           H        ASP  11   5.568   3.993  -5.607
   71    HA   ASP  11           HA       ASP  11   6.161   5.043  -3.102
   72    HB2  ASP  11           HB2      ASP  11   6.270   6.317  -5.213
   73    HB3  ASP  11           HB3      ASP  11   4.516   6.301  -5.302
   74    H    CYS  12           H        CYS  12   3.088   4.158  -4.519
   75    HA   CYS  12           HA       CYS  12   1.444   5.271  -2.481
   76    HB2  CYS  12           HB2      CYS  12   0.453   4.898  -4.618
   77    HB3  CYS  12           HB3      CYS  12   0.979   3.221  -4.644
   78    H    ARG  13           H        ARG  13   3.132   2.259  -2.930
   79    HA   ARG  13           HA       ARG  13   1.666   0.865  -0.871
   80    HB2  ARG  13           HB2      ARG  13   4.265   0.102  -2.212
   81    HB3  ARG  13           HB3      ARG  13   3.230  -0.957  -1.266
   82    HG2  ARG  13           HG2      ARG  13   1.443  -0.636  -2.949
   83    HG3  ARG  13           HG3      ARG  13   2.575   0.313  -3.915
   84    HD2  ARG  13           HD2      ARG  13   4.077  -1.648  -4.007
   85    HD3  ARG  13           HD3      ARG  13   2.871  -2.585  -3.125
   86    HE   ARG  13           HE       ARG  13   1.989  -1.334  -5.600
   87   HH11  ARG  13          HH11      ARG  13   3.158  -4.224  -4.007
   88   HH12  ARG  13          HH12      ARG  13   2.578  -5.287  -5.244
   89   HH21  ARG  13          HH21      ARG  13   1.227  -2.730  -7.227
   90   HH22  ARG  13          HH22      ARG  13   1.485  -4.439  -7.081
   91    H    VAL  14           H        VAL  14   4.400   2.928  -1.045
   92    HA   VAL  14           HA       VAL  14   5.624   2.006   1.380
   93    HB   VAL  14           HB       VAL  14   6.091   4.529  -0.210
   94   HG11  VAL  14          HG11      VAL  14   8.191   4.701   1.047
   95   HG12  VAL  14          HG12      VAL  14   7.713   3.316   2.027
   96   HG13  VAL  14          HG13      VAL  14   6.787   4.816   2.110
   97   HG21  VAL  14          HG21      VAL  14   7.620   1.936  -0.106
   98   HG22  VAL  14          HG22      VAL  14   8.088   3.373  -1.013
   99   HG23  VAL  14          HG23      VAL  14   6.619   2.498  -1.444
  100    H    LYS  15           H        LYS  15   3.734   4.847   0.422
  101    HA   LYS  15           HA       LYS  15   3.578   5.678   3.215
  102    HB2  LYS  15           HB2      LYS  15   2.608   7.756   2.333
  103    HB3  LYS  15           HB3      LYS  15   4.154   7.383   1.586
  104    HG2  LYS  15           HG2      LYS  15   3.114   6.663  -0.419
  105    HG3  LYS  15           HG3      LYS  15   1.518   6.715   0.325
  106    HD2  LYS  15           HD2      LYS  15   1.949   8.642  -1.160
  107    HD3  LYS  15           HD3      LYS  15   1.628   9.116   0.507
  108    HE2  LYS  15           HE2      LYS  15   3.477  10.400  -0.442
  109    HE3  LYS  15           HE3      LYS  15   4.017   9.400   0.902
  110    HZ1  LYS  15           HZ1      LYS  15   5.544   9.348  -0.990
  111    HZ2  LYS  15           HZ2      LYS  15   4.329   8.689  -1.969
  112    HZ3  LYS  15           HZ3      LYS  15   4.920   7.817  -0.644
  113    H    GLY  16           H        GLY  16   1.970   3.515   1.535
  114    HA2  GLY  16           HA2      GLY  16  -0.721   4.428   2.189
  115    HA3  GLY  16           HA3      GLY  16  -0.311   3.023   1.214
  116    H    THR  17           H        THR  17  -2.186   3.154   3.354
  117    HA   THR  17           HA       THR  17  -0.957   1.588   5.476
  118    HB   THR  17           HB       THR  17  -3.378   1.606   6.355
  119    HG1  THR  17           HG1      THR  17  -4.524   2.300   4.600
  120   HG21  THR  17          HG21      THR  17  -1.834   4.189   6.110
  121   HG22  THR  17          HG22      THR  17  -1.608   2.954   7.347
  122   HG23  THR  17          HG23      THR  17  -3.112   3.872   7.284
  123    H    CYS  18           H        CYS  18  -1.142  -0.553   5.627
  124    HA   CYS  18           HA       CYS  18  -2.389  -1.958   3.420
  125    HB2  CYS  18           HB2      CYS  18  -0.107  -2.534   4.230
  126    HB3  CYS  18           HB3      CYS  18  -0.813  -3.045   5.758
  127    H    GLU  19           H        GLU  19  -4.507  -2.346   3.572
  128    HA   GLU  19           HA       GLU  19  -5.503  -3.525   6.070
  129    HB2  GLU  19           HB2      GLU  19  -6.853  -1.323   4.513
  130    HB3  GLU  19           HB3      GLU  19  -7.621  -2.240   5.796
  131    HG2  GLU  19           HG2      GLU  19  -5.834  -1.410   7.337
  132    HG3  GLU  19           HG3      GLU  19  -5.291  -0.359   6.032
  133    H    ASN  20           H        ASN  20  -6.474  -5.367   5.720
  134    HA   ASN  20           HA       ASN  20  -7.678  -7.050   4.800
  135    HB2  ASN  20           HB2      ASN  20  -9.055  -4.753   3.406
  136    HB3  ASN  20           HB3      ASN  20  -9.674  -6.399   3.487
  137   HD21  ASN  20          HD21      ASN  20 -10.499  -7.168   5.423
  138   HD22  ASN  20          HD22      ASN  20 -10.883  -6.117   6.740
  139    H    GLY  21           H        GLY  21  -5.240  -6.602   3.539
  140    HA2  GLY  21           HA2      GLY  21  -4.153  -7.548   1.735
  141    HA3  GLY  21           HA3      GLY  21  -5.723  -7.998   1.084
  142    H    LYS  22           H        LYS  22  -5.671  -4.728   1.822
  143    HA   LYS  22           HA       LYS  22  -4.895  -4.041  -0.929
  144    HB2  LYS  22           HB2      LYS  22  -7.314  -3.145   0.623
  145    HB3  LYS  22           HB3      LYS  22  -6.718  -2.261  -0.770
  146    HG2  LYS  22           HG2      LYS  22  -7.520  -5.160  -0.841
  147    HG3  LYS  22           HG3      LYS  22  -8.599  -3.824  -1.246
  148    HD2  LYS  22           HD2      LYS  22  -5.971  -4.383  -2.622
  149    HD3  LYS  22           HD3      LYS  22  -7.548  -4.890  -3.228
  150    HE2  LYS  22           HE2      LYS  22  -8.253  -2.530  -3.308
  151    HE3  LYS  22           HE3      LYS  22  -6.651  -2.046  -2.754
  152    HZ1  LYS  22           HZ1      LYS  22  -5.703  -2.997  -4.750
  153    HZ2  LYS  22           HZ2      LYS  22  -6.878  -1.851  -5.152
  154    HZ3  LYS  22           HZ3      LYS  22  -7.228  -3.501  -5.276
  155    H    CYS  23           H        CYS  23  -3.617  -2.348  -1.173
  156    HA   CYS  23           HA       CYS  23  -2.701  -0.924   1.185
  157    HB2  CYS  23           HB2      CYS  23  -1.166  -1.782  -0.647
  158    HB3  CYS  23           HB3      CYS  23  -1.828  -0.513  -1.669
  159    H    VAL  24           H        VAL  24  -3.306   1.073   1.732
  160    HA   VAL  24           HA       VAL  24  -4.952   2.587  -0.194
  161    HB   VAL  24           HB       VAL  24  -5.206   2.762   2.800
  162   HG11  VAL  24          HG11      VAL  24  -7.369   3.764   2.294
  163   HG12  VAL  24          HG12      VAL  24  -7.076   3.545   0.570
  164   HG13  VAL  24          HG13      VAL  24  -6.065   4.648   1.501
  165   HG21  VAL  24          HG21      VAL  24  -6.800   1.021   0.927
  166   HG22  VAL  24          HG22      VAL  24  -7.190   1.318   2.619
  167   HG23  VAL  24          HG23      VAL  24  -5.705   0.468   2.194
  168    H    CYS  25           H        CYS  25  -3.573   4.113  -0.950
  169    HA   CYS  25           HA       CYS  25  -1.905   5.541   0.987
  170    HB2  CYS  25           HB2      CYS  25  -0.719   6.417  -1.043
  171    HB3  CYS  25           HB3      CYS  25  -0.608   4.675  -0.822
  172    H    GLY  26           H        GLY  26  -4.132   6.427   1.588
  173    HA2  GLY  26           HA2      GLY  26  -4.356   9.061   0.418
  174    HA3  GLY  26           HA3      GLY  26  -5.763   8.035   0.178
  175    H    SER  27           H        SER  27  -7.076   9.409   1.425
  176    HA   SER  27           HA       SER  27  -6.936   8.871   4.263
  177    HB2  SER  27           HB2      SER  27  -6.910  11.723   3.233
  178    HB3  SER  27           HB3      SER  27  -7.094  11.243   4.919
  179    HG   SER  27           HG       SER  27  -4.921  10.060   3.879
  Start of MODEL    2
    1    H1   LEU   1           H1       LEU   1   1.899   1.323   4.835
    2    H2   LEU   1           H2       LEU   1   3.261   1.632   5.789
    3    H3   LEU   1           H3       LEU   1   2.283   0.294   6.121
    4    HA   LEU   1           HA       LEU   1   3.872   0.680   3.657
    5    HB2  LEU   1           HB2      LEU   1   4.321  -1.018   6.108
    6    HB3  LEU   1           HB3      LEU   1   5.126  -1.325   4.583
    7    HG   LEU   1           HG       LEU   1   5.381   1.253   6.133
    8   HD11  LEU   1          HD11      LEU   1   7.253  -1.107   5.991
    9   HD12  LEU   1          HD12      LEU   1   6.315  -0.609   7.399
   10   HD13  LEU   1          HD13      LEU   1   7.589   0.436   6.776
   11   HD21  LEU   1          HD21      LEU   1   6.916   0.140   3.785
   12   HD22  LEU   1          HD22      LEU   1   7.299   1.629   4.648
   13   HD23  LEU   1          HD23      LEU   1   5.791   1.497   3.744
   14    H    CYS   2           H        CYS   2   3.461  -0.714   2.052
   15    HA   CYS   2           HA       CYS   2   1.450  -2.809   2.566
   16    HB2  CYS   2           HB2      CYS   2   1.972  -1.449  -0.076
   17    HB3  CYS   2           HB3      CYS   2   0.623  -2.493   0.340
   18    H    LEU   3           H        LEU   3   2.905  -4.440   2.989
   19    HA   LEU   3           HA       LEU   3   5.042  -4.956   1.091
   20    HB2  LEU   3           HB2      LEU   3   4.313  -6.232   3.724
   21    HB3  LEU   3           HB3      LEU   3   5.595  -6.835   2.697
   22    HG   LEU   3           HG       LEU   3   6.697  -4.573   2.915
   23   HD11  LEU   3          HD11      LEU   3   4.691  -4.240   5.134
   24   HD12  LEU   3          HD12      LEU   3   4.737  -3.308   3.639
   25   HD13  LEU   3          HD13      LEU   3   6.061  -3.181   4.799
   26   HD21  LEU   3          HD21      LEU   3   7.447  -6.536   4.149
   27   HD22  LEU   3          HD22      LEU   3   6.290  -6.177   5.431
   28   HD23  LEU   3          HD23      LEU   3   7.623  -5.068   5.109
   29    H    SER   4           H        SER   4   2.477  -6.919   2.608
   30    HA   SER   4           HA       SER   4   2.676  -8.860   0.467
   31    HB2  SER   4           HB2      SER   4   0.711  -8.813   2.761
   32    HB3  SER   4           HB3      SER   4   1.171 -10.199   1.776
   33    HG   SER   4           HG       SER   4   3.415  -9.358   2.702
   34    H    CYS   5           H        CYS   5   0.616  -6.229   1.412
   35    HA   CYS   5           HA       CYS   5  -1.541  -7.062  -0.333
   36    HB2  CYS   5           HB2      CYS   5  -2.571  -4.887   0.489
   37    HB3  CYS   5           HB3      CYS   5  -2.280  -6.125   1.709
   38    H    ARG   6           H        ARG   6  -2.128  -6.110  -2.199
   39    HA   ARG   6           HA       ARG   6  -0.279  -4.108  -3.312
   40    HB2  ARG   6           HB2      ARG   6  -1.965  -6.205  -4.686
   41    HB3  ARG   6           HB3      ARG   6  -1.145  -4.914  -5.545
   42    HG2  ARG   6           HG2      ARG   6   0.274  -6.727  -5.774
   43    HG3  ARG   6           HG3      ARG   6   0.992  -5.805  -4.457
   44    HD2  ARG   6           HD2      ARG   6   0.979  -8.191  -3.954
   45    HD3  ARG   6           HD3      ARG   6  -0.050  -7.301  -2.833
   46    HE   ARG   6           HE       ARG   6  -1.724  -8.130  -4.848
   47   HH11  ARG   6          HH11      ARG   6   0.420  -9.702  -2.570
   48   HH12  ARG   6          HH12      ARG   6  -0.527 -11.151  -2.492
   49   HH21  ARG   6          HH21      ARG   6  -2.984 -10.024  -4.725
   50   HH22  ARG   6          HH22      ARG   6  -2.458 -11.340  -3.728
   51    H    GLY   7           H        GLY   7  -1.706  -3.156  -5.386
   52    HA2  GLY   7           HA2      GLY   7  -3.953  -2.261  -5.842
   53    HA3  GLY   7           HA3      GLY   7  -4.123  -2.035  -4.105
   54    H    GLY   8           H        GLY   8  -1.274  -1.351  -6.008
   55    HA2  GLY   8           HA2      GLY   8  -1.430   1.248  -6.667
   56    HA3  GLY   8           HA3      GLY   8  -1.161   1.321  -4.931
   57    H    ASP   9           H        ASP   9   0.626   2.313  -6.901
   58    HA   ASP   9           HA       ASP   9   2.708   0.398  -7.345
   59    HB2  ASP   9           HB2      ASP   9   2.644   3.393  -7.712
   60    HB3  ASP   9           HB3      ASP   9   4.007   2.377  -8.162
   61    H    TYR  10           H        TYR  10   5.046   1.329  -6.786
   62    HA   TYR  10           HA       TYR  10   5.500   0.818  -4.119
   63    HB2  TYR  10           HB2      TYR  10   7.263   0.767  -5.817
   64    HB3  TYR  10           HB3      TYR  10   7.172   2.517  -5.975
   65    HD1  TYR  10           HD1      TYR  10   8.337   3.939  -4.491
   66    HD2  TYR  10           HD2      TYR  10   8.060  -0.223  -3.671
   67    HE1  TYR  10           HE1      TYR  10  10.019   4.183  -2.715
   68    HE2  TYR  10           HE2      TYR  10   9.734   0.008  -1.892
   69    HH   TYR  10           HH       TYR  10  11.537   1.494  -1.246
   70    H    ASP  11           H        ASP  11   5.248   3.954  -5.722
   71    HA   ASP  11           HA       ASP  11   5.658   5.712  -3.668
   72    HB2  ASP  11           HB2      ASP  11   5.309   6.602  -5.823
   73    HB3  ASP  11           HB3      ASP  11   3.768   5.775  -6.007
   74    H    CYS  12           H        CYS  12   2.763   3.824  -4.311
   75    HA   CYS  12           HA       CYS  12   1.313   5.064  -2.139
   76    HB2  CYS  12           HB2      CYS  12   0.690   2.994  -4.200
   77    HB3  CYS  12           HB3      CYS  12  -0.316   3.098  -2.757
   78    H    ARG  13           H        ARG  13   3.276   2.251  -2.657
   79    HA   ARG  13           HA       ARG  13   2.086   0.811  -0.446
   80    HB2  ARG  13           HB2      ARG  13   4.439   0.126  -2.213
   81    HB3  ARG  13           HB3      ARG  13   3.737  -0.949  -1.013
   82    HG2  ARG  13           HG2      ARG  13   1.552  -0.699  -2.254
   83    HG3  ARG  13           HG3      ARG  13   2.479   0.090  -3.530
   84    HD2  ARG  13           HD2      ARG  13   2.979  -2.694  -2.482
   85    HD3  ARG  13           HD3      ARG  13   2.092  -2.312  -3.955
   86    HE   ARG  13           HE       ARG  13   4.967  -1.835  -3.525
   87   HH11  ARG  13          HH11      ARG  13   2.223  -2.180  -5.694
   88   HH12  ARG  13          HH12      ARG  13   3.214  -2.429  -7.096
   89   HH21  ARG  13          HH21      ARG  13   6.257  -2.168  -5.387
   90   HH22  ARG  13          HH22      ARG  13   5.491  -2.441  -6.917
   91    H    VAL  14           H        VAL  14   4.771   2.903  -0.962
   92    HA   VAL  14           HA       VAL  14   6.217   1.992   1.346
   93    HB   VAL  14           HB       VAL  14   7.404   2.913  -0.596
   94   HG11  VAL  14          HG11      VAL  14   6.170   5.549   0.180
   95   HG12  VAL  14          HG12      VAL  14   5.825   4.626  -1.280
   96   HG13  VAL  14          HG13      VAL  14   7.427   5.317  -1.034
   97   HG21  VAL  14          HG21      VAL  14   7.767   4.498   1.942
   98   HG22  VAL  14          HG22      VAL  14   8.944   4.397   0.631
   99   HG23  VAL  14          HG23      VAL  14   8.518   2.951   1.549
  100    H    LYS  15           H        LYS  15   3.712   4.319   0.751
  101    HA   LYS  15           HA       LYS  15   3.939   5.136   3.557
  102    HB2  LYS  15           HB2      LYS  15   3.326   7.448   2.954
  103    HB3  LYS  15           HB3      LYS  15   4.877   6.952   2.298
  104    HG2  LYS  15           HG2      LYS  15   3.800   6.549   0.122
  105    HG3  LYS  15           HG3      LYS  15   2.278   7.137   0.798
