*HEADER   ELECTRON TRANSPORT                      03-JUL-96   1OCD    
*TITLE    CYTOCHROME C (OXIDIZED) FROM EQUUS CABALLUS, NMR, MINIMIZED 
*TITLE   2 AVERAGE STRUCTURE                                          
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: CYTOCHROME C;                                    
*COMPND  3 CHAIN: NULL;                                               
*COMPND  4 OTHER_DETAILS: OXIDIZED                                    
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: EQUUS CABALLUS;                       
*SOURCE  3 ORGANISM_COMMON: HORSE;                                    
*SOURCE  4 ORGAN: HEART                                               
*KEYWDS   ELECTRON TRANSPORT                                          
*EXPDTA   NMR, MINIMIZED AVERAGE STRUCTURE                            
*AUTHOR   P.X.QI,R.A.BECKMAN,A.J.WAND                                 
*REVDAT  1   16-JUN-97 1OCD    0                                      

The following is a concatenated file of all restraints files used
in the NMR-based determination of the structure of oxidized horse
cytochrome c.

individual files begin with "file: " followed by the filename
                                                                               
file: oc.noe
assign (resid 105 and name haa*) (resid  59 and name he1)  2.62  0.71  1.41
assign (resid 105 and name haa*) (resid  59 and name hz2)  2.38  0.48  1.18
assign (resid 105 and name haa*) (resid 105 and name hba*)  2.41  0.52  1.91
assign (resid 105 and name haa*) (resid 105 and name hma*)  3.01  1.11  2.41
assign (resid 105 and name hma*) (resid  35 and name hd2*)  3.54  1.64  2.84
assign (resid 105 and name hma*) (resid  35 and name hd1*)  4.15  2.25  3.45
assign (resid 105 and name hma*) (resid  64 and name hd1*)  3.63  1.73  2.93
assign (resid 105 and name hmc*) (resid  82 and name hd*)  3.03  1.13  5.73
assign (resid 105 and name hmc*) (resid  82 and name hd*)  3.03  1.13  5.73
assign (resid 105 and name hmc*) (resid  16 and name ha)  3.95  2.05  2.95
assign (resid 105 and name hmc*) (resid  14 and name ha)  3.42  1.52  2.12
assign (resid 105 and name hmc*) (resid 105 and name hbc*)  3.25  1.35  2.55
assign (resid 105 and name hma*) (resid  67 and name hb1)  2.80  0.90  1.50
assign (resid 105 and name haa*) (resid 105 and name hba*)  3.20  1.30  2.70
assign (resid  80 and name he*) (resid  82 and name hd*)  3.90  2.00  6.60
assign (resid  80 and name he*) (resid  82 and name hd*)  3.90  2.00  6.60
assign (resid  80 and name he*) (resid  80 and name hb*)  3.90  2.00  3.30
assign (resid  80 and name he*) (resid  80 and name hn)  3.90  2.00  2.60
assign (resid  18 and name hd2) (resid  30 and name hd*)  3.20  1.30  2.00
assign (resid 105 and name hma*) (resid 105 and name hba*)  2.96  1.06  2.36
assign (resid  19 and name hn) (resid  18 and name hb2)  3.20  1.30  1.30
assign (resid  18 and name hb2) (resid  18 and name hn)  3.20  1.30  1.30
assign (resid  31 and name hn) (resid  27 and name hn)  3.20  1.30  1.30
assign (resid  31 and name hn) (resid  19 and name hg1)  3.20  1.30  1.30
assign (resid  32 and name hn) (resid  31 and name hn)  3.20  1.30  1.30
assign (resid 105 and name haa*) (resid  59 and name he1)  3.20  1.30  2.00
assign (resid  19 and name hn) (resid  19 and name ha)  3.20  1.30  1.30
assign (resid  31 and name hn) (resid  26 and name hb*)  3.20  1.30  2.00
assign (resid  19 and name hn) (resid  19 and name hg2*)  3.68  1.78  2.38
assign (resid  31 and name hb1) (resid  19 and name hn)  3.20  1.30  1.30
assign (resid  61 and name hn) (resid  60 and name hb1)  2.86  0.96  0.96
assign (resid  31 and name hn) (resid  30 and name hb*)  3.04  1.13  1.84
assign (resid  64 and name hd2*) (resid  61 and name hn)  3.90  2.00  2.60
assign (resid  17 and name hn) (resid  16 and name hn)  3.09  1.19  1.19
assign (resid  59 and name he1) (resid  41 and name hn)  3.20  1.30  1.30
assign (resid  52 and name hn) (resid  49 and name hn)  3.20  1.30  1.30
assign (resid  53 and name hn) (resid  49 and name hn)  3.20  1.30  1.30
assign (resid  79 and name hn) (resid  78 and name hg1)  3.20  1.30  1.30
assign (resid  64 and name hn) (resid  62 and name hn)  3.20  1.30  1.30
assign (resid   3 and name hn) (resid   2 and name hn)  3.20  1.30  1.30
assign (resid  11 and name hn) (resid  10 and name hn)  2.86  0.95  0.95
assign (resid  37 and name hn) (resid  36 and name hd*)  3.20  1.30  5.30
assign (resid  41 and name hn) (resid  40 and name hn)  3.20  1.30  1.30
assign (resid  42 and name hn) (resid  41 and name hn)  3.20  1.30  1.30
assign (resid  98 and name hn) (resid  97 and name hd2)  5.32  3.42  3.42
assign (resid  55 and name hn) (resid  53 and name hn)  3.20  1.30  1.30
assign (resid  74 and name hn) (resid  74 and name hd*)  3.20  1.30  5.30
assign (resid  63 and name hn) (resid  60 and name hn)  3.20  1.30  1.30