  106    HD2  LYS  15           HD2      LYS  15   3.379   9.294   1.304
  107    HD3  LYS  15           HD3      LYS  15   4.852   8.695   0.538
  108    HE2  LYS  15           HE2      LYS  15   3.613  10.112  -0.995
  109    HE3  LYS  15           HE3      LYS  15   3.635   8.450  -1.582
  110    HZ1  LYS  15           HZ1      LYS  15   1.447   9.501  -1.779
  111    HZ2  LYS  15           HZ2      LYS  15   1.380   9.692  -0.103
  112    HZ3  LYS  15           HZ3      LYS  15   1.405   8.144  -0.777
  113    H    GLY  16           H        GLY  16   2.138   3.364   1.783
  114    HA2  GLY  16           HA2      GLY  16  -0.438   4.596   2.457
  115    HA3  GLY  16           HA3      GLY  16  -0.201   3.254   1.343
  116    H    THR  17           H        THR  17  -2.132   3.123   3.278
  117    HA   THR  17           HA       THR  17  -1.022   1.530   5.464
  118    HB   THR  17           HB       THR  17  -3.367   1.575   6.345
  119    HG1  THR  17           HG1      THR  17  -4.191   2.061   4.098
  120   HG21  THR  17          HG21      THR  17  -3.321   3.934   7.023
  121   HG22  THR  17          HG22      THR  17  -2.126   4.268   5.771
  122   HG23  THR  17          HG23      THR  17  -1.718   3.204   7.117
  123    H    CYS  18           H        CYS  18  -1.258  -0.621   5.593
  124    HA   CYS  18           HA       CYS  18  -2.442  -2.019   3.347
  125    HB2  CYS  18           HB2      CYS  18  -0.231  -2.643   4.448
  126    HB3  CYS  18           HB3      CYS  18  -1.182  -3.227   5.808
  127    H    GLU  19           H        GLU  19  -4.635  -1.951   3.468
  128    HA   GLU  19           HA       GLU  19  -5.872  -2.809   6.002
  129    HB2  GLU  19           HB2      GLU  19  -6.738  -0.651   4.092
  130    HB3  GLU  19           HB3      GLU  19  -7.798  -1.316   5.323
  131    HG2  GLU  19           HG2      GLU  19  -5.162   0.033   5.863
  132    HG3  GLU  19           HG3      GLU  19  -6.744   0.801   5.998
  133    H    ASN  20           H        ASN  20  -7.028  -4.579   5.845
  134    HA   ASN  20           HA       ASN  20  -8.449  -6.187   5.118
  135    HB2  ASN  20           HB2      ASN  20  -9.825  -4.132   4.540
  136    HB3  ASN  20           HB3      ASN  20  -9.235  -4.299   2.893
  137   HD21  ASN  20          HD21      ASN  20 -11.244  -5.655   5.369
  138   HD22  ASN  20          HD22      ASN  20 -12.135  -6.724   4.345
  139    H    GLY  21           H        GLY  21  -5.695  -5.744   3.936
  140    HA2  GLY  21           HA2      GLY  21  -4.423  -7.171   2.596
  141    HA3  GLY  21           HA3      GLY  21  -5.910  -7.791   1.891
  142    H    LYS  22           H        LYS  22  -5.904  -4.440   1.965
  143    HA   LYS  22           HA       LYS  22  -4.872  -4.290  -0.786
  144    HB2  LYS  22           HB2      LYS  22  -7.325  -4.062  -0.754
  145    HB3  LYS  22           HB3      LYS  22  -7.189  -2.757   0.416
  146    HG2  LYS  22           HG2      LYS  22  -5.866  -1.483  -1.283
  147    HG3  LYS  22           HG3      LYS  22  -6.268  -2.744  -2.448
  148    HD2  LYS  22           HD2      LYS  22  -8.659  -2.283  -2.090
  149    HD3  LYS  22           HD3      LYS  22  -8.225  -0.999  -0.957
  150    HE2  LYS  22           HE2      LYS  22  -7.423  -1.098  -3.865
  151    HE3  LYS  22           HE3      LYS  22  -8.751  -0.144  -3.216
  152    HZ1  LYS  22           HZ1      LYS  22  -7.253   1.203  -2.001
  153    HZ2  LYS  22           HZ2      LYS  22  -6.616   1.079  -3.561
  154    HZ3  LYS  22           HZ3      LYS  22  -5.944   0.171  -2.305
  155    H    CYS  23           H        CYS  23  -3.477  -2.679  -1.224
  156    HA   CYS  23           HA       CYS  23  -2.484  -1.034   0.900
  157    HB2  CYS  23           HB2      CYS  23  -1.106  -1.885  -1.032
  158    HB3  CYS  23           HB3      CYS  23  -1.964  -0.743  -2.062
  159    H    VAL  24           H        VAL  24  -3.265   0.847   1.524
  160    HA   VAL  24           HA       VAL  24  -5.061   2.301  -0.301
  161    HB   VAL  24           HB       VAL  24  -5.209   2.192   2.717
  162   HG11  VAL  24          HG11      VAL  24  -7.366   3.365   2.404
  163   HG12  VAL  24          HG12      VAL  24  -6.990   3.532   0.690
  164   HG13  VAL  24          HG13      VAL  24  -5.976   4.322   1.896
  165   HG21  VAL  24          HG21      VAL  24  -6.985   0.924   0.634
  166   HG22  VAL  24          HG22      VAL  24  -7.305   0.950   2.368
  167   HG23  VAL  24          HG23      VAL  24  -5.903   0.080   1.743
  168    H    CYS  25           H        CYS  25  -3.756   3.830  -1.098
  169    HA   CYS  25           HA       CYS  25  -2.129   5.427   0.757
  170    HB2  CYS  25           HB2      CYS  25  -0.982   6.228  -1.284
  171    HB3  CYS  25           HB3      CYS  25  -0.901   4.477  -1.119
  172    H    GLY  26           H        GLY  26  -4.684   5.967   1.097
  173    HA2  GLY  26           HA2      GLY  26  -6.093   7.852   1.091
  174    HA3  GLY  26           HA3      GLY  26  -5.190   8.492  -0.280
  175    H    SER  27           H        SER  27  -5.516   5.501  -1.163
  176    HA   SER  27           HA       SER  27  -8.299   5.397  -1.932
  177    HB2  SER  27           HB2      SER  27  -6.108   5.451  -4.034
  178    HB3  SER  27           HB3      SER  27  -7.830   5.211  -4.330
  179    HG   SER  27           HG       SER  27  -7.669   7.421  -2.947
  Start of MODEL    3
    1    H1   LEU   1           H1       LEU   1   2.264   1.496   4.413
    2    H2   LEU   1           H2       LEU   1   3.619   2.078   5.240
    3    H3   LEU   1           H3       LEU   1   2.663   0.871   5.934
    4    HA   LEU   1           HA       LEU   1   4.305   0.604   3.491
    5    HB2  LEU   1           HB2      LEU   1   4.609  -0.498   6.287
    6    HB3  LEU   1           HB3      LEU   1   5.509  -1.102   4.912
    7    HG   LEU   1           HG       LEU   1   5.655   1.758   5.876
    8   HD11  LEU   1          HD11      LEU   1   7.509  -0.555   6.429
    9   HD12  LEU   1          HD12      LEU   1   6.475   0.251   7.608
   10   HD13  LEU   1          HD13      LEU   1   7.807   1.130   6.858
   11   HD21  LEU   1          HD21      LEU   1   7.351   0.153   3.966
   12   HD22  LEU   1          HD22      LEU   1   7.704   1.789   4.512
   13   HD23  LEU   1          HD23      LEU   1   6.266   1.478   3.545
   14    H    CYS   2           H        CYS   2   4.080  -1.253   2.347
   15    HA   CYS   2           HA       CYS   2   2.008  -3.144   3.246
   16    HB2  CYS   2           HB2      CYS   2   2.801  -2.301   0.458
   17    HB3  CYS   2           HB3      CYS   2   1.766  -3.681   0.791
   18    H    LEU   3           H        LEU   3   2.903  -4.945   3.952
   19    HA   LEU   3           HA       LEU   3   5.520  -5.760   2.979
   20    HB2  LEU   3           HB2      LEU   3   3.796  -6.969   5.139
   21    HB3  LEU   3           HB3      LEU   3   5.462  -7.391   4.799
   22    HG   LEU   3           HG       LEU   3   4.478  -4.739   5.851
   23   HD11  LEU   3          HD11      LEU   3   4.404  -6.516   7.512
   24   HD12  LEU   3          HD12      LEU   3   5.681  -5.358   7.880
   25   HD13  LEU   3          HD13      LEU   3   6.086  -6.920   7.169
   26   HD21  LEU   3          HD21      LEU   3   6.867  -4.194   6.102
   27   HD22  LEU   3          HD22      LEU   3   6.392  -4.386   4.417
   28   HD23  LEU   3          HD23      LEU   3   7.279  -5.673   5.234
   29    H    SER   4           H        SER   4   2.190  -6.889   3.049
   30    HA   SER   4           HA       SER   4   2.809  -8.694   0.835
   31    HB2  SER   4           HB2      SER   4   1.285  -9.560   3.303
   32    HB3  SER   4           HB3      SER   4   1.578 -10.538   1.868
   33    HG   SER   4           HG       SER   4   3.924  -9.951   2.435
   34    H    CYS   5           H        CYS   5   1.639  -6.370   0.365
   35    HA   CYS   5           HA       CYS   5  -1.192  -7.017  -0.011
   36    HB2  CYS   5           HB2      CYS   5  -0.266  -4.312   0.961
   37    HB3  CYS   5           HB3      CYS   5  -1.927  -4.872   0.778
   38    H    ARG   6           H        ARG   6  -2.238  -5.527  -1.594
   39    HA   ARG   6           HA       ARG   6  -0.310  -4.458  -3.540
   40    HB2  ARG   6           HB2      ARG   6  -2.689  -6.217  -4.142
   41    HB3  ARG   6           HB3      ARG   6  -1.763  -5.355  -5.361
   42    HG2  ARG   6           HG2      ARG   6   0.243  -6.623  -4.670
   43    HG3  ARG   6           HG3      ARG   6  -0.769  -7.540  -3.551
   44    HD2  ARG   6           HD2      ARG   6  -0.435  -8.762  -5.637
   45    HD3  ARG   6           HD3      ARG   6  -2.130  -8.325  -5.422
   46    HE   ARG   6           HE       ARG   6  -0.867  -6.318  -6.922
   47   HH11  ARG   6          HH11      ARG   6  -1.868  -9.656  -7.235
   48   HH12  ARG   6          HH12      ARG   6  -2.060  -9.562  -8.957
   49   HH21  ARG   6          HH21      ARG   6  -1.112  -6.191  -9.170
   50   HH22  ARG   6          HH22      ARG   6  -1.607  -7.595 -10.063
   51    H    GLY   7           H        GLY   7  -1.364  -3.016  -5.147
   52    HA2  GLY   7           HA2      GLY   7  -3.474  -1.826  -5.678
   53    HA3  GLY   7           HA3      GLY   7  -3.661  -1.612  -3.944
   54    H    GLY   8           H        GLY   8  -3.196   0.150  -6.450
   55    HA2  GLY   8           HA2      GLY   8  -2.487   2.341  -6.609
   56    HA3  GLY   8           HA3      GLY   8  -1.839   2.204  -4.985
   57    H    ASP   9           H        ASP   9  -0.194   3.566  -6.127
   58    HA   ASP   9           HA       ASP   9   1.644   2.267  -7.902
   59    HB2  ASP   9           HB2      ASP   9   1.249   4.726  -7.913
   60    HB3  ASP   9           HB3      ASP   9   1.963   4.825  -6.312
   61    H    TYR  10           H        TYR  10   4.042   2.138  -7.267
   62    HA   TYR  10           HA       TYR  10   4.476   0.497  -5.075
   63    HB2  TYR  10           HB2      TYR  10   6.109   0.728  -6.881
   64    HB3  TYR  10           HB3      TYR  10   6.421   2.393  -6.402
   65    HD1  TYR  10           HD1      TYR  10   7.918   2.903  -4.639
   66    HD2  TYR  10           HD2      TYR  10   6.770  -1.128  -5.354
   67    HE1  TYR  10           HE1      TYR  10   9.664   2.137  -3.087
   68    HE2  TYR  10           HE2      TYR  10   8.511  -1.906  -3.807
   69    HH   TYR  10           HH       TYR  10  10.639  -1.122  -2.881
   70    H    ASP  11           H        ASP  11   4.711   3.985  -5.390
   71    HA   ASP  11           HA       ASP  11   5.685   4.642  -2.862
   72    HB2  ASP  11           HB2      ASP  11   5.553   6.283  -4.617
   73    HB3  ASP  11           HB3      ASP  11   3.806   6.110  -4.712
   74    H    CYS  12           H        CYS  12   2.445   3.807  -3.907
   75    HA   CYS  12           HA       CYS  12   1.132   4.560  -1.487
   76    HB2  CYS  12           HB2      CYS  12   0.326   2.739  -3.755
   77    HB3  CYS  12           HB3      CYS  12  -0.731   3.125  -2.402
   78    H    ARG  13           H        ARG  13   2.992   1.875  -2.506
   79    HA   ARG  13           HA       ARG  13   1.978   0.113  -0.425
   80    HB2  ARG  13           HB2      ARG  13   4.322  -0.301  -2.292
   81    HB3  ARG  13           HB3      ARG  13   3.505  -1.530  -1.337
   82    HG2  ARG  13           HG2      ARG  13   1.447  -1.114  -2.650
   83    HG3  ARG  13           HG3      ARG  13   2.368   0.003  -3.660
   84    HD2  ARG  13           HD2      ARG  13   3.933  -1.883  -4.160
   85    HD3  ARG  13           HD3      ARG  13   2.822  -2.954  -3.310
   86    HE   ARG  13           HE       ARG  13   1.821  -1.370  -5.558
   87   HH11  ARG  13          HH11      ARG  13   2.662  -4.481  -4.189
   88   HH12  ARG  13          HH12      ARG  13   1.944  -5.381  -5.484
   89   HH21  ARG  13          HH21      ARG  13   0.854  -2.560  -7.256
   90   HH22  ARG  13          HH22      ARG  13   0.901  -4.296  -7.215
   91    H    VAL  14           H        VAL  14   4.088   2.656  -0.630
   92    HA   VAL  14           HA       VAL  14   5.828   1.628   1.481
   93    HB   VAL  14           HB       VAL  14   6.092   4.156  -0.153
   94   HG11  VAL  14          HG11      VAL  14   8.344   4.296   0.826
   95   HG12  VAL  14          HG12      VAL  14   7.981   2.901   1.837
   96   HG13  VAL  14          HG13      VAL  14   7.085   4.403   2.057
   97   HG21  VAL  14          HG21      VAL  14   7.966   3.008  -1.236
   98   HG22  VAL  14          HG22      VAL  14   6.444   2.153  -1.491
   99   HG23  VAL  14          HG23      VAL  14   7.605   1.553  -0.308
  100    H    LYS  15           H        LYS  15   4.114   4.692   0.730
  101    HA   LYS  15           HA       LYS  15   4.069   5.200   3.605
  102    HB2  LYS  15           HB2      LYS  15   3.576   7.495   3.097
  103    HB3  LYS  15           HB3      LYS  15   4.932   6.965   2.116
  104    HG2  LYS  15           HG2      LYS  15   3.467   6.743   0.185
  105    HG3  LYS  15           HG3      LYS  15   2.090   7.249   1.168
  106    HD2  LYS  15           HD2      LYS  15   3.277   9.386   1.631
  107    HD3  LYS  15           HD3      LYS  15   4.552   8.876   0.528
  108    HE2  LYS  15           HE2      LYS  15   3.057  10.381  -0.618
  109    HE3  LYS  15           HE3      LYS  15   2.881   8.764  -1.294
  110    HZ1  LYS  15           HZ1      LYS  15   0.737   9.813  -0.967
  111    HZ2  LYS  15           HZ2      LYS  15   1.061  10.031   0.681
  112    HZ3  LYS  15           HZ3      LYS  15   0.890   8.468   0.054
  113    H    GLY  16           H        GLY  16   2.096   3.814   1.363
  114    HA2  GLY  16           HA2      GLY  16  -0.410   4.800   2.425
  115    HA3  GLY  16           HA3      GLY  16  -0.209   3.550   1.203
  116    H    THR  17           H        THR  17  -2.045   3.195   3.146
  117    HA   THR  17           HA       THR  17  -0.795   1.426   5.136
  118    HB   THR  17           HB       THR  17  -3.009   1.625   6.319
  119    HG1  THR  17           HG1      THR  17  -4.111   2.383   4.344
  120   HG21  THR  17          HG21      THR  17  -2.573   3.864   7.206
  121   HG22  THR  17          HG22      THR  17  -1.522   4.208   5.832
  122   HG23  THR  17          HG23      THR  17  -1.071   2.965   6.998
  123    H    CYS  18           H        CYS  18  -1.181  -0.716   5.051
  124    HA   CYS  18           HA       CYS  18  -2.843  -1.741   2.937
  125    HB2  CYS  18           HB2      CYS  18  -0.783  -2.921   3.415
  126    HB3  CYS  18           HB3      CYS  18  -1.276  -3.161   5.090
  127    H    GLU  19           H        GLU  19  -4.932  -1.822   3.139
  128    HA   GLU  19           HA       GLU  19  -6.079  -2.586   5.740
  129    HB2  GLU  19           HB2      GLU  19  -7.174  -0.741   3.615
  130    HB3  GLU  19           HB3      GLU  19  -8.124  -1.333   4.964
  131    HG2  GLU  19           HG2      GLU  19  -6.547  -0.269   6.523
  132    HG3  GLU  19           HG3      GLU  19  -5.645   0.359   5.149
  133    H    ASN  20           H        ASN  20  -6.804  -4.566   5.700
  134    HA   ASN  20           HA       ASN  20  -7.608  -6.567   5.027
  135    HB2  ASN  20           HB2      ASN  20  -9.258  -4.775   3.248
  136    HB3  ASN  20           HB3      ASN  20  -9.514  -6.509   3.373
  137   HD21  ASN  20          HD21      ASN  20  -9.870  -3.445   4.920
  138   HD22  ASN  20          HD22      ASN  20 -10.835  -3.995   6.245
  139    H    GLY  21           H        GLY  21  -5.200  -5.636   3.809
  140    HA2  GLY  21           HA2      GLY  21  -3.768  -6.798   2.368
  141    HA3  GLY  21           HA3      GLY  21  -5.170  -7.473   1.550
  142    H    LYS  22           H        LYS  22  -5.787  -4.264   1.822
  143    HA   LYS  22           HA       LYS  22  -4.793  -3.804  -0.907
  144    HB2  LYS  22           HB2      LYS  22  -7.239  -3.816  -0.672
  145    HB3  LYS  22           HB3      LYS  22  -7.131  -2.556   0.546
  146    HG2  LYS  22           HG2      LYS  22  -7.807  -1.572  -1.523
  147    HG3  LYS  22           HG3      LYS  22  -6.166  -1.042  -1.153
  148    HD2  LYS  22           HD2      LYS  22  -6.335  -1.595  -3.501
  149    HD3  LYS  22           HD3      LYS  22  -5.293  -2.766  -2.692
  150    HE2  LYS  22           HE2      LYS  22  -6.815  -3.865  -4.258
  151    HE3  LYS  22           HE3      LYS  22  -7.139  -4.360  -2.600
  152    HZ1  LYS  22           HZ1      LYS  22  -9.170  -3.898  -3.855
  153    HZ2  LYS  22           HZ2      LYS  22  -8.675  -2.298  -4.087
  154    HZ3  LYS  22           HZ3      LYS  22  -9.010  -2.863  -2.528
  155    H    CYS  23           H        CYS  23  -3.261  -2.348  -1.180
  156    HA   CYS  23           HA       CYS  23  -2.407  -0.624   0.938
  157    HB2  CYS  23           HB2      CYS  23  -1.606  -0.675  -1.975
  158    HB3  CYS  23           HB3      CYS  23  -0.783   0.225  -0.707
  159    H    VAL  24           H        VAL  24  -3.712   0.964   1.505
  160    HA   VAL  24           HA       VAL  24  -5.035   2.568  -0.559
  161    HB   VAL  24           HB       VAL  24  -5.455   2.622   2.434
  162   HG11  VAL  24          HG11      VAL  24  -7.510   3.841   1.887
  163   HG12  VAL  24          HG12      VAL  24  -7.084   3.795   0.178
  164   HG13  VAL  24          HG13      VAL  24  -6.079   4.697   1.311
  165   HG21  VAL  24          HG21      VAL  24  -7.514   1.358   2.014
  166   HG22  VAL  24          HG22      VAL  24  -6.086   0.444   1.526
  167   HG23  VAL  24          HG23      VAL  24  -7.087   1.232   0.307
  168    H    CYS  25           H        CYS  25  -4.169   4.451  -1.103
  169    HA   CYS  25           HA       CYS  25  -2.394   5.763   0.833
  170    HB2  CYS  25           HB2      CYS  25  -1.077   6.578  -1.109
  171    HB3  CYS  25           HB3      CYS  25  -1.037   4.831  -0.917
  172    H    GLY  26           H        GLY  26  -3.036   7.712   1.424
  173    HA2  GLY  26           HA2      GLY  26  -5.155   9.086   0.028
  174    HA3  GLY  26           HA3      GLY  26  -4.328   9.637   1.478
  175    H    SER  27           H        SER  27  -3.704   9.088  -1.973
  176    HA   SER  27           HA       SER  27  -2.541  10.239  -3.539
  177    HB2  SER  27           HB2      SER  27  -2.677  12.606  -1.656
  178    HB3  SER  27           HB3      SER  27  -2.388  12.649  -3.394
  179    HG   SER  27           HG       SER  27  -4.678  11.321  -2.814
  Start of MODEL    4
    1    H1   LEU   1           H1       LEU   1   3.736   1.937   5.497
    2    H2   LEU   1           H2       LEU   1   2.908   0.587   6.094
    3    H3   LEU   1           H3       LEU   1   2.263   1.469   4.804
    4    HA   LEU   1           HA       LEU   1   4.079   0.822   3.391
    5    HB2  LEU   1           HB2      LEU   1   5.733   0.641   5.237
    6    HB3  LEU   1           HB3      LEU   1   4.945  -0.828   5.770
    7    HG   LEU   1           HG       LEU   1   5.546  -1.892   3.601
    8   HD11  LEU   1          HD11      LEU   1   7.081   0.670   3.183
    9   HD12  LEU   1          HD12      LEU   1   5.755   0.057   2.195
   10   HD13  LEU   1          HD13      LEU   1   7.293  -0.801   2.236
   11   HD21  LEU   1          HD21      LEU   1   6.916  -2.238   5.573
   12   HD22  LEU   1          HD22      LEU   1   7.827  -0.770   5.218
   13   HD23  LEU   1          HD23      LEU   1   7.926  -2.152   4.128
   14    H    CYS   2           H        CYS   2   3.393  -0.683   1.971
   15    HA   CYS   2           HA       CYS   2   1.467  -2.668   2.967
   16    HB2  CYS   2           HB2      CYS   2   1.673  -1.450   0.214
   17    HB3  CYS   2           HB3      CYS   2   0.409  -2.530   0.780
   18    H    LEU   3           H        LEU   3   3.028  -4.285   3.353
   19    HA   LEU   3           HA       LEU   3   4.406  -5.325   0.986
   20    HB2  LEU   3           HB2      LEU   3   4.642  -6.141   3.880
   21    HB3  LEU   3           HB3      LEU   3   5.607  -6.779   2.563
   22    HG   LEU   3           HG       LEU   3   5.634  -3.937   3.577
   23   HD11  LEU   3          HD11      LEU   3   6.730  -5.490   5.087
   24   HD12  LEU   3          HD12      LEU   3   7.917  -4.469   4.277
   25   HD13  LEU   3          HD13      LEU   3   7.685  -6.137   3.754
   26   HD21  LEU   3          HD21      LEU   3   7.181  -5.244   1.345
   27   HD22  LEU   3          HD22      LEU   3   7.559  -3.668   2.034
   28   HD23  LEU   3          HD23      LEU   3   6.024  -3.919   1.204
   29    H    SER   4           H        SER   4   1.948  -6.152   3.350
   30    HA   SER   4           HA       SER   4   1.442  -8.681   1.962
   31    HB2  SER   4           HB2      SER   4   1.622  -8.751   4.427
   32    HB3  SER   4           HB3      SER   4   0.277  -7.621   4.549
   33    HG   SER   4           HG       SER   4  -0.915  -9.288   3.293
   34    H    CYS   5           H        CYS   5   0.763  -5.812   1.155
   35    HA   CYS   5           HA       CYS   5  -2.025  -6.335   0.455
   36    HB2  CYS   5           HB2      CYS   5  -0.959  -3.786   1.664
   37    HB3  CYS   5           HB3      CYS   5  -2.494  -3.880   0.804
   38    H    ARG   6           H        ARG   6  -2.667  -5.515  -1.510
   39    HA   ARG   6           HA       ARG   6  -0.474  -4.488  -3.187
   40    HB2  ARG   6           HB2      ARG   6  -2.828  -6.214  -3.969
   41    HB3  ARG   6           HB3      ARG   6  -1.611  -5.598  -5.081
   42    HG2  ARG   6           HG2      ARG   6   0.110  -6.876  -3.944
   43    HG3  ARG   6           HG3      ARG   6  -1.079  -7.453  -2.773
   44    HD2  ARG   6           HD2      ARG   6  -2.320  -8.526  -4.609
   45    HD3  ARG   6           HD3      ARG   6  -1.074  -8.000  -5.737
   46    HE   ARG   6           HE       ARG   6   0.356  -9.368  -3.925
   47   HH11  ARG   6          HH11      ARG   6  -2.590 -10.140  -5.638
   48   HH12  ARG   6          HH12      ARG   6  -2.284 -11.846  -5.671
   49   HH21  ARG   6          HH21      ARG   6   0.775 -11.621  -3.957
   50   HH22  ARG   6          HH22      ARG   6  -0.367 -12.692  -4.707
   51    H    GLY   7           H        GLY   7  -1.363  -3.319  -5.171
   52    HA2  GLY   7           HA2      GLY   7  -3.274  -1.992  -5.991
   53    HA3  GLY   7           HA3      GLY   7  -3.588  -1.582  -4.310
   54    H    GLY   8           H        GLY   8  -2.690  -0.161  -6.939
   55    HA2  GLY   8           HA2      GLY   8  -1.628   1.862  -7.298
   56    HA3  GLY   8           HA3      GLY   8  -1.167   1.868  -5.604
   57    H    ASP   9           H        ASP   9   0.755   2.806  -6.928
   58    HA   ASP   9           HA       ASP   9   2.525   0.658  -7.825
   59    HB2  ASP   9           HB2      ASP   9   2.136   2.909  -9.094
   60    HB3  ASP   9           HB3      ASP   9   3.244   3.568  -7.896
   61    H    TYR  10           H        TYR  10   4.978   1.641  -7.236
   62    HA   TYR  10           HA       TYR  10   5.428   0.652  -4.696
   63    HB2  TYR  10           HB2      TYR  10   7.177   0.818  -6.370
   64    HB3  TYR  10           HB3      TYR  10   7.095   2.574  -6.318
   65    HD1  TYR  10           HD1      TYR  10   8.075  -0.433  -4.423
   66    HD2  TYR  10           HD2      TYR  10   8.252   3.804  -4.662
   67    HE1  TYR  10           HE1      TYR  10   9.817  -0.416  -2.687
   68    HE2  TYR  10           HE2      TYR  10   9.988   3.840  -2.928
   69    HH   TYR  10           HH       TYR  10  11.629   1.031  -1.917
   70    H    ASP  11           H        ASP  11   5.308   4.059  -5.706
   71    HA   ASP  11           HA       ASP  11   5.927   5.174  -3.225
   72    HB2  ASP  11           HB2      ASP  11   5.060   7.265  -4.114
   73    HB3  ASP  11           HB3      ASP  11   5.976   6.425  -5.357
   74    H    CYS  12           H        CYS  12   2.873   4.064  -4.525
   75    HA   CYS  12           HA       CYS  12   1.255   5.166  -2.454
   76    HB2  CYS  12           HB2      CYS  12   0.176   4.601  -4.507
   77    HB3  CYS  12           HB3      CYS  12   0.822   2.967  -4.474
   78    H    ARG  13           H        ARG  13   3.087   2.230  -2.883
   79    HA   ARG  13           HA       ARG  13   1.762   0.860  -0.704
   80    HB2  ARG  13           HB2      ARG  13   4.174   0.016  -2.319
   81    HB3  ARG  13           HB3      ARG  13   3.190  -1.015  -1.289
   82    HG2  ARG  13           HG2      ARG  13   1.260  -0.599  -2.753
   83    HG3  ARG  13           HG3      ARG  13   2.290   0.385  -3.794
   84    HD2  ARG  13           HD2      ARG  13   3.727  -1.606  -4.154
   85    HD3  ARG  13           HD3      ARG  13   2.569  -2.560  -3.227
   86    HE   ARG  13           HE       ARG  13   1.535  -1.096  -5.522
   87   HH11  ARG  13          HH11      ARG  13   2.596  -4.147  -4.174
   88   HH12  ARG  13          HH12      ARG  13   1.851  -5.093  -5.421
   89   HH21  ARG  13          HH21      ARG  13   0.550  -2.333  -7.148
   90   HH22  ARG  13          HH22      ARG  13   0.672  -4.068  -7.107
   91    H    VAL  14           H        VAL  14   4.240   3.088  -0.941
   92    HA   VAL  14           HA       VAL  14   5.750   2.068   1.309
   93    HB   VAL  14           HB       VAL  14   5.999   4.649  -0.241
   94   HG11  VAL  14          HG11      VAL  14   8.122   4.967   0.932
   95   HG12  VAL  14          HG12      VAL  14   7.809   3.526   1.899
   96   HG13  VAL  14          HG13      VAL  14   6.771   4.942   2.066
   97   HG21  VAL  14          HG21      VAL  14   8.025   3.619  -1.140
   98   HG22  VAL  14          HG22      VAL  14   6.596   2.656  -1.509
   99   HG23  VAL  14          HG23      VAL  14   7.689   2.153  -0.220
  100    H    LYS  15           H        LYS  15   3.738   4.920   0.616
  101    HA   LYS  15           HA       LYS  15   3.720   5.570   3.454
  102    HB2  LYS  15           HB2      LYS  15   2.538   7.634   2.741
  103    HB3  LYS  15           HB3      LYS  15   4.095   7.416   1.958
  104    HG2  LYS  15           HG2      LYS  15   3.005   6.627  -0.056
  105    HG3  LYS  15           HG3      LYS  15   1.434   6.776   0.725
  106    HD2  LYS  15           HD2      LYS  15   3.190   9.173   0.632
  107    HD3  LYS  15           HD3      LYS  15   2.394   8.668  -0.858
  108    HE2  LYS  15           HE2      LYS  15   1.028  10.311   0.257
  109    HE3  LYS  15           HE3      LYS  15   0.219   8.748   0.318
  110    HZ1  LYS  15           HZ1      LYS  15   0.941   8.490   2.591
  111    HZ2  LYS  15           HZ2      LYS  15   0.093   9.943   2.426
  112    HZ3  LYS  15           HZ3      LYS  15   1.782   9.953   2.537
  113    H    GLY  16           H        GLY  16   1.946   3.622   1.480
  114    HA2  GLY  16           HA2      GLY  16  -0.680   4.310   2.464
  115    HA3  GLY  16           HA3      GLY  16  -0.278   2.971   1.398
  116    H    THR  17           H        THR  17  -2.076   2.732   3.473
  117    HA   THR  17           HA       THR  17  -0.651   1.192   5.512
  118    HB   THR  17           HB       THR  17  -2.981   1.096   6.571
  119    HG1  THR  17           HG1      THR  17  -4.512   1.907   5.346
  120   HG21  THR  17          HG21      THR  17  -2.754   3.339   7.537
  121   HG22  THR  17          HG22      THR  17  -1.629   3.776   6.252
  122   HG23  THR  17          HG23      THR  17  -1.194   2.528   7.419
  123    H    CYS  18           H        CYS  18  -0.910  -0.972   5.720
  124    HA   CYS  18           HA       CYS  18  -2.101  -2.369   3.486
  125    HB2  CYS  18           HB2      CYS  18   0.097  -3.052   4.399
  126    HB3  CYS  18           HB3      CYS  18  -0.670  -3.424   5.935
  127    H    GLU  19           H        GLU  19  -4.284  -2.206   3.656
  128    HA   GLU  19           HA       GLU  19  -5.492  -3.390   6.062
  129    HB2  GLU  19           HB2      GLU  19  -6.498  -1.063   4.432
  130    HB3  GLU  19           HB3      GLU  19  -7.430  -1.865   5.684
  131    HG2  GLU  19           HG2      GLU  19  -5.711  -1.230   7.330
  132    HG3  GLU  19           HG3      GLU  19  -4.844  -0.375   6.059
  133    H    ASN  20           H        ASN  20  -6.404  -5.227   5.602
  134    HA   ASN  20           HA       ASN  20  -7.741  -6.797   4.668
  135    HB2  ASN  20           HB2      ASN  20  -9.351  -4.875   4.801
  136    HB3  ASN  20           HB3      ASN  20  -8.954  -4.498   3.133
  137   HD21  ASN  20          HD21      ASN  20  -9.224  -7.758   4.360
  138   HD22  ASN  20          HD22      ASN  20 -10.662  -8.162   3.490
  139    H    GLY  21           H        GLY  21  -5.221  -6.360   3.476
  140    HA2  GLY  21           HA2      GLY  21  -4.091  -7.349   1.721
  141    HA3  GLY  21           HA3      GLY  21  -5.643  -7.776   1.014
  142    H    LYS  22           H        LYS  22  -5.732  -4.538   1.688
  143    HA   LYS  22           HA       LYS  22  -4.858  -3.875  -1.043
  144    HB2  LYS  22           HB2      LYS  22  -7.307  -3.888  -0.859
  145    HB3  LYS  22           HB3      LYS  22  -7.215  -2.783   0.501
  146    HG2  LYS  22           HG2      LYS  22  -7.866  -1.596  -1.496
  147    HG3  LYS  22           HG3      LYS  22  -6.274  -1.058  -0.965
  148    HD2  LYS  22           HD2      LYS  22  -6.259  -1.309  -3.358
  149    HD3  LYS  22           HD3      LYS  22  -5.251  -2.570  -2.647
  150    HE2  LYS  22           HE2      LYS  22  -6.622  -3.481  -4.440
  151    HE3  LYS  22           HE3      LYS  22  -7.103  -4.170  -2.891
  152    HZ1  LYS  22           HZ1      LYS  22  -8.993  -3.529  -4.299
  153    HZ2  LYS  22           HZ2      LYS  22  -8.491  -1.915  -4.230
  154    HZ3  LYS  22           HZ3      LYS  22  -8.982  -2.710  -2.821
  155    H    CYS  23           H        CYS  23  -3.625  -2.112  -1.298
  156    HA   CYS  23           HA       CYS  23  -2.573  -0.854   1.074
  157    HB2  CYS  23           HB2      CYS  23  -1.196  -1.508  -0.953
  158    HB3  CYS  23           HB3      CYS  23  -1.944  -0.148  -1.788
  159    H    VAL  24           H        VAL  24  -3.474   0.837   1.973
  160    HA   VAL  24           HA       VAL  24  -5.196   2.581   0.356
  161    HB   VAL  24           HB       VAL  24  -4.958   2.438   3.365
  162   HG11  VAL  24          HG11      VAL  24  -5.795   4.577   2.562
  163   HG12  VAL  24          HG12      VAL  24  -7.080   3.669   3.353
  164   HG13  VAL  24          HG13      VAL  24  -7.018   3.755   1.595
  165   HG21  VAL  24          HG21      VAL  24  -5.792   0.326   2.466
  166   HG22  VAL  24          HG22      VAL  24  -7.038   1.194   1.570
  167   HG23  VAL  24          HG23      VAL  24  -7.057   1.194   3.334
  168    H    CYS  25           H        CYS  25  -3.857   4.051  -0.564
  169    HA   CYS  25           HA       CYS  25  -1.972   5.441   1.206
  170    HB2  CYS  25           HB2      CYS  25  -0.796   6.099  -0.909
  171    HB3  CYS  25           HB3      CYS  25  -0.781   4.373  -0.568
  172    H    GLY  26           H        GLY  26  -4.305   6.381   1.664
  173    HA2  GLY  26           HA2      GLY  26  -4.882   8.587  -0.175
  174    HA3  GLY  26           HA3      GLY  26  -5.940   8.015   1.104
  175    H    SER  27           H        SER  27  -3.873   7.956   3.125
  176    HA   SER  27           HA       SER  27  -3.731  10.840   3.643
  177    HB2  SER  27           HB2      SER  27  -3.338   8.547   5.585
  178    HB3  SER  27           HB3      SER  27  -3.526  10.255   5.985
  179    HG   SER  27           HG       SER  27  -5.618   9.712   4.565
  Start of MODEL    5
    1    H1   LEU   1           H1       LEU   1   3.210   0.992   6.172
    2    H2   LEU   1           H2       LEU   1   2.431   1.720   4.860
    3    H3   LEU   1           H3       LEU   1   3.922   2.319   5.400
    4    HA   LEU   1           HA       LEU   1   4.219   1.057   3.392
    5    HB2  LEU   1           HB2      LEU   1   5.971   1.048   5.135
    6    HB3  LEU   1           HB3      LEU   1   5.241  -0.373   5.849
    7    HG   LEU   1           HG       LEU   1   5.724  -1.617   3.735
    8   HD11  LEU   1          HD11      LEU   1   5.863   0.216   2.176
    9   HD12  LEU   1          HD12      LEU   1   7.407  -0.634   2.212
   10   HD13  LEU   1          HD13      LEU   1   7.229   0.905   3.052
   11   HD21  LEU   1          HD21      LEU   1   8.116  -1.860   4.175
   12   HD22  LEU   1          HD22      LEU   1   7.186  -1.801   5.671
   13   HD23  LEU   1          HD23      LEU   1   8.091  -0.384   5.139
   14    H    CYS   2           H        CYS   2   3.471  -0.518   2.105
   15    HA   CYS   2           HA       CYS   2   1.688  -2.509   3.318
   16    HB2  CYS   2           HB2      CYS   2   1.862  -1.572   0.451
   17    HB3  CYS   2           HB3      CYS   2   0.673  -2.694   1.099
   18    H    LEU   3           H        LEU   3   2.716  -4.354   3.696
   19    HA   LEU   3           HA       LEU   3   4.604  -5.361   1.694
   20    HB2  LEU   3           HB2      LEU   3   4.121  -6.219   4.544
   21    HB3  LEU   3           HB3      LEU   3   5.280  -6.967   3.463
   22    HG   LEU   3           HG       LEU   3   5.384  -4.100   4.409
   23   HD11  LEU   3          HD11      LEU   3   7.308  -4.823   5.731
   24   HD12  LEU   3          HD12      LEU   3   7.038  -6.488   5.215
   25   HD13  LEU   3          HD13      LEU   3   5.839  -5.668   6.217
   26   HD21  LEU   3          HD21      LEU   3   6.386  -4.312   2.227
   27   HD22  LEU   3          HD22      LEU   3   7.295  -5.731   2.742
   28   HD23  LEU   3          HD23      LEU   3   7.662  -4.151   3.433
   29    H    SER   4           H        SER   4   1.758  -6.326   3.586
   30    HA   SER   4           HA       SER   4   1.492  -8.707   1.906
   31    HB2  SER   4           HB2      SER   4   0.053  -7.937   4.450
   32    HB3  SER   4           HB3      SER   4  -0.145  -9.462   3.588
   33    HG   SER   4           HG       SER   4   1.368  -9.496   5.388
   34    H    CYS   5           H        CYS   5   0.678  -5.737   1.390
   35    HA   CYS   5           HA       CYS   5  -2.014  -6.375   0.407
   36    HB2  CYS   5           HB2      CYS   5  -1.077  -3.798   1.667
   37    HB3  CYS   5           HB3      CYS   5  -2.577  -3.948   0.757
   38    H    ARG   6           H        ARG   6  -2.557  -5.601  -1.600
   39    HA   ARG   6           HA       ARG   6  -0.293  -4.607  -3.183
   40    HB2  ARG   6           HB2      ARG   6  -2.884  -5.885  -4.072
   41    HB3  ARG   6           HB3      ARG   6  -1.616  -5.320  -5.150
   42    HG2  ARG   6           HG2      ARG   6  -0.066  -6.937  -4.069
   43    HG3  ARG   6           HG3      ARG   6  -1.443  -7.570  -3.164
   44    HD2  ARG   6           HD2      ARG   6  -1.012  -8.934  -5.133
   45    HD3  ARG   6           HD3      ARG   6  -2.569  -8.120  -5.273
   46    HE   ARG   6           HE       ARG   6  -0.669  -6.495  -6.507
   47   HH11  ARG   6          HH11      ARG   6  -2.069  -9.673  -6.965
   48   HH12  ARG   6          HH12      ARG   6  -1.867  -9.652  -8.685
   49   HH21  ARG   6          HH21      ARG   6  -0.395  -6.464  -8.760
   50   HH22  ARG   6          HH22      ARG   6  -0.903  -7.825  -9.712
   51    H    GLY   7           H        GLY   7  -0.643  -2.918  -4.712
   52    HA2  GLY   7           HA2      GLY   7  -3.082  -1.361  -4.486
   53    HA3  GLY   7           HA3      GLY   7  -1.625  -0.589  -3.877
   54    H    GLY   8           H        GLY   8  -1.639   1.025  -5.410
   55    HA2  GLY   8           HA2      GLY   8  -1.490   0.266  -8.218
   56    HA3  GLY   8           HA3      GLY   8  -1.623   1.899  -7.589
   57    H    ASP   9           H        ASP   9   0.146   3.091  -7.404
   58    HA   ASP   9           HA       ASP   9   2.542   2.125  -8.619
   59    HB2  ASP   9           HB2      ASP   9   1.760   4.431  -8.959
   60    HB3  ASP   9           HB3      ASP   9   1.995   4.764  -7.249
   61    H    TYR  10           H        TYR  10   4.676   2.228  -7.670
   62    HA   TYR  10           HA       TYR  10   5.078   0.879  -5.323
   63    HB2  TYR  10           HB2      TYR  10   6.839   1.221  -6.944
   64    HB3  TYR  10           HB3      TYR  10   6.814   2.955  -6.656
   65    HD1  TYR  10           HD1      TYR  10   8.061   3.921  -4.911
   66    HD2  TYR  10           HD2      TYR  10   7.686  -0.306  -5.148
   67    HE1  TYR  10           HE1      TYR  10   9.817   3.679  -3.214
   68    HE2  TYR  10           HE2      TYR  10   9.440  -0.563  -3.443
   69    HH   TYR  10           HH       TYR  10  11.319   0.691  -2.534
   70    H    ASP  11           H        ASP  11   5.026   4.385  -5.817
   71    HA   ASP  11           HA       ASP  11   5.687   5.212  -3.244
   72    HB2  ASP  11           HB2      ASP  11   5.638   6.780  -5.067
   73    HB3  ASP  11           HB3      ASP  11   3.921   6.498  -5.326
   74    H    CYS  12           H        CYS  12   2.635   4.088  -4.522
   75    HA   CYS  12           HA       CYS  12   0.967   5.026  -2.450
   76    HB2  CYS  12           HB2      CYS  12   0.100   4.252  -4.624
   77    HB3  CYS  12           HB3      CYS  12   0.615   2.616  -4.243
   78    H    ARG  13           H        ARG  13   2.912   2.110  -2.840
   79    HA   ARG  13           HA       ARG  13   1.707   0.993  -0.431
   80    HB2  ARG  13           HB2      ARG  13   3.056  -1.049  -1.004
   81    HB3  ARG  13           HB3      ARG  13   1.820  -0.600  -2.164
   82    HG2  ARG  13           HG2      ARG  13   3.505   0.360  -3.614
   83    HG3  ARG  13           HG3      ARG  13   4.760  -0.027  -2.435
   84    HD2  ARG  13           HD2      ARG  13   3.019  -1.968  -3.949
   85    HD3  ARG  13           HD3      ARG  13   4.754  -1.720  -4.149
   86    HE   ARG  13           HE       ARG  13   4.712  -2.431  -1.624
   87   HH11  ARG  13          HH11      ARG  13   2.852  -3.809  -4.263
   88   HH12  ARG  13          HH12      ARG  13   2.807  -5.391  -3.560
   89   HH21  ARG  13          HH21      ARG  13   4.616  -4.497  -0.692
   90   HH22  ARG  13          HH22      ARG  13   3.810  -5.785  -1.527
   91    H    VAL  14           H        VAL  14   4.058   3.114  -0.976
   92    HA   VAL  14           HA       VAL  14   5.917   2.106   1.008
   93    HB   VAL  14           HB       VAL  14   5.790   4.782  -0.397
   94   HG11  VAL  14          HG11      VAL  14   7.936   3.660   1.406
   95   HG12  VAL  14          HG12      VAL  14   6.851   4.994   1.797
   96   HG13  VAL  14          HG13      VAL  14   8.035   5.172   0.502
   97   HG21  VAL  14          HG21      VAL  14   7.609   2.413  -0.787
   98   HG22  VAL  14          HG22      VAL  14   7.749   3.963  -1.615
   99   HG23  VAL  14          HG23      VAL  14   6.337   2.942  -1.886
  100    H    LYS  15           H        LYS  15   3.778   4.940   0.685
  101    HA   LYS  15           HA       LYS  15   3.887   5.237   3.595
  102    HB2  LYS  15           HB2      LYS  15   3.055   7.498   3.261
  103    HB3  LYS  15           HB3      LYS  15   4.490   7.212   2.293
  104    HG2  LYS  15           HG2      LYS  15   3.249   7.105   0.294
  105    HG3  LYS  15           HG3      LYS  15   1.719   6.988   1.167
  106    HD2  LYS  15           HD2      LYS  15   2.025   9.257   2.024
  107    HD3  LYS  15           HD3      LYS  15   3.570   9.371   1.184
  108    HE2  LYS  15           HE2      LYS  15   0.986   8.845  -0.262
  109    HE3  LYS  15           HE3      LYS  15   1.566  10.476   0.068
  110    HZ1  LYS  15           HZ1      LYS  15   2.982   8.396  -1.515
  111    HZ2  LYS  15           HZ2      LYS  15   3.605   9.920  -1.139
  112    HZ3  LYS  15           HZ3      LYS  15   2.236   9.789  -2.117
  113    H    GLY  16           H        GLY  16   2.066   3.562   1.598
  114    HA2  GLY  16           HA2      GLY  16  -0.554   4.377   2.541
  115    HA3  GLY  16           HA3      GLY  16  -0.200   3.055   1.435
  116    H    THR  17           H        THR  17  -2.027   2.646   3.348
  117    HA   THR  17           HA       THR  17  -0.667   1.125   5.460
  118    HB   THR  17           HB       THR  17  -3.013   1.055   6.466
  119    HG1  THR  17           HG1      THR  17  -4.217   1.689   4.674
  120   HG21  THR  17          HG21      THR  17  -1.242   2.501   7.341
  121   HG22  THR  17          HG22      THR  17  -2.810   3.304   7.421
  122   HG23  THR  17          HG23      THR  17  -1.661   3.738   6.154
  123    H    CYS  18           H        CYS  18  -1.078  -1.036   5.752
  124    HA   CYS  18           HA       CYS  18  -2.208  -2.430   3.467
  125    HB2  CYS  18           HB2      CYS  18  -0.038  -3.127   4.455
  126    HB3  CYS  18           HB3      CYS  18  -0.867  -3.512   5.955
  127    H    GLU  19           H        GLU  19  -4.394  -2.186   3.600
  128    HA   GLU  19           HA       GLU  19  -5.693  -3.258   6.018
  129    HB2  GLU  19           HB2      GLU  19  -6.568  -1.042   4.171
  130    HB3  GLU  19           HB3      GLU  19  -7.641  -1.794   5.339
  131    HG2  GLU  19           HG2      GLU  19  -5.087  -0.343   5.990
  132    HG3  GLU  19           HG3      GLU  19  -6.716   0.302   6.174
  133    H    ASN  20           H        ASN  20  -6.667  -5.090   5.692
  134    HA   ASN  20           HA       ASN  20  -7.579  -6.905   4.710
  135    HB2  ASN  20           HB2      ASN  20  -9.705  -6.482   3.512
  136    HB3  ASN  20           HB3      ASN  20  -9.574  -5.612   5.028
  137   HD21  ASN  20          HD21      ASN  20  -9.734  -5.346   1.576
  138   HD22  ASN  20          HD22      ASN  20  -9.985  -3.638   1.519
  139    H    GLY  21           H        GLY  21  -5.257  -6.168   3.349
  140    HA2  GLY  21           HA2      GLY  21  -4.214  -7.260   1.561
  141    HA3  GLY  21           HA3      GLY  21  -5.798  -7.606   0.883
  142    H    LYS  22           H        LYS  22  -6.026  -4.493   1.571
  143    HA   LYS  22           HA       LYS  22  -5.183  -3.693  -1.126
  144    HB2  LYS  22           HB2      LYS  22  -7.610  -3.576  -0.699
  145    HB3  LYS  22           HB3      LYS  22  -7.313  -2.537   0.684
  146    HG2  LYS  22           HG2      LYS  22  -8.056  -1.195  -1.150
  147    HG3  LYS  22           HG3      LYS  22  -6.356  -0.841  -0.843
  148    HD2  LYS  22           HD2      LYS  22  -5.690  -2.235  -2.704
  149    HD3  LYS  22           HD3      LYS  22  -7.366  -2.723  -2.974
  150    HE2  LYS  22           HE2      LYS  22  -7.943  -0.365  -3.440
  151    HE3  LYS  22           HE3      LYS  22  -6.245   0.064  -3.243
  152    HZ1  LYS  22           HZ1      LYS  22  -7.325  -1.799  -5.287
  153    HZ2  LYS  22           HZ2      LYS  22  -5.700  -1.365  -5.106
  154    HZ3  LYS  22           HZ3      LYS  22  -6.836  -0.205  -5.567
  155    H    CYS  23           H        CYS  23  -3.602  -2.244  -1.287
  156    HA   CYS  23           HA       CYS  23  -2.578  -0.980   1.094
  157    HB2  CYS  23           HB2      CYS  23  -1.088  -1.820  -0.725
  158    HB3  CYS  23           HB3      CYS  23  -1.716  -0.547  -1.767
  159    H    VAL  24           H        VAL  24  -3.495   0.736   1.883
  160    HA   VAL  24           HA       VAL  24  -5.020   2.506   0.113
  161    HB   VAL  24           HB       VAL  24  -5.070   2.332   3.129
  162   HG11  VAL  24          HG11      VAL  24  -5.761   4.508   2.275
  163   HG12  VAL  24          HG12      VAL  24  -7.137   3.633   2.945
  164   HG13  VAL  24          HG13      VAL  24  -6.920   3.729   1.198
  165   HG21  VAL  24          HG21      VAL  24  -7.201   1.153   2.858
  166   HG22  VAL  24          HG22      VAL  24  -5.874   0.259   2.118
  167   HG23  VAL  24          HG23      VAL  24  -6.990   1.175   1.107
  168    H    CYS  25           H        CYS  25  -3.583   3.949  -0.681
  169    HA   CYS  25           HA       CYS  25  -1.820   5.349   1.182
  170    HB2  CYS  25           HB2      CYS  25  -0.854   6.323  -0.952
  171    HB3  CYS  25           HB3      CYS  25  -0.623   4.596  -0.712
  172    H    GLY  26           H        GLY  26  -4.406   5.901   1.590
  173    HA2  GLY  26           HA2      GLY  26  -4.527   8.699   1.398
  174    HA3  GLY  26           HA3      GLY  26  -5.562   7.997   0.160
  175    H    SER  27           H        SER  27  -7.350   9.003   1.307
  176    HA   SER  27           HA       SER  27  -8.285   7.262   3.469
  177    HB2  SER  27           HB2      SER  27  -7.392   9.394   4.444
  178    HB3  SER  27           HB3      SER  27  -8.591  10.277   3.501
  179    HG   SER  27           HG       SER  27 -10.119   9.659   4.831
  Start of MODEL    6
    1    H1   LEU   1           H1       LEU   1   5.189  -0.271   6.346
    2    H2   LEU   1           H2       LEU   1   4.255   0.876   5.531
    3    H3   LEU   1           H3       LEU   1   5.898   1.163   5.798
    4    HA   LEU   1           HA       LEU   1   5.469   0.529   3.514
    5    HB2  LEU   1           HB2      LEU   1   7.600  -0.038   4.706
    6    HB3  LEU   1           HB3      LEU   1   6.927  -1.616   5.060
    7    HG   LEU   1           HG       LEU   1   6.787  -2.059   2.614
    8   HD11  LEU   1          HD11      LEU   1   6.677   0.201   1.777
    9   HD12  LEU   1          HD12      LEU   1   8.101  -0.599   1.116
   10   HD13  LEU   1          HD13      LEU   1   8.273   0.558   2.434
   11   HD21  LEU   1          HD21      LEU   1   9.524  -1.333   3.647
   12   HD22  LEU   1          HD22      LEU   1   9.170  -2.437   2.317
   13   HD23  LEU   1          HD23      LEU   1   8.671  -2.845   3.959
   14    H    CYS   2           H        CYS   2   3.819  -0.293   2.415
   15    HA   CYS   2           HA       CYS   2   2.228  -2.430   3.539
   16    HB2  CYS   2           HB2      CYS   2   1.143  -0.469   2.534
   17    HB3  CYS   2           HB3      CYS   2   1.899  -0.838   0.988
   18    H    LEU   3           H        LEU   3   3.327  -4.317   3.368
   19    HA   LEU   3           HA       LEU   3   4.143  -5.163   0.672
   20    HB2  LEU   3           HB2      LEU   3   5.067  -6.124   3.373
   21    HB3  LEU   3           HB3      LEU   3   5.549  -6.847   1.852
   22    HG   LEU   3           HG       LEU   3   6.144  -4.020   2.720
   23   HD11  LEU   3          HD11      LEU   3   8.466  -4.792   2.832
   24   HD12  LEU   3          HD12      LEU   3   7.932  -6.432   2.471
   25   HD13  LEU   3          HD13      LEU   3   7.433  -5.652   3.971
   26   HD21  LEU   3          HD21      LEU   3   6.919  -5.542   0.235
   27   HD22  LEU   3          HD22      LEU   3   7.615  -3.999   0.722
   28   HD23  LEU   3          HD23      LEU   3   5.901  -4.105   0.325
   29    H    SER   4           H        SER   4   2.344  -6.153   3.544
   30    HA   SER   4           HA       SER   4   1.687  -8.740   2.518
   31    HB2  SER   4           HB2      SER   4   1.771  -8.302   4.931
   32    HB3  SER   4           HB3      SER   4   0.438  -7.161   4.778
   33    HG   SER   4           HG       SER   4  -0.611  -9.182   3.752
   34    H    CYS   5           H        CYS   5   0.658  -5.722   1.660
   35    HA   CYS   5           HA       CYS   5  -1.915  -6.755   0.693
   36    HB2  CYS   5           HB2      CYS   5  -1.191  -3.982   1.615
   37    HB3  CYS   5           HB3      CYS   5  -2.630  -4.324   0.665
   38    H    ARG   6           H        ARG   6  -2.661  -5.702  -1.317
   39    HA   ARG   6           HA       ARG   6  -0.397  -4.966  -3.053
   40    HB2  ARG   6           HB2      ARG   6  -1.451  -6.131  -4.881
   41    HB3  ARG   6           HB3      ARG   6  -1.320  -7.236  -3.524
   42    HG2  ARG   6           HG2      ARG   6  -3.612  -7.124  -3.061
   43    HG3  ARG   6           HG3      ARG   6  -3.830  -5.690  -4.063
   44    HD2  ARG   6           HD2      ARG   6  -4.724  -7.660  -5.174
   45    HD3  ARG   6           HD3      ARG   6  -3.347  -7.013  -6.062
   46    HE   ARG   6           HE       ARG   6  -2.545  -9.061  -4.252
   47   HH11  ARG   6          HH11      ARG   6  -4.089  -8.532  -7.350
   48   HH12  ARG   6          HH12      ARG   6  -3.615 -10.071  -7.993
   49   HH21  ARG   6          HH21      ARG   6  -1.923 -11.097  -5.096
   50   HH22  ARG   6          HH22      ARG   6  -2.384 -11.535  -6.710
   51    H    GLY   7           H        GLY   7  -1.184  -3.757  -5.047
   52    HA2  GLY   7           HA2      GLY   7  -3.013  -2.542  -6.071
   53    HA3  GLY   7           HA3      GLY   7  -3.611  -2.198  -4.458
   54    H    GLY   8           H        GLY   8  -2.641  -0.604  -6.891
   55    HA2  GLY   8           HA2      GLY   8  -2.066   1.662  -6.909
   56    HA3  GLY   8           HA3      GLY   8  -1.467   1.498  -5.268
   57    H    ASP   9           H        ASP   9   0.102   2.943  -6.696
   58    HA   ASP   9           HA       ASP   9   2.117   1.344  -8.034
   59    HB2  ASP   9           HB2      ASP   9   3.164   3.392  -8.625
   60    HB3  ASP   9           HB3      ASP   9   1.437   3.691  -8.776
   61    H    TYR  10           H        TYR  10   4.479   2.143  -7.348
   62    HA   TYR  10           HA       TYR  10   5.061   0.865  -4.969
   63    HB2  TYR  10           HB2      TYR  10   6.753   1.254  -6.672
   64    HB3  TYR  10           HB3      TYR  10   6.663   2.990  -6.394
   65    HD1  TYR  10           HD1      TYR  10   7.863   4.011  -4.622
   66    HD2  TYR  10           HD2      TYR  10   7.684  -0.224  -4.901
   67    HE1  TYR  10           HE1      TYR  10   9.618   3.834  -2.913
   68    HE2  TYR  10           HE2      TYR  10   9.437  -0.418  -3.191
   69    HH   TYR  10           HH       TYR  10  10.396   2.136  -1.233
   70    H    ASP  11           H        ASP  11   4.818   4.363  -5.571
   71    HA   ASP  11           HA       ASP  11   5.550   5.129  -2.968
   72    HB2  ASP  11           HB2      ASP  11   5.585   6.700  -4.859
   73    HB3  ASP  11           HB3      ASP  11   3.827   6.639  -4.933
   74    H    CYS  12           H        CYS  12   2.478   4.299  -4.423
   75    HA   CYS  12           HA       CYS  12   0.825   5.129  -2.294
   76    HB2  CYS  12           HB2      CYS  12  -0.006   4.619  -4.566
   77    HB3  CYS  12           HB3      CYS  12   0.353   2.919  -4.296
   78    H    ARG  13           H        ARG  13   2.850   2.361  -2.762
   79    HA   ARG  13           HA       ARG  13   1.536   0.878  -0.627
   80    HB2  ARG  13           HB2      ARG  13   3.990   0.099  -2.208
   81    HB3  ARG  13           HB3      ARG  13   2.981  -0.956  -1.228
   82    HG2  ARG  13           HG2      ARG  13   1.110  -0.580  -2.763
   83    HG3  ARG  13           HG3      ARG  13   2.141   0.455  -3.750
   84    HD2  ARG  13           HD2      ARG  13   2.147  -1.634  -4.819
   85    HD3  ARG  13           HD3      ARG  13   3.686  -1.538  -3.972
   86    HE   ARG  13           HE       ARG  13   2.080  -2.827  -2.211
   87   HH11  ARG  13          HH11      ARG  13   2.858  -3.308  -5.580
   88   HH12  ARG  13          HH12      ARG  13   2.654  -5.027  -5.519
   89   HH21  ARG  13          HH21      ARG  13   1.783  -5.119  -2.124
   90   HH22  ARG  13          HH22      ARG  13   2.061  -6.061  -3.561
   91    H    VAL  14           H        VAL  14   4.372   2.828  -1.180
   92    HA   VAL  14           HA       VAL  14   5.609   2.002   1.294
   93    HB   VAL  14           HB       VAL  14   6.886   2.703  -0.788
   94   HG11  VAL  14          HG11      VAL  14   5.540   4.762  -1.180
   95   HG12  VAL  14          HG12      VAL  14   7.284   5.006  -1.215
   96   HG13  VAL  14          HG13      VAL  14   6.353   5.491   0.203
   97   HG21  VAL  14          HG21      VAL  14   8.008   2.381   1.319
   98   HG22  VAL  14          HG22      VAL  14   7.535   3.990   1.855
   99   HG23  VAL  14          HG23      VAL  14   8.672   3.808   0.522
  100    H    LYS  15           H        LYS  15   3.439   4.465   0.221
  101    HA   LYS  15           HA       LYS  15   3.701   5.912   2.760
  102    HB2  LYS  15           HB2      LYS  15   2.080   6.600   0.303
  103    HB3  LYS  15           HB3      LYS  15   2.266   7.614   1.725
  104    HG2  LYS  15           HG2      LYS  15   4.508   6.794  -0.103
  105    HG3  LYS  15           HG3      LYS  15   3.636   8.322  -0.196
  106    HD2  LYS  15           HD2      LYS  15   4.322   8.650   2.248
  107    HD3  LYS  15           HD3      LYS  15   5.458   7.326   1.975
  108    HE2  LYS  15           HE2      LYS  15   5.348   9.955   0.497
  109    HE3  LYS  15           HE3      LYS  15   6.586   9.438   1.638
  110    HZ1  LYS  15           HZ1      LYS  15   7.174   7.654   0.091
  111    HZ2  LYS  15           HZ2      LYS  15   7.359   9.179  -0.608
  112    HZ3  LYS  15           HZ3      LYS  15   6.026   8.222  -1.020
  113    H    GLY  16           H        GLY  16   1.885   3.471   1.342
  114    HA2  GLY  16           HA2      GLY  16  -0.636   4.310   2.564
  115    HA3  GLY  16           HA3      GLY  16  -0.451   3.079   1.327
  116    H    THR  17           H        THR  17  -2.001   2.754   3.566
  117    HA   THR  17           HA       THR  17  -0.498   1.013   5.363
  118    HB   THR  17           HB       THR  17  -2.945   0.924   6.400
  119    HG1  THR  17           HG1      THR  17  -4.244   2.262   5.383
  120   HG21  THR  17          HG21      THR  17  -2.328   2.801   7.840
  121   HG22  THR  17          HG22      THR  17  -1.108   3.306   6.670
  122   HG23  THR  17          HG23      THR  17  -0.933   1.771   7.520
  123    H    CYS  18           H        CYS  18  -0.986  -1.129   5.645
  124    HA   CYS  18           HA       CYS  18  -2.161  -2.452   3.361
  125    HB2  CYS  18           HB2      CYS  18  -0.080  -3.294   4.332
  126    HB3  CYS  18           HB3      CYS  18  -0.874  -3.520   5.880
  127    H    GLU  19           H        GLU  19  -4.343  -2.138   3.422
  128    HA   GLU  19           HA       GLU  19  -5.741  -3.134   5.813
  129    HB2  GLU  19           HB2      GLU  19  -6.509  -0.871   3.975
  130    HB3  GLU  19           HB3      GLU  19  -7.559  -1.528   5.219
  131    HG2  GLU  19           HG2      GLU  19  -6.001  -0.852   6.940
  132    HG3  GLU  19           HG3      GLU  19  -4.865  -0.284   5.721
  133    H    ASN  20           H        ASN  20  -6.595  -5.006   5.387
  134    HA   ASN  20           HA       ASN  20  -7.823  -6.662   4.455
  135    HB2  ASN  20           HB2      ASN  20  -9.512  -4.786   4.584
  136    HB3  ASN  20           HB3      ASN  20  -9.197  -4.488   2.882
  137   HD21  ASN  20          HD21      ASN  20 -11.249  -4.974   2.230
  138   HD22  ASN  20          HD22      ASN  20 -11.905  -6.573   2.269
  139    H    GLY  21           H        GLY  21  -5.351  -6.108   3.215
  140    HA2  GLY  21           HA2      GLY  21  -4.273  -7.186   1.460
  141    HA3  GLY  21           HA3      GLY  21  -5.838  -7.502   0.733
  142    H    LYS  22           H        LYS  22  -5.694  -4.256   1.502
  143    HA   LYS  22           HA       LYS  22  -4.661  -3.619  -1.180
  144    HB2  LYS  22           HB2      LYS  22  -7.148  -3.392  -0.974
  145    HB3  LYS  22           HB3      LYS  22  -6.886  -2.174   0.263
  146    HG2  LYS  22           HG2      LYS  22  -5.703  -0.775  -1.364
  147    HG3  LYS  22           HG3      LYS  22  -5.995  -1.990  -2.611
  148    HD2  LYS  22           HD2      LYS  22  -8.436  -1.701  -2.235
  149    HD3  LYS  22           HD3      LYS  22  -8.066  -0.393  -1.111
  150    HE2  LYS  22           HE2      LYS  22  -7.284  -0.457  -4.026
  151    HE3  LYS  22           HE3      LYS  22  -8.655   0.430  -3.364
  152    HZ1  LYS  22           HZ1      LYS  22  -7.130   1.753  -2.049
  153    HZ2  LYS  22           HZ2      LYS  22  -6.727   1.852  -3.690
  154    HZ3  LYS  22           HZ3      LYS  22  -5.808   0.887  -2.655
  155    H    CYS  23           H        CYS  23  -3.121  -2.134  -1.287
  156    HA   CYS  23           HA       CYS  23  -2.193  -0.795   1.081
  157    HB2  CYS  23           HB2      CYS  23  -1.374  -0.508  -1.818
  158    HB3  CYS  23           HB3      CYS  23  -0.556   0.261  -0.463
  159    H    VAL  24           H        VAL  24  -3.506   0.715   1.856
  160    HA   VAL  24           HA       VAL  24  -4.903   2.516   0.031
  161    HB   VAL  24           HB       VAL  24  -5.137   2.292   3.036
  162   HG11  VAL  24          HG11      VAL  24  -5.837   4.462   2.148
  163   HG12  VAL  24          HG12      VAL  24  -7.217   3.543   2.750
  164   HG13  VAL  24          HG13      VAL  24  -6.919   3.652   1.014
  165   HG21  VAL  24          HG21      VAL  24  -5.817   0.211   1.957
  166   HG22  VAL  24          HG22      VAL  24  -6.886   1.109   0.878
  167   HG23  VAL  24          HG23      VAL  24  -7.217   1.064   2.611
  168    H    CYS  25           H        CYS  25  -3.711   4.184  -0.600
  169    HA   CYS  25           HA       CYS  25  -1.886   5.422   1.330
  170    HB2  CYS  25           HB2      CYS  25  -0.804   6.425  -0.691
  171    HB3  CYS  25           HB3      CYS  25  -0.740   4.666  -0.633
  172    H    GLY  26           H        GLY  26  -3.940   6.360   2.211
  173    HA2  GLY  26           HA2      GLY  26  -4.518   8.883   0.808
  174    HA3  GLY  26           HA3      GLY  26  -5.819   7.903   1.463
  175    H    SER  27           H        SER  27  -2.816   8.102   3.172
  176    HA   SER  27           HA       SER  27  -4.044   9.980   5.080
  177    HB2  SER  27           HB2      SER  27  -2.238   7.635   5.726
  178    HB3  SER  27           HB3      SER  27  -2.914   8.771   6.893
  179    HG   SER  27           HG       SER  27  -4.525   7.233   5.146
  Start of MODEL    7
    1    H1   LEU   1           H1       LEU   1   3.118   0.820   6.432
    2    H2   LEU   1           H2       LEU   1   2.556   1.864   5.226
    3    H3   LEU   1           H3       LEU   1   4.064   2.133   5.941
    4    HA   LEU   1           HA       LEU   1   4.271   1.175   3.736
    5    HB2  LEU   1           HB2      LEU   1   5.102  -0.567   6.056
    6    HB3  LEU   1           HB3      LEU   1   5.657  -0.825   4.414
    7    HG   LEU   1           HG       LEU   1   6.164   1.679   6.030
    8   HD11  LEU   1          HD11      LEU   1   8.466   0.876   6.168
    9   HD12  LEU   1          HD12      LEU   1   7.996  -0.620   5.359
   10   HD13  LEU   1          HD13      LEU   1   7.348  -0.237   6.953
   11   HD21  LEU   1          HD21      LEU   1   7.787   2.165   4.227
   12   HD22  LEU   1          HD22      LEU   1   6.117   2.149   3.664
   13   HD23  LEU   1          HD23      LEU   1   7.171   0.775   3.333
   14    H    CYS   2           H        CYS   2   3.675  -0.284   2.251
   15    HA   CYS   2           HA       CYS   2   1.936  -2.506   3.061
   16    HB2  CYS   2           HB2      CYS   2   0.569  -0.600   2.212
   17    HB3  CYS   2           HB3      CYS   2   1.460  -0.674   0.702
   18    H    LEU   3           H        LEU   3   4.380  -3.143   2.801
   19    HA   LEU   3           HA       LEU   3   5.209  -3.482   0.042
   20    HB2  LEU   3           HB2      LEU   3   6.573  -4.292   2.606
   21    HB3  LEU   3           HB3      LEU   3   7.288  -4.353   1.008
   22    HG   LEU   3           HG       LEU   3   6.458  -1.856   2.490
   23   HD11  LEU   3          HD11      LEU   3   9.177  -2.941   1.783
   24   HD12  LEU   3          HD12      LEU   3   8.470  -2.858   3.397
   25   HD13  LEU   3          HD13      LEU   3   8.856  -1.374   2.528
   26   HD21  LEU   3          HD21      LEU   3   7.711  -2.187  -0.233
   27   HD22  LEU   3          HD22      LEU   3   7.549  -0.657   0.627
   28   HD23  LEU   3          HD23      LEU   3   6.109  -1.540   0.120
   29    H    SER   4           H        SER   4   3.856  -5.360   2.633
   30    HA   SER   4           HA       SER   4   4.417  -7.881   1.314
   31    HB2  SER   4           HB2      SER   4   3.120  -8.820   3.257
   32    HB3  SER   4           HB3      SER   4   4.542  -7.881   3.711
   33    HG   SER   4           HG       SER   4   1.817  -7.099   3.803
   34    H    CYS   5           H        CYS   5   2.356  -5.552   0.580
   35    HA   CYS   5           HA       CYS   5   0.234  -7.402  -0.237
   36    HB2  CYS   5           HB2      CYS   5  -0.233  -4.629   0.882
   37    HB3  CYS   5           HB3      CYS   5  -1.474  -5.756   0.346
   38    H    ARG   6           H        ARG   6  -1.214  -6.278  -1.916
   39    HA   ARG   6           HA       ARG   6   0.328  -4.388  -3.543
   40    HB2  ARG   6           HB2      ARG   6  -0.263  -5.564  -5.598
   41    HB3  ARG   6           HB3      ARG   6   0.644  -6.618  -4.530
   42    HG2  ARG   6           HG2      ARG   6  -2.342  -6.696  -4.548
   43    HG3  ARG   6           HG3      ARG   6  -1.414  -7.537  -5.790
   44    HD2  ARG   6           HD2      ARG   6  -0.274  -8.842  -4.113
   45    HD3  ARG   6           HD3      ARG   6  -1.050  -7.924  -2.823
   46    HE   ARG   6           HE       ARG   6  -3.012  -9.089  -4.487
   47   HH11  ARG   6          HH11      ARG   6  -0.638  -9.953  -2.071
   48   HH12  ARG   6          HH12      ARG   6  -1.531 -11.323  -1.497
   49   HH21  ARG   6          HH21      ARG   6  -4.189 -10.898  -3.753
   50   HH22  ARG   6          HH22      ARG   6  -3.562 -11.862  -2.452
   51    H    GLY   7           H        GLY   7  -1.187  -3.573  -5.387
   52    HA2  GLY   7           HA2      GLY   7  -3.496  -3.075  -5.967
   53    HA3  GLY   7           HA3      GLY   7  -3.871  -3.133  -4.250
   54    H    GLY   8           H        GLY   8  -1.430  -1.511  -6.231
   55    HA2  GLY   8           HA2      GLY   8  -2.308   1.077  -6.124
   56    HA3  GLY   8           HA3      GLY   8  -1.459   0.837  -4.602
   57    H    ASP   9           H        ASP   9  -0.360   2.702  -6.111
   58    HA   ASP   9           HA       ASP   9   1.608   1.536  -7.879
   59    HB2  ASP   9           HB2      ASP   9   0.479   3.899  -8.051
   60    HB3  ASP   9           HB3      ASP   9   1.763   4.375  -6.946
   61    H    TYR  10           H        TYR  10   3.942   2.625  -7.482
   62    HA   TYR  10           HA       TYR  10   5.068   1.105  -5.428
   63    HB2  TYR  10           HB2      TYR  10   6.315   1.845  -7.406
   64    HB3  TYR  10           HB3      TYR  10   6.205   3.513  -6.861
   65    HD1  TYR  10           HD1      TYR  10   7.620   4.339  -5.094
   66    HD2  TYR  10           HD2      TYR  10   7.792   0.265  -6.289
   67    HE1  TYR  10           HE1      TYR  10   9.722   4.074  -3.854
   68    HE2  TYR  10           HE2      TYR  10   9.897  -0.017  -5.053
   69    HH   TYR  10           HH       TYR  10  11.713   1.290  -4.183
   70    H    ASP  11           H        ASP  11   4.790   4.644  -5.627
   71    HA   ASP  11           HA       ASP  11   5.659   5.161  -3.018
   72    HB2  ASP  11           HB2      ASP  11   4.651   7.390  -3.307
   73    HB3  ASP  11           HB3      ASP  11   5.588   6.913  -4.716
   74    H    CYS  12           H        CYS  12   2.577   4.212  -4.274
   75    HA   CYS  12           HA       CYS  12   0.973   5.015  -2.102
   76    HB2  CYS  12           HB2      CYS  12   0.117   4.386  -4.352
   77    HB3  CYS  12           HB3      CYS  12   0.511   2.709  -3.999
   78    H    ARG  13           H        ARG  13   3.096   2.304  -2.613
   79    HA   ARG  13           HA       ARG  13   2.009   0.885  -0.324
   80    HB2  ARG  13           HB2      ARG  13   4.498   0.204  -1.885
   81    HB3  ARG  13           HB3      ARG  13   3.583  -0.855  -0.824
   82    HG2  ARG  13           HG2      ARG  13   1.642  -0.448  -2.473
   83    HG3  ARG  13           HG3      ARG  13   2.910   0.105  -3.572
   84    HD2  ARG  13           HD2      ARG  13   2.642  -2.608  -2.283
   85    HD3  ARG  13           HD3      ARG  13   2.518  -2.220  -3.996
   86    HE   ARG  13           HE       ARG  13   4.992  -1.446  -3.558
   87   HH11  ARG  13          HH11      ARG  13   3.353  -4.276  -2.309
   88   HH12  ARG  13          HH12      ARG  13   4.797  -5.234  -2.238
   89   HH21  ARG  13          HH21      ARG  13   6.894  -2.704  -3.474
   90   HH22  ARG  13          HH22      ARG  13   6.814  -4.342  -2.911
   91    H    VAL  14           H        VAL  14   4.419   3.200  -1.008
   92    HA   VAL  14           HA       VAL  14   6.035   2.605   1.304
   93    HB   VAL  14           HB       VAL  14   6.059   5.015  -0.520
   94   HG11  VAL  14          HG11      VAL  14   7.025   5.516   1.664
   95   HG12  VAL  14          HG12      VAL  14   8.273   5.468   0.417
   96   HG13  VAL  14          HG13      VAL  14   8.083   4.110   1.526
   97   HG21  VAL  14          HG21      VAL  14   8.029   3.966  -1.533
   98   HG22  VAL  14          HG22      VAL  14   6.594   2.954  -1.703
   99   HG23  VAL  14          HG23      VAL  14   7.811   2.562  -0.490
  100    H    LYS  15           H        LYS  15   3.825   5.201   0.319
  101    HA   LYS  15           HA       LYS  15   3.604   6.006   3.132
  102    HB2  LYS  15           HB2      LYS  15   2.521   8.081   2.213
  103    HB3  LYS  15           HB3      LYS  15   4.199   7.857   1.742
  104    HG2  LYS  15           HG2      LYS  15   3.543   7.111  -0.443
  105    HG3  LYS  15           HG3      LYS  15   1.843   7.165   0.015
  106    HD2  LYS  15           HD2      LYS  15   1.876   9.536   0.191
  107    HD3  LYS  15           HD3      LYS  15   3.636   9.583   0.073
  108    HE2  LYS  15           HE2      LYS  15   2.490  10.260  -2.021
  109    HE3  LYS  15           HE3      LYS  15   3.555   8.874  -2.227
  110    HZ1  LYS  15           HZ1      LYS  15   1.465   7.498  -1.888
  111    HZ2  LYS  15           HZ2      LYS  15   1.627   8.303  -3.364
  112    HZ3  LYS  15           HZ3      LYS  15   0.604   8.927  -2.164
  113    H    GLY  16           H        GLY  16   2.366   3.648   2.166
  114    HA2  GLY  16           HA2      GLY  16  -0.435   4.372   2.667
  115    HA3  GLY  16           HA3      GLY  16  -0.021   3.231   1.394
  116    H    THR  17           H        THR  17  -1.744   2.472   3.303
  117    HA   THR  17           HA       THR  17  -0.170   0.633   4.980
  118    HB   THR  17           HB       THR  17  -2.384   0.659   6.382
  119    HG1  THR  17           HG1      THR  17  -3.614   1.991   5.054
  120   HG21  THR  17          HG21      THR  17  -1.497   2.495   7.758
  121   HG22  THR  17          HG22      THR  17  -0.430   2.961   6.432
  122   HG23  THR  17          HG23      THR  17  -0.219   1.402   7.228
  123    H    CYS  18           H        CYS  18  -0.797  -1.510   5.008
  124    HA   CYS  18           HA       CYS  18  -2.451  -2.374   2.818
  125    HB2  CYS  18           HB2      CYS  18  -0.440  -3.650   3.426
  126    HB3  CYS  18           HB3      CYS  18  -1.125  -3.979   5.014
  127    H    GLU  19           H        GLU  19  -4.529  -1.976   3.070
  128    HA   GLU  19           HA       GLU  19  -5.836  -2.800   5.578
  129    HB2  GLU  19           HB2      GLU  19  -6.618  -0.658   3.598
  130    HB3  GLU  19           HB3      GLU  19  -7.615  -1.165   4.952
  131    HG2  GLU  19           HG2      GLU  19  -4.866   0.042   5.173
  132    HG3  GLU  19           HG3      GLU  19  -6.386   0.901   5.417
  133    H    ASN  20           H        ASN  20  -7.086  -4.513   5.395
  134    HA   ASN  20           HA       ASN  20  -8.397  -6.162   4.556
  135    HB2  ASN  20           HB2      ASN  20  -9.253  -3.967   2.665
  136    HB3  ASN  20           HB3      ASN  20 -10.079  -5.507   2.845
  137   HD21  ASN  20          HD21      ASN  20  -9.649  -5.577   5.746
  138   HD22  ASN  20          HD22      ASN  20 -10.760  -4.430   6.411
  139    H    GLY  21           H        GLY  21  -5.700  -5.842   3.527
  140    HA2  GLY  21           HA2      GLY  21  -4.418  -7.096   2.064
  141    HA3  GLY  21           HA3      GLY  21  -5.903  -7.688   1.333
  142    H    LYS  22           H        LYS  22  -5.568  -4.263   1.576
  143    HA   LYS  22           HA       LYS  22  -4.483  -4.118  -1.151
  144    HB2  LYS  22           HB2      LYS  22  -6.968  -3.844  -1.203
  145    HB3  LYS  22           HB3      LYS  22  -6.799  -2.460  -0.133
  146    HG2  LYS  22           HG2      LYS  22  -5.296  -1.443  -1.892
  147    HG3  LYS  22           HG3      LYS  22  -5.843  -2.732  -2.966
  148    HD2  LYS  22           HD2      LYS  22  -8.156  -1.996  -2.668
  149    HD3  LYS  22           HD3      LYS  22  -7.610  -0.715  -1.582
  150    HE2  LYS  22           HE2      LYS  22  -6.937  -1.013  -4.509
  151    HE3  LYS  22           HE3      LYS  22  -7.996   0.200  -3.788
  152    HZ1  LYS  22           HZ1      LYS  22  -6.033   1.006  -2.531
  153    HZ2  LYS  22           HZ2      LYS  22  -5.888   1.192  -4.198
  154    HZ3  LYS  22           HZ3      LYS  22  -5.056  -0.054  -3.417
  155    H    CYS  23           H        CYS  23  -3.206  -2.355  -1.578
  156    HA   CYS  23           HA       CYS  23  -2.145  -0.917   0.660
  157    HB2  CYS  23           HB2      CYS  23  -1.630  -0.680  -2.306
  158    HB3  CYS  23           HB3      CYS  23  -0.740   0.204  -1.070
  159    H    VAL  24           H        VAL  24  -3.385   0.568   1.556
  160    HA   VAL  24           HA       VAL  24  -4.830   2.455  -0.168
  161    HB   VAL  24           HB       VAL  24  -5.163   1.888   2.784
  162   HG11  VAL  24          HG11      VAL  24  -6.771   3.689   0.969
  163   HG12  VAL  24          HG12      VAL  24  -5.670   4.219   2.242
  164   HG13  VAL  24          HG13      VAL  24  -7.136   3.330   2.659
  165   HG21  VAL  24          HG21      VAL  24  -5.972   0.060   1.398
  166   HG22  VAL  24          HG22      VAL  24  -6.917   1.191   0.430
  167   HG23  VAL  24          HG23      VAL  24  -7.328   0.925   2.123
  168    H    CYS  25           H        CYS  25  -3.689   4.202  -0.591
  169    HA   CYS  25           HA       CYS  25  -1.885   5.247   1.472
  170    HB2  CYS  25           HB2      CYS  25  -0.822   6.442  -0.519
  171    HB3  CYS  25           HB3      CYS  25  -0.598   4.699  -0.417
  172    H    GLY  26           H        GLY  26  -3.513   6.378   2.553
  173    HA2  GLY  26           HA2      GLY  26  -4.445   8.439   3.073
  174    HA3  GLY  26           HA3      GLY  26  -4.045   8.997   1.454
  175    H    SER  27           H        SER  27  -5.365   7.904  -0.314
  176    HA   SER  27           HA       SER  27  -7.944   6.898   0.309
  177    HB2  SER  27           HB2      SER  27  -8.221   9.330   0.924
  178    HB3  SER  27           HB3      SER  27  -7.895   9.732  -0.762
  179    HG   SER  27           HG       SER  27 -10.178   9.494  -0.078
  Start of MODEL    8
    1    H1   LEU   1           H1       LEU   1   2.732   1.561   4.825
    2    H2   LEU   1           H2       LEU   1   4.328   1.983   5.185
    3    H3   LEU   1           H3       LEU   1   3.637   0.606   5.883
    4    HA   LEU   1           HA       LEU   1   4.176   0.994   3.002
    5    HB2  LEU   1           HB2      LEU   1   6.230   0.662   4.268
    6    HB3  LEU   1           HB3      LEU   1   5.536  -0.718   5.091
    7    HG   LEU   1           HG       LEU   1   5.421  -1.899   2.878
    8   HD11  LEU   1          HD11      LEU   1   7.097   0.432   1.957
    9   HD12  LEU   1          HD12      LEU   1   5.465   0.042   1.411
   10   HD13  LEU   1          HD13      LEU   1   6.800  -1.049   1.050
   11   HD21  LEU   1          HD21      LEU   1   8.134  -1.002   3.838
   12   HD22  LEU   1          HD22      LEU   1   7.827  -2.393   2.798
   13   HD23  LEU   1          HD23      LEU   1   7.202  -2.369   4.446
   14    H    CYS   2           H        CYS   2   3.019  -0.266   1.716
   15    HA   CYS   2           HA       CYS   2   1.234  -2.241   2.847
   16    HB2  CYS   2           HB2      CYS   2   1.668  -1.484  -0.046
   17    HB3  CYS   2           HB3      CYS   2   0.302  -2.375   0.612
   18    H    LEU   3           H        LEU   3   2.858  -3.689   3.608
   19    HA   LEU   3           HA       LEU   3   4.558  -4.954   1.623
   20    HB2  LEU   3           HB2      LEU   3   5.404  -4.228   3.864
   21    HB3  LEU   3           HB3      LEU   3   4.395  -5.464   4.587
   22    HG   LEU   3           HG       LEU   3   5.669  -7.202   3.408
   23   HD11  LEU   3          HD11      LEU   3   7.293  -4.869   2.409
   24   HD12  LEU   3          HD12      LEU   3   6.382  -6.031   1.443
   25   HD13  LEU   3          HD13      LEU   3   7.814  -6.551   2.327
   26   HD21  LEU   3          HD21      LEU   3   6.333  -6.552   5.656
   27   HD22  LEU   3          HD22      LEU   3   7.369  -5.286   5.000
   28   HD23  LEU   3          HD23      LEU   3   7.744  -6.980   4.690
   29    H    SER   4           H        SER   4   1.832  -5.732   3.715
   30    HA   SER   4           HA       SER   4   1.928  -8.528   2.898
   31    HB2  SER   4           HB2      SER   4   0.048  -7.120   4.801
   32    HB3  SER   4           HB3      SER   4   0.174  -8.864   4.570
   33    HG   SER   4           HG       SER   4   2.600  -8.118   5.073
   34    H    CYS   5           H        CYS   5   1.072  -6.143   1.155
   35    HA   CYS   5           HA       CYS   5  -1.150  -7.448  -0.113
   36    HB2  CYS   5           HB2      CYS   5  -2.585  -5.349   0.038
   37    HB3  CYS   5           HB3      CYS   5  -2.455  -6.310   1.507
   38    H    ARG   6           H        ARG   6  -1.872  -6.221  -2.054
   39    HA   ARG   6           HA       ARG   6   0.340  -4.641  -3.193
   40    HB2  ARG   6           HB2      ARG   6  -1.646  -6.464  -4.554
   41    HB3  ARG   6           HB3      ARG   6  -0.514  -5.428  -5.408
   42    HG2  ARG   6           HG2      ARG   6   1.354  -6.639  -4.417
   43    HG3  ARG   6           HG3      ARG   6   0.221  -7.669  -3.539
   44    HD2  ARG   6           HD2      ARG   6  -0.687  -8.489  -5.650
   45    HD3  ARG   6           HD3      ARG   6   0.411  -7.435  -6.542
   46    HE   ARG   6           HE       ARG   6   1.795  -9.196  -4.763
   47   HH11  ARG   6          HH11      ARG   6   0.257  -8.985  -7.897
   48   HH12  ARG   6          HH12      ARG   6   1.224 -10.240  -8.602
   49   HH21  ARG   6          HH21      ARG   6   3.071 -10.862  -5.679
   50   HH22  ARG   6          HH22      ARG   6   2.819 -11.314  -7.335
   51    H    GLY   7           H        GLY   7  -0.703  -3.483  -5.287
   52    HA2  GLY   7           HA2      GLY   7  -2.711  -2.312  -6.035
   53    HA3  GLY   7           HA3      GLY   7  -3.100  -2.048  -4.342
   54    H    GLY   8           H        GLY   8  -2.255  -0.417  -6.913
   55    HA2  GLY   8           HA2      GLY   8  -1.594   1.815  -7.024
   56    HA3  GLY   8           HA3      GLY   8  -1.072   1.711  -5.353
   57    H    ASP   9           H        ASP   9   0.558   3.073  -6.881
   58    HA   ASP   9           HA       ASP   9   2.615   1.357  -7.992
   59    HB2  ASP   9           HB2      ASP   9   3.673   3.347  -8.743
   60    HB3  ASP   9           HB3      ASP   9   1.950   3.617  -8.974
   61    H    TYR  10           H        TYR  10   4.958   2.264  -7.313
   62    HA   TYR  10           HA       TYR  10   5.492   1.254  -4.791
   63    HB2  TYR  10           HB2      TYR  10   7.224   1.524  -6.491
   64    HB3  TYR  10           HB3      TYR  10   7.088   3.273  -6.371
   65    HD1  TYR  10           HD1      TYR  10   8.110   4.478  -4.562
   66    HD2  TYR  10           HD2      TYR  10   8.247   0.232  -4.681
   67    HE1  TYR  10           HE1      TYR  10   9.812   4.492  -2.790
   68    HE2  TYR  10           HE2      TYR  10   9.951   0.230  -2.912
   69    HH   TYR  10           HH       TYR  10  11.637   1.737  -1.969
   70    H    ASP  11           H        ASP  11   5.135   4.636  -5.793
   71    HA   ASP  11           HA       ASP  11   5.735   5.782  -3.297
   72    HB2  ASP  11           HB2      ASP  11   5.800   7.070  -5.362
   73    HB3  ASP  11           HB3      ASP  11   4.067   6.855  -5.574
   74    H    CYS  12           H        CYS  12   2.801   4.429  -4.585
   75    HA   CYS  12           HA       CYS  12   1.105   5.452  -2.515
   76    HB2  CYS  12           HB2      CYS  12   0.064   4.865  -4.577
   77    HB3  CYS  12           HB3      CYS  12   0.793   3.265  -4.569
   78    H    ARG  13           H        ARG  13   2.934   2.494  -3.068
   79    HA   ARG  13           HA       ARG  13   1.758   1.105  -0.843
   80    HB2  ARG  13           HB2      ARG  13   4.244   0.391  -2.405
   81    HB3  ARG  13           HB3      ARG  13   3.290  -0.686  -1.393
   82    HG2  ARG  13           HG2      ARG  13   1.381  -0.370  -2.933
   83    HG3  ARG  13           HG3      ARG  13   2.424   0.610  -3.966
   84    HD2  ARG  13           HD2      ARG  13   3.960  -1.363  -4.123
   85    HD3  ARG  13           HD3      ARG  13   2.726  -2.310  -3.293
   86    HE   ARG  13           HE       ARG  13   1.707  -0.950  -5.596
   87   HH11  ARG  13          HH11      ARG  13   3.397  -3.801  -4.501
   88   HH12  ARG  13          HH12      ARG  13   3.007  -4.730  -5.911
   89   HH21  ARG  13          HH21      ARG  13   1.171  -2.164  -7.450
   90   HH22  ARG  13          HH22      ARG  13   1.725  -3.806  -7.589
   91    H    VAL  14           H        VAL  14   4.593   3.059  -1.375
   92    HA   VAL  14           HA       VAL  14   6.104   2.114   0.814
   93    HB   VAL  14           HB       VAL  14   7.131   3.312  -1.071
   94   HG11  VAL  14          HG11      VAL  14   5.386   4.994  -1.428
   95   HG12  VAL  14          HG12      VAL  14   6.987   5.721  -1.277
   96   HG13  VAL  14          HG13      VAL  14   5.858   5.789   0.076
   97   HG21  VAL  14          HG21      VAL  14   7.540   4.635   1.604
   98   HG22  VAL  14          HG22      VAL  14   8.650   4.745   0.237
   99   HG23  VAL  14          HG23      VAL  14   8.355   3.190   1.012
  100    H    LYS  15           H        LYS  15   3.559   4.471   0.554
  101    HA   LYS  15           HA       LYS  15   3.850   4.973   3.431
  102    HB2  LYS  15           HB2      LYS  15   3.231   7.297   3.128
  103    HB3  LYS  15           HB3      LYS  15   4.660   6.921   2.177
  104    HG2  LYS  15           HG2      LYS  15   3.377   6.844   0.159
  105    HG3  LYS  15           HG3      LYS  15   1.873   7.016   1.060
  106    HD2  LYS  15           HD2      LYS  15   4.076   9.062   0.808
  107    HD3  LYS  15           HD3      LYS  15   2.474   9.138   0.075
  108    HE2  LYS  15           HE2      LYS  15   3.130   9.239   3.018
  109    HE3  LYS  15           HE3      LYS  15   2.522  10.558   2.023
  110    HZ1  LYS  15           HZ1      LYS  15   0.746   9.611   3.308
  111    HZ2  LYS  15           HZ2      LYS  15   1.063   8.065   2.707
  112    HZ3  LYS  15           HZ3      LYS  15   0.480   9.274   1.669
  113    H    GLY  16           H        GLY  16   2.134   3.215   1.704
  114    HA2  GLY  16           HA2      GLY  16  -0.508   4.268   2.382
  115    HA3  GLY  16           HA3      GLY  16  -0.182   2.899   1.323
  116    H    THR  17           H        THR  17  -2.071   2.822   3.337
  117    HA   THR  17           HA       THR  17  -0.858   1.208   5.454
  118    HB   THR  17           HB       THR  17  -3.175   1.258   6.435
  119    HG1  THR  17           HG1      THR  17  -4.120   1.795   4.285
  120   HG21  THR  17          HG21      THR  17  -1.897   3.940   5.887
  121   HG22  THR  17          HG22      THR  17  -1.457   2.829   7.184
  122   HG23  THR  17          HG23      THR  17  -3.046   3.592   7.179
  123    H    CYS  18           H        CYS  18  -1.113  -0.947   5.546
  124    HA   CYS  18           HA       CYS  18  -2.346  -2.260   3.274
  125    HB2  CYS  18           HB2      CYS  18  -0.097  -2.886   4.331
  126    HB3  CYS  18           HB3      CYS  18  -1.038  -3.591   5.640
  127    H    GLU  19           H        GLU  19  -4.531  -2.159   3.478
  128    HA   GLU  19           HA       GLU  19  -5.691  -3.119   6.012
  129    HB2  GLU  19           HB2      GLU  19  -6.616  -0.933   4.165
  130    HB3  GLU  19           HB3      GLU  19  -7.649  -1.632   5.397
  131    HG2  GLU  19           HG2      GLU  19  -4.998  -0.339   5.974
  132    HG3  GLU  19           HG3      GLU  19  -6.544   0.504   6.048
  133    H    ASN  20           H        ASN  20  -6.540  -5.040   5.733
  134    HA   ASN  20           HA       ASN  20  -7.823  -6.742   4.962
  135    HB2  ASN  20           HB2      ASN  20  -9.520  -4.872   5.057
  136    HB3  ASN  20           HB3      ASN  20  -9.256  -4.637   3.336
  137   HD21  ASN  20          HD21      ASN  20 -10.500  -6.777   5.778
  138   HD22  ASN  20          HD22      ASN  20 -11.478  -7.734   4.723
  139    H    GLY  21           H        GLY  21  -5.396  -6.284   3.646
  140    HA2  GLY  21           HA2      GLY  21  -4.294  -7.288   1.882
  141    HA3  GLY  21           HA3      GLY  21  -5.855  -7.822   1.268
  142    H    LYS  22           H        LYS  22  -5.794  -4.518   1.909
  143    HA   LYS  22           HA       LYS  22  -5.303  -3.931  -0.932
  144    HB2  LYS  22           HB2      LYS  22  -7.682  -3.830  -0.461
  145    HB3  LYS  22           HB3      LYS  22  -7.399  -2.795   0.928
  146    HG2  LYS  22           HG2      LYS  22  -8.242  -1.488  -0.904
  147    HG3  LYS  22           HG3      LYS  22  -6.569  -1.036  -0.576
  148    HD2  LYS  22           HD2      LYS  22  -5.797  -2.311  -2.459
  149    HD3  LYS  22           HD3      LYS  22  -7.410  -2.975  -2.726
  150    HE2  LYS  22           HE2      LYS  22  -6.656  -0.061  -2.946
  151    HE3  LYS  22           HE3      LYS  22  -6.881  -1.162  -4.304
  152    HZ1  LYS  22           HZ1      LYS  22  -9.184  -1.455  -3.646
  153    HZ2  LYS  22           HZ2      LYS  22  -8.847   0.179  -3.915
  154    HZ3  LYS  22           HZ3      LYS  22  -8.973  -0.406  -2.334
  155    H    CYS  23           H        CYS  23  -3.694  -2.561  -1.250
  156    HA   CYS  23           HA       CYS  23  -2.523  -1.052   0.861
  157    HB2  CYS  23           HB2      CYS  23  -1.233  -1.859  -1.092
  158    HB3  CYS  23           HB3      CYS  23  -2.145  -0.763  -2.124
  159    H    VAL  24           H        VAL  24  -3.481   0.630   1.731
  160    HA   VAL  24           HA       VAL  24  -5.152   2.353   0.031
  161    HB   VAL  24           HB       VAL  24  -5.213   2.096   3.039
  162   HG11  VAL  24          HG11      VAL  24  -7.321   3.329   2.872
  163   HG12  VAL  24          HG12      VAL  24  -7.095   3.475   1.129
  164   HG13  VAL  24          HG13      VAL  24  -5.968   4.265   2.232
  165   HG21  VAL  24          HG21      VAL  24  -7.072   0.915   0.979
  166   HG22  VAL  24          HG22      VAL  24  -7.315   0.868   2.724
  167   HG23  VAL  24          HG23      VAL  24  -5.947   0.021   2.000
  168    H    CYS  25           H        CYS  25  -3.615   3.735  -0.726
  169    HA   CYS  25           HA       CYS  25  -2.057   5.252   1.213
  170    HB2  CYS  25           HB2      CYS  25  -1.039   6.280  -0.861
  171    HB3  CYS  25           HB3      CYS  25  -0.753   4.557  -0.655
  172    H    GLY  26           H        GLY  26  -3.866   6.288   2.149
  173    HA2  GLY  26           HA2      GLY  26  -5.899   7.622   0.792
  174    HA3  GLY  26           HA3      GLY  26  -5.388   7.987   2.431
  175    H    SER  27           H        SER  27  -2.845   8.936   2.026
  176    HA   SER  27           HA       SER  27  -2.919  10.983  -0.013
  177    HB2  SER  27           HB2      SER  27  -2.867  11.730   2.924
  178    HB3  SER  27           HB3      SER  27  -2.662  12.846   1.577
  179    HG   SER  27           HG       SER  27  -4.889  11.547   1.101
  Start of MODEL    9
    1    H1   LEU   1           H1       LEU   1   3.593   1.763   5.608
    2    H2   LEU   1           H2       LEU   1   2.599   0.438   5.942
    3    H3   LEU   1           H3       LEU   1   2.139   1.565   4.767
    4    HA   LEU   1           HA       LEU   1   3.942   0.936   3.352
    5    HB2  LEU   1           HB2      LEU   1   4.605  -0.979   5.598
    6    HB3  LEU   1           HB3      LEU   1   5.308  -1.064   3.997
    7    HG   LEU   1           HG       LEU   1   5.631   1.275   5.884
    8   HD11  LEU   1          HD11      LEU   1   6.733  -0.727   6.741
    9   HD12  LEU   1          HD12      LEU   1   7.912   0.461   6.185
   10   HD13  LEU   1          HD13      LEU   1   7.544  -0.950   5.192
   11   HD21  LEU   1          HD21      LEU   1   5.816   1.937   3.564
   12   HD22  LEU   1          HD22      LEU   1   6.926   0.606   3.243
   13   HD23  LEU   1          HD23      LEU   1   7.414   1.926   4.308
   14    H    CYS   2           H        CYS   2   3.582  -0.649   1.796
   15    HA   CYS   2           HA       CYS   2   1.419  -2.547   2.431
   16    HB2  CYS   2           HB2      CYS   2   2.130  -1.426  -0.284
   17    HB3  CYS   2           HB3      CYS   2   0.748  -2.436   0.109
   18    H    LEU   3           H        LEU   3   3.058  -4.013   3.193
   19    HA   LEU   3           HA       LEU   3   4.819  -5.100   1.124
   20    HB2  LEU   3           HB2      LEU   3   4.720  -5.715   4.077
   21    HB3  LEU   3           HB3      LEU   3   5.937  -6.279   2.948
   22    HG   LEU   3           HG       LEU   3   5.478  -3.397   3.730
   23   HD11  LEU   3          HD11      LEU   3   7.600  -3.587   4.906
   24   HD12  LEU   3          HD12      LEU   3   7.697  -5.294   4.477
   25   HD13  LEU   3          HD13      LEU   3   6.417  -4.724   5.549
   26   HD21  LEU   3          HD21      LEU   3   7.607  -3.000   2.542
   27   HD22  LEU   3          HD22      LEU   3   6.315  -3.538   1.470
   28   HD23  LEU   3          HD23      LEU   3   7.574  -4.669   1.972
   29    H    SER   4           H        SER   4   2.179  -6.000   3.260
   30    HA   SER   4           HA       SER   4   2.118  -8.660   2.017
   31    HB2  SER   4           HB2      SER   4   0.768  -7.720   4.555
   32    HB3  SER   4           HB3      SER   4   0.841  -9.377   3.957
   33    HG   SER   4           HG       SER   4   2.507  -8.338   5.592
   34    H    CYS   5           H        CYS   5   1.167  -6.468   0.561
   35    HA   CYS   5           HA       CYS   5  -1.447  -7.353  -0.109
   36    HB2  CYS   5           HB2      CYS   5  -2.502  -5.058   0.281
   37    HB3  CYS   5           HB3      CYS   5  -2.249  -6.063   1.704
   38    H    ARG   6           H        ARG   6  -2.420  -5.703  -1.778
   39    HA   ARG   6           HA       ARG   6  -0.311  -4.426  -3.338
   40    HB2  ARG   6           HB2      ARG   6  -0.739  -5.635  -5.323
   41    HB3  ARG   6           HB3      ARG   6  -0.604  -6.847  -4.064
   42    HG2  ARG   6           HG2      ARG   6  -3.192  -5.799  -5.186
   43    HG3  ARG   6           HG3      ARG   6  -2.414  -7.307  -5.654
   44    HD2  ARG   6           HD2      ARG   6  -3.523  -6.590  -2.947
   45    HD3  ARG   6           HD3      ARG   6  -4.172  -7.773  -4.080
   46    HE   ARG   6           HE       ARG   6  -1.526  -8.482  -3.463
   47   HH11  ARG   6          HH11      ARG   6  -4.691  -8.325  -1.972
   48   HH12  ARG   6          HH12      ARG   6  -4.350  -9.576  -0.821
   49   HH21  ARG   6          HH21      ARG   6  -1.071 -10.112  -1.928
   50   HH22  ARG   6          HH22      ARG   6  -2.296 -10.594  -0.795
   51    H    GLY   7           H        GLY   7  -1.370  -3.359  -5.349
   52    HA2  GLY   7           HA2      GLY   7  -3.790  -2.779  -6.049
   53    HA3  GLY   7           HA3      GLY   7  -3.848  -2.061  -4.446
   54    H    GLY   8           H        GLY   8  -1.551  -0.750  -4.163
   55    HA2  GLY   8           HA2      GLY   8  -1.836   1.342  -6.200
   56    HA3  GLY   8           HA3      GLY   8  -1.177   1.560  -4.586
   57    H    ASP   9           H        ASP   9   0.284   2.704  -6.356
   58    HA   ASP   9           HA       ASP   9   2.281   0.922  -7.463
   59    HB2  ASP   9           HB2      ASP   9   2.049   3.932  -7.481
   60    HB3  ASP   9           HB3      ASP   9   3.336   3.035  -8.270
   61    H    TYR  10           H        TYR  10   4.619   2.186  -7.174
   62    HA   TYR  10           HA       TYR  10   5.621   1.279  -4.784
   63    HB2  TYR  10           HB2      TYR  10   7.058   1.814  -6.671
   64    HB3  TYR  10           HB3      TYR  10   6.677   3.524  -6.506
   65    HD1  TYR  10           HD1      TYR  10   8.467   0.693  -4.987
   66    HD2  TYR  10           HD2      TYR  10   7.770   4.883  -4.863
   67    HE1  TYR  10           HE1      TYR  10  10.376   0.960  -3.461
   68    HE2  TYR  10           HE2      TYR  10   9.675   5.164  -3.338
   69    HH   TYR  10           HH       TYR  10  10.962   3.827  -1.732
   70    H    ASP  11           H        ASP  11   4.827   4.652  -5.590
   71    HA   ASP  11           HA       ASP  11   5.518   5.798  -3.157
   72    HB2  ASP  11           HB2      ASP  11   4.097   7.680  -3.805
   73    HB3  ASP  11           HB3      ASP  11   5.012   7.101  -5.190
   74    H    CYS  12           H        CYS  12   2.580   4.158  -4.125
   75    HA   CYS  12           HA       CYS  12   1.118   4.832  -1.768
   76    HB2  CYS  12           HB2      CYS  12   0.713   2.768  -3.922
   77    HB3  CYS  12           HB3      CYS  12  -0.364   2.900  -2.537
   78    H    ARG  13           H        ARG  13   3.283   2.248  -2.706
   79    HA   ARG  13           HA       ARG  13   2.494   0.524  -0.549
   80    HB2  ARG  13           HB2      ARG  13   4.961   0.378  -2.294
   81    HB3  ARG  13           HB3      ARG  13   4.354  -0.902  -1.255
   82    HG2  ARG  13           HG2      ARG  13   2.258  -0.892  -2.626
   83    HG3  ARG  13           HG3      ARG  13   3.078   0.209  -3.738
   84    HD2  ARG  13           HD2      ARG  13   3.268  -2.042  -4.572
   85    HD3  ARG  13           HD3      ARG  13   4.854  -1.493  -4.039
   86    HE   ARG  13           HE       ARG  13   4.394  -2.796  -1.955
   87   HH11  ARG  13          HH11      ARG  13   2.899  -3.652  -5.001
   88   HH12  ARG  13          HH12      ARG  13   2.629  -5.301  -4.555
   89   HH21  ARG  13          HH21      ARG  13   4.059  -4.976  -1.367
   90   HH22  ARG  13          HH22      ARG  13   3.286  -6.058  -2.482
   91    H    VAL  14           H        VAL  14   4.416   3.256  -0.795
   92    HA   VAL  14           HA       VAL  14   6.132   2.508   1.431
   93    HB   VAL  14           HB       VAL  14   6.103   5.018  -0.249
   94   HG11  VAL  14          HG11      VAL  14   6.961   5.504   1.957
   95   HG12  VAL  14          HG12      VAL  14   8.297   5.465   0.806
   96   HG13  VAL  14          HG13      VAL  14   8.025   4.101   1.888
   97   HG21  VAL  14          HG21      VAL  14   6.793   3.047  -1.501
   98   HG22  VAL  14          HG22      VAL  14   7.979   2.655  -0.256
   99   HG23  VAL  14          HG23      VAL  14   8.164   4.119  -1.221
  100    H    LYS  15           H        LYS  15   3.892   5.191   0.610
  101    HA   LYS  15           HA       LYS  15   3.809   5.773   3.482
  102    HB2  LYS  15           HB2      LYS  15   3.109   7.998   2.946
  103    HB3  LYS  15           HB3      LYS  15   4.511   7.600   1.971
  104    HG2  LYS  15           HG2      LYS  15   3.129   7.268   0.028
  105    HG3  LYS  15           HG3      LYS  15   1.669   7.520   0.989
  106    HD2  LYS  15           HD2      LYS  15   2.473   9.802   1.533
  107    HD3  LYS  15           HD3      LYS  15   3.853   9.540   0.469
  108    HE2  LYS  15           HE2      LYS  15   2.112  10.829  -0.650
  109    HE3  LYS  15           HE3      LYS  15   2.344   9.270  -1.436
  110    HZ1  LYS  15           HZ1      LYS  15   0.214   9.767   0.576
  111    HZ2  LYS  15           HZ2      LYS  15   0.370   8.444  -0.477
  112    HZ3  LYS  15           HZ3      LYS  15  -0.013   9.967  -1.090
  113    H    GLY  16           H        GLY  16   2.142   3.874   1.589
  114    HA2  GLY  16           HA2      GLY  16  -0.517   4.760   2.414
  115    HA3  GLY  16           HA3      GLY  16  -0.162   3.451   1.293
  116    H    THR  17           H        THR  17  -1.997   2.949   3.130
  117    HA   THR  17           HA       THR  17  -0.654   1.490   5.288
  118    HB   THR  17           HB       THR  17  -3.074   1.406   6.202
  119    HG1  THR  17           HG1      THR  17  -4.495   2.393   4.985
  120   HG21  THR  17          HG21      THR  17  -1.298   2.703   7.246
  121   HG22  THR  17          HG22      THR  17  -2.808   3.613   7.261
  122   HG23  THR  17          HG23      THR  17  -1.550   4.012   6.089
  123    H    CYS  18           H        CYS  18  -0.816  -0.666   5.406
  124    HA   CYS  18           HA       CYS  18  -2.077  -2.071   3.206
  125    HB2  CYS  18           HB2      CYS  18   0.220  -2.608   4.176
  126    HB3  CYS  18           HB3      CYS  18  -0.624  -3.263   5.572
  127    H    GLU  19           H        GLU  19  -4.261  -2.109   3.442
  128    HA   GLU  19           HA       GLU  19  -5.325  -3.155   5.977
  129    HB2  GLU  19           HB2      GLU  19  -6.410  -0.819   4.403
  130    HB3  GLU  19           HB3      GLU  19  -7.196  -1.542   5.797
  131    HG2  GLU  19           HG2      GLU  19  -5.381  -0.866   7.227
  132    HG3  GLU  19           HG3      GLU  19  -4.470  -0.267   5.845
  133    H    ASN  20           H        ASN  20  -6.596  -4.812   5.732
  134    HA   ASN  20           HA       ASN  20  -8.018  -6.362   4.897
  135    HB2  ASN  20           HB2      ASN  20  -9.388  -4.180   4.638
  136    HB3  ASN  20           HB3      ASN  20  -9.031  -4.334   2.925
  137   HD21  ASN  20          HD21      ASN  20 -10.720  -5.671   5.629
  138   HD22  ASN  20          HD22      ASN  20 -11.754  -6.726   4.728
  139    H    GLY  21           H        GLY  21  -5.392  -6.075   3.757
  140    HA2  GLY  21           HA2      GLY  21  -4.208  -7.254   2.165
  141    HA3  GLY  21           HA3      GLY  21  -5.739  -7.806   1.498
  142    H    LYS  22           H        LYS  22  -5.718  -4.468   1.811
  143    HA   LYS  22           HA       LYS  22  -4.935  -4.170  -1.011
  144    HB2  LYS  22           HB2      LYS  22  -7.402  -4.014  -0.604
  145    HB3  LYS  22           HB3      LYS  22  -7.097  -2.649   0.456
  146    HG2  LYS  22           HG2      LYS  22  -6.159  -1.398  -1.431
  147    HG3  LYS  22           HG3      LYS  22  -6.515  -2.759  -2.496
  148    HD2  LYS  22           HD2      LYS  22  -8.903  -2.540  -1.930
  149    HD3  LYS  22           HD3      LYS  22  -8.522  -1.142  -0.924
  150    HE2  LYS  22           HE2      LYS  22  -9.313  -0.349  -3.043
  151    HE3  LYS  22           HE3      LYS  22  -7.582  -0.027  -2.945
  152    HZ1  LYS  22           HZ1      LYS  22  -8.085  -0.891  -5.091
  153    HZ2  LYS  22           HZ2      LYS  22  -8.904  -2.218  -4.442
  154    HZ3  LYS  22           HZ3      LYS  22  -7.231  -2.084  -4.249
  155    H    CYS  23           H        CYS  23  -3.551  -2.578  -1.477
  156    HA   CYS  23           HA       CYS  23  -2.322  -1.088   0.640
  157    HB2  CYS  23           HB2      CYS  23  -1.080  -1.932  -1.347
  158    HB3  CYS  23           HB3      CYS  23  -1.975  -0.800  -2.350
  159    H    VAL  24           H        VAL  24  -3.399   0.530   1.531
  160    HA   VAL  24           HA       VAL  24  -5.194   2.154  -0.124
  161    HB   VAL  24           HB       VAL  24  -4.981   1.998   2.887
  162   HG11  VAL  24          HG11      VAL  24  -7.124   3.191   2.886
  163   HG12  VAL  24          HG12      VAL  24  -7.052   3.315   1.128
  164   HG13  VAL  24          HG13      VAL  24  -5.850   4.142   2.120
  165   HG21  VAL  24          HG21      VAL  24  -7.070   0.724   2.786
  166   HG22  VAL  24          HG22      VAL  24  -5.766  -0.105   1.938
  167   HG23  VAL  24          HG23      VAL  24  -7.004   0.755   1.025
  168    H    CYS  25           H        CYS  25  -4.065   3.780  -1.016
  169    HA   CYS  25           HA       CYS  25  -2.348   5.356   0.769
  170    HB2  CYS  25           HB2      CYS  25  -1.222   6.158  -1.303
  171    HB3  CYS  25           HB3      CYS  25  -1.038   4.432  -1.007
  172    H    GLY  26           H        GLY  26  -4.288   6.400   1.519
  173    HA2  GLY  26           HA2      GLY  26  -5.476   8.277  -0.403
  174    HA3  GLY  26           HA3      GLY  26  -6.153   7.854   1.162
  175    H    SER  27           H        SER  27  -3.330   8.121   2.271
  176    HA   SER  27           HA       SER  27  -3.552  10.972   2.823
  177    HB2  SER  27           HB2      SER  27  -1.775   8.879   4.098
  178    HB3  SER  27           HB3      SER  27  -2.023  10.525   4.679
  179    HG   SER  27           HG       SER  27  -3.505   8.325   5.125
  Start of MODEL   10
    1    H1   LEU   1           H1       LEU   1   4.087  -0.704   6.517
    2    H2   LEU   1           H2       LEU   1   5.377   0.377   6.364
    3    H3   LEU   1           H3       LEU   1   5.588  -1.254   5.974
    4    HA   LEU   1           HA       LEU   1   3.764   0.602   4.586
    5    HB2  LEU   1           HB2      LEU   1   5.320   0.804   2.832
    6    HB3  LEU   1           HB3      LEU   1   6.215   1.092   4.299
    7    HG   LEU   1           HG       LEU   1   7.689  -0.123   3.001
    8   HD11  LEU   1          HD11      LEU   1   6.316  -2.236   4.635
    9   HD12  LEU   1          HD12      LEU   1   7.570  -1.126   5.191
   10   HD13  LEU   1          HD13      LEU   1   7.944  -2.337   3.964
   11   HD21  LEU   1          HD21      LEU   1   5.455  -1.962   2.179
   12   HD22  LEU   1          HD22      LEU   1   7.136  -2.081   1.665
   13   HD23  LEU   1          HD23      LEU   1   6.169  -0.681   1.200
   14    H    CYS   2           H        CYS   2   3.154  -0.369   2.410
   15    HA   CYS   2           HA       CYS   2   1.737  -2.731   3.082
   16    HB2  CYS   2           HB2      CYS   2   1.980  -1.337   0.417
   17    HB3  CYS   2           HB3      CYS   2   0.759  -2.523   0.852
   18    H    LEU   3           H        LEU   3   3.253  -4.351   3.440
   19    HA   LEU   3           HA       LEU   3   4.601  -5.384   1.047
   20    HB2  LEU   3           HB2      LEU   3   4.830  -6.171   3.948
   21    HB3  LEU   3           HB3      LEU   3   5.677  -6.975   2.641
   22    HG   LEU   3           HG       LEU   3   6.037  -4.089   3.444
   23   HD11  LEU   3          HD11      LEU   3   7.814  -6.485   3.871
   24   HD12  LEU   3          HD12      LEU   3   6.918  -5.619   5.119
   25   HD13  LEU   3          HD13      LEU   3   8.227  -4.814   4.252
   26   HD21  LEU   3          HD21      LEU   3   8.001  -4.207   1.931
   27   HD22  LEU   3          HD22      LEU   3   6.458  -4.351   1.092
   28   HD23  LEU   3          HD23      LEU   3   7.442  -5.788   1.385
   29    H    SER   4           H        SER   4   2.189  -6.176   3.467
   30    HA   SER   4           HA       SER   4   1.579  -8.723   2.220
   31    HB2  SER   4           HB2      SER   4   1.526  -8.529   4.672
   32    HB3  SER   4           HB3      SER   4   0.288  -7.284   4.552
   33    HG   SER   4           HG       SER   4  -0.659  -9.283   3.192
   34    H    CYS   5           H        CYS   5   0.926  -5.647   1.440
   35    HA   CYS   5           HA       CYS   5  -1.772  -6.271   0.478
   36    HB2  CYS   5           HB2      CYS   5  -0.770  -3.654   1.597
   37    HB3  CYS   5           HB3      CYS   5  -2.301  -3.841   0.747
   38    H    ARG   6           H        ARG   6  -2.329  -5.584  -1.511
   39    HA   ARG   6           HA       ARG   6  -0.161  -4.501  -3.178
   40    HB2  ARG   6           HB2      ARG   6  -1.285  -5.632  -5.074
   41    HB3  ARG   6           HB3      ARG   6  -0.759  -6.762  -3.832
   42    HG2  ARG   6           HG2      ARG   6  -3.029  -6.894  -2.970
   43    HG3  ARG   6           HG3      ARG   6  -3.565  -5.738  -4.191
   44    HD2  ARG   6           HD2      ARG   6  -4.066  -8.070  -4.805
   45    HD3  ARG   6           HD3      ARG   6  -2.990  -7.281  -5.957
   46    HE   ARG   6           HE       ARG   6  -1.276  -8.529  -4.269
   47   HH11  ARG   6          HH11      ARG   6  -4.093  -9.636  -6.021
   48   HH12  ARG   6          HH12      ARG   6  -3.469 -11.234  -6.272
   49   HH21  ARG   6          HH21      ARG   6  -0.436 -10.627  -4.613
   50   HH22  ARG   6          HH22      ARG   6  -1.383 -11.795  -5.481
   51    H    GLY   7           H        GLY   7  -1.159  -3.404  -5.212
   52    HA2  GLY   7           HA2      GLY   7  -3.091  -2.139  -6.016
   53    HA3  GLY   7           HA3      GLY   7  -3.432  -1.745  -4.336
   54    H    GLY   8           H        GLY   8  -2.459  -0.381  -7.041
   55    HA2  GLY   8           HA2      GLY   8  -1.599   1.751  -7.354
   56    HA3  GLY   8           HA3      GLY   8  -1.171   1.792  -5.654
   57    H    ASP   9           H        ASP   9   0.643   2.882  -7.090
   58    HA   ASP   9           HA       ASP   9   2.615   0.984  -8.035
   59    HB2  ASP   9           HB2      ASP   9   2.718   3.992  -7.756
   60    HB3  ASP   9           HB3      ASP   9   4.011   3.013  -8.429
   61    H    TYR  10           H        TYR  10   4.983   1.774  -7.235
   62    HA   TYR  10           HA       TYR  10   5.268   0.693  -4.689
   63    HB2  TYR  10           HB2      TYR  10   7.087   0.776  -6.331
   64    HB3  TYR  10           HB3      TYR  10   7.156   2.526  -6.172
   65    HD1  TYR  10           HD1      TYR  10   7.545  -0.614  -4.244
   66    HD2  TYR  10           HD2      TYR  10   8.544   3.504  -4.568
   67    HE1  TYR  10           HE1      TYR  10   9.169  -0.873  -2.423
   68    HE2  TYR  10           HE2      TYR  10  10.179   3.259  -2.746
   69    HH   TYR  10           HH       TYR  10  11.148   0.183  -1.561
   70    H    ASP  11           H        ASP  11   5.392   4.078  -5.717
   71    HA   ASP  11           HA       ASP  11   5.921   5.258  -3.255
   72    HB2  ASP  11           HB2      ASP  11   6.026   6.437  -5.420
   73    HB3  ASP  11           HB3      ASP  11   4.270   6.384  -5.526
   74    H    CYS  12           H        CYS  12   2.945   3.991  -4.526
   75    HA   CYS  12           HA       CYS  12   1.265   5.158  -2.510
   76    HB2  CYS  12           HB2      CYS  12   0.164   4.601  -4.535
   77    HB3  CYS  12           HB3      CYS  12   0.879   2.996  -4.575
   78    H    ARG  13           H        ARG  13   2.996   2.147  -2.983
   79    HA   ARG  13           HA       ARG  13   1.695   0.788  -0.815
   80    HB2  ARG  13           HB2      ARG  13   4.193   0.026  -2.341
   81    HB3  ARG  13           HB3      ARG  13   3.233  -1.040  -1.321
   82    HG2  ARG  13           HG2      ARG  13   1.325  -0.752  -2.822
   83    HG3  ARG  13           HG3      ARG  13   2.300   0.302  -3.848
   84    HD2  ARG  13           HD2      ARG  13   3.870  -1.610  -4.184
   85    HD3  ARG  13           HD3      ARG  13   2.727  -2.635  -3.309
   86    HE   ARG  13           HE       ARG  13   1.674  -1.160  -5.583
   87   HH11  ARG  13          HH11      ARG  13   2.926  -4.208  -4.378
   88   HH12  ARG  13          HH12      ARG  13   2.224  -5.132  -5.666
   89   HH21  ARG  13          HH21      ARG  13   0.756  -2.376  -7.255
   90   HH22  ARG  13          HH22      ARG  13   0.995  -4.096  -7.302
   91    H    VAL  14           H        VAL  14   4.218   3.007  -1.037
   92    HA   VAL  14           HA       VAL  14   5.571   2.113   1.355
   93    HB   VAL  14           HB       VAL  14   5.943   4.631  -0.271
   94   HG11  VAL  14          HG11      VAL  14   8.072   4.844   0.939
   95   HG12  VAL  14          HG12      VAL  14   7.627   3.465   1.943
   96   HG13  VAL  14          HG13      VAL  14   6.683   4.953   2.021
   97   HG21  VAL  14          HG21      VAL  14   7.510   2.060  -0.208
   98   HG22  VAL  14          HG22      VAL  14   7.972   3.515  -1.091
   99   HG23  VAL  14          HG23      VAL  14   6.504   2.643  -1.532
  100    H    LYS  15           H        LYS  15   3.422   4.749   0.372
  101    HA   LYS  15           HA       LYS  15   3.454   5.822   3.077
  102    HB2  LYS  15           HB2      LYS  15   2.325   7.737   2.212
  103    HB3  LYS  15           HB3      LYS  15   3.585   7.315   1.063
  104    HG2  LYS  15           HG2      LYS  15   2.044   6.454  -0.484
  105    HG3  LYS  15           HG3      LYS  15   0.747   6.422   0.709
  106    HD2  LYS  15           HD2      LYS  15   0.353   8.280  -0.739
  107    HD3  LYS  15           HD3      LYS  15   0.892   8.920   0.814
  108    HE2  LYS  15           HE2      LYS  15   1.985  10.116  -0.977
  109    HE3  LYS  15           HE3      LYS  15   3.173   9.145  -0.110
  110    HZ1  LYS  15           HZ1      LYS  15   3.040   7.479  -1.851
  111    HZ2  LYS  15           HZ2      LYS  15   3.457   8.980  -2.510
  112    HZ3  LYS  15           HZ3      LYS  15   1.880   8.395  -2.675
  113    H    GLY  16           H        GLY  16   1.599   3.680   1.231
  114    HA2  GLY  16           HA2      GLY  16  -0.972   4.383   2.292
  115    HA3  GLY  16           HA3      GLY  16  -0.591   2.982   1.301
  116    H    THR  17           H        THR  17  -2.342   2.882   3.423
  117    HA   THR  17           HA       THR  17  -0.893   1.464   5.522
  118    HB   THR  17           HB       THR  17  -3.234   1.303   6.540
  119    HG1  THR  17           HG1      THR  17  -4.821   2.054   5.364
  120   HG21  THR  17          HG21      THR  17  -2.046   4.046   6.094
  121   HG22  THR  17          HG22      THR  17  -1.554   2.897   7.337
  122   HG23  THR  17          HG23      THR  17  -3.168   3.604   7.382
  123    H    CYS  18           H        CYS  18  -0.857  -0.701   5.622
  124    HA   CYS  18           HA       CYS  18  -2.023  -2.218   3.477
  125    HB2  CYS  18           HB2      CYS  18   0.217  -2.737   4.422
  126    HB3  CYS  18           HB3      CYS  18  -0.550  -3.173   5.942
  127    H    GLU  19           H        GLU  19  -4.209  -2.255   3.613
  128    HA   GLU  19           HA       GLU  19  -5.337  -3.398   6.072
  129    HB2  GLU  19           HB2      GLU  19  -6.521  -1.218   4.358
  130    HB3  GLU  19           HB3      GLU  19  -7.350  -2.000   5.695
  131    HG2  GLU  19           HG2      GLU  19  -5.516  -1.211   7.193
  132    HG3  GLU  19           HG3      GLU  19  -4.876  -0.294   5.835
  133    H    ASN  20           H        ASN  20  -5.891  -5.363   5.612
  134    HA   ASN  20           HA       ASN  20  -7.025  -7.130   4.767
  135    HB2  ASN  20           HB2      ASN  20  -8.873  -5.341   5.021
  136    HB3  ASN  20           HB3      ASN  20  -8.791  -5.213   3.271
  137   HD21  ASN  20          HD21      ASN  20  -9.621  -7.219   5.962
  138   HD22  ASN  20          HD22      ASN  20 -10.539  -8.388   5.076
  139    H    GLY  21           H        GLY  21  -4.742  -6.274   3.345
  140    HA2  GLY  21           HA2      GLY  21  -3.704  -7.226   1.491
  141    HA3  GLY  21           HA3      GLY  21  -5.285  -7.665   0.861
  142    H    LYS  22           H        LYS  22  -5.654  -4.534   1.641
  143    HA   LYS  22           HA       LYS  22  -4.793  -3.658  -1.034
  144    HB2  LYS  22           HB2      LYS  22  -7.198  -3.606  -0.880
  145    HB3  LYS  22           HB3      LYS  22  -7.129  -2.762   0.657
  146    HG2  LYS  22           HG2      LYS  22  -7.766  -1.257  -1.147
  147    HG3  LYS  22           HG3      LYS  22  -6.219  -0.790  -0.442
  148    HD2  LYS  22           HD2      LYS  22  -5.101  -2.028  -2.321
  149    HD3  LYS  22           HD3      LYS  22  -6.694  -2.217  -3.055
  150    HE2  LYS  22           HE2      LYS  22  -5.429   0.430  -2.347
  151    HE3  LYS  22           HE3      LYS  22  -5.407  -0.289  -3.955
  152    HZ1  LYS  22           HZ1      LYS  22  -7.685  -0.002  -4.198
  153    HZ2  LYS  22           HZ2      LYS  22  -7.193   1.432  -3.433
  154    HZ3  LYS  22           HZ3      LYS  22  -7.948   0.208  -2.542
  155    H    CYS  23           H        CYS  23  -3.404  -2.037  -1.173
  156    HA   CYS  23           HA       CYS  23  -2.467  -0.753   1.234
  157    HB2  CYS  23           HB2      CYS  23  -1.005  -1.452  -0.738
  158    HB3  CYS  23           HB3      CYS  23  -1.677  -0.064  -1.590
  159    H    VAL  24           H        VAL  24  -3.600   0.842   2.071
  160    HA   VAL  24           HA       VAL  24  -5.303   2.466   0.355
  161    HB   VAL  24           HB       VAL  24  -5.058   2.468   3.365
  162   HG11  VAL  24          HG11      VAL  24  -7.212   3.633   3.317
  163   HG12  VAL  24          HG12      VAL  24  -7.157   3.657   1.555
  164   HG13  VAL  24          HG13      VAL  24  -5.959   4.554   2.487
  165   HG21  VAL  24          HG21      VAL  24  -5.825   0.305   2.537
  166   HG22  VAL  24          HG22      VAL  24  -7.079   1.103   1.590
  167   HG23  VAL  24          HG23      VAL  24  -7.131   1.163   3.351
  168    H    CYS  25           H        CYS  25  -3.877   3.778  -0.704
  169    HA   CYS  25           HA       CYS  25  -2.305   5.646   0.940
  170    HB2  CYS  25           HB2      CYS  25  -1.007   6.077  -1.118
  171    HB3  CYS  25           HB3      CYS  25  -0.959   4.379  -0.655
  172    H    GLY  26           H        GLY  26  -5.118   5.934   0.595
  173    HA2  GLY  26           HA2      GLY  26  -6.570   7.697   0.161
  174    HA3  GLY  26           HA3      GLY  26  -5.267   8.519  -0.689
  175    H    SER  27           H        SER  27  -5.913   5.254  -1.495
  176    HA   SER  27           HA       SER  27  -7.425   6.051  -3.873
  177    HB2  SER  27           HB2      SER  27  -4.948   5.753  -4.361
  178    HB3  SER  27           HB3      SER  27  -5.145   4.057  -3.928
  179    HG   SER  27           HG       SER  27  -6.850   5.214  -5.846