assign (resid  46 and name hn) (resid  45 and name hn)  3.20  1.30  1.30
assign (resid  61 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  61 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  61 and name hn) (resid  36 and name hd*)  3.20  1.30  5.30
assign (resid  61 and name hn) (resid  36 and name hd*)  3.20  1.30  5.30
assign (resid  37 and name hn) (resid  36 and name hd*)  3.20  1.30  5.30
assign (resid  74 and name hn) (resid  74 and name hd*)  3.20  1.30  5.30
assign (resid  26 and name hn) (resid  26 and name hd1)  3.20  1.30  1.30
assign (resid  11 and name hn) (resid  10 and name hd2)  5.32  3.42  3.42
assign (resid  15 and name ha) (resid  10 and name hz)  3.13  1.22  1.22
assign (resid  98 and name hn) (resid  97 and name hd1)  5.32  3.42  3.42
assign (resid  98 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  98 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  98 and name hn) (resid  36 and name hz)  3.20  1.30  1.30
assign (resid  36 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  36 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid  97 and name hd1) (resid  10 and name hn)  5.32  3.42  3.42
assign (resid  69 and name hn) (resid  68 and name hn)  2.90  1.01  1.01
assign (resid  67 and name hn) (resid  67 and name hd2)  5.16  3.26  3.26
assign (resid  67 and name hn) (resid  66 and name hn)  2.75  0.85  0.85
assign (resid  85 and name hn) (resid  82 and name he*)  2.87  0.96  4.97
assign (resid  85 and name hn) (resid  82 and name he*)  2.87  0.96  4.97
assign (resid  19 and name hg1) (resid  19 and name hb)  3.18  1.28  1.28
assign (resid  78 and name ha) (resid  52 and name hn)  3.20  1.30  1.30
assign (resid 105 and name hmd*) (resid  46 and name hz)  3.90  2.00  2.60
assign (resid  77 and name hn) (resid  77 and name ha*)  2.75  0.85  1.55
assign (resid  37 and name hn) (resid  37 and name ha2)  2.69  0.80  0.80
assign (resid  38 and name ha) (resid  37 and name hn)  3.20  1.30  1.30
assign (resid   2 and name hn) (resid   2 and name ha)  2.85  0.95  0.95
assign (resid  34 and name hn) (resid  34 and name ha*)  2.71  0.81  1.51
assign (resid  24 and name ha1) (resid  19 and name hg1)  3.20  1.30  1.30
assign (resid  50 and name hn) (resid  49 and name hb)  2.69  0.79  0.79
assign (resid  52 and name hn) (resid  51 and name ha)  3.01  1.11  1.11
assign (resid  13 and name hn) (resid  12 and name ha)  2.90  1.00  1.00
assign (resid  24 and name hn) (resid  24 and name ha1)  2.67  0.78  0.78
assign (resid  17 and name hn) (resid  16 and name hg*)  3.20  1.30  2.00
assign (resid  32 and name hn) (resid  24 and name ha2)  3.20  1.30  1.30
assign (resid  52 and name hb2) (resid  49 and name hn)  3.20  1.30  1.30
assign (resid  78 and name hg1) (resid  78 and name hg2*)  3.90  2.00  2.60
assign (resid  62 and name hn) (resid  61 and name ha)  3.07  1.16  1.16
assign (resid  78 and name hg2*) (resid  77 and name hn)  3.90  2.00  2.60
assign (resid  37 and name hn) (resid  36 and name hb1)  3.20  1.30  1.30
assign (resid  98 and name hn) (resid  97 and name hb1)  2.88  0.98  0.98
assign (resid  59 and name hb1) (resid  36 and name hn)  3.20  1.30  1.30
assign (resid  53 and name hn) (resid  53 and name ha)  2.62  0.71  0.71
assign (resid  86 and name hn) (resid  86 and name ha)  2.85  0.95  0.95
assign (resid   1 and name ht*) (resid   1 and name ha2)  2.70  0.81  0.81
assign (resid  89 and name hn) (resid  89 and name ha)  2.48  0.58  0.58
assign (resid  67 and name hn) (resid  67 and name hb2)  2.47  0.57  0.57
assign (resid   7 and name hn) (resid   6 and name ha2)  3.00  1.10  1.10
assign (resid   7 and name hn) (resid   6 and name ha1)  2.82  0.92  0.92
assign (resid  48 and name hn) (resid  48 and name hb1)  2.81  0.91  0.91
assign (resid 105 and name hmd*) (resid 105 and name hac)  4.16  2.26  2.86
assign (resid 105 and name hmd*) (resid  80 and name ha)  3.90  2.00  2.60
assign (resid  32 and name hn) (resid  20 and name hb)  2.67  0.77  0.77
assign (resid  32 and name hn) (resid  32 and name hb1)  2.69  0.79  0.79
assign (resid  32 and name hn) (resid  31 and name hb1)  3.20  1.30  1.30
assign (resid  23 and name hn) (resid  19 and name hg2*)  3.90  2.00  2.60
assign (resid  78 and name hn) (resid  72 and name hg*)  3.20  1.30  2.00
assign (resid  78 and name hn) (resid  76 and name hb1)  3.20  1.30  1.70
assign (resid  19 and name hg1) (resid  19 and name hg2*)  3.90  2.00  2.60
assign (resid  45 and name hn) (resid  44 and name hb*)  3.20  1.30  2.00
assign (resid  45 and name hn) (resid  44 and name hb*)  3.20  1.30  2.00
assign (resid  50 and name hn) (resid  50 and name hb*)  2.73  0.83  1.53
assign (resid  99 and name hn) (resid  99 and name ha)  2.80  0.90  0.90
assign (resid  59 and name hn) (resid  59 and name hb2)  2.74  0.84  0.84
assign (resid  93 and name hb*) (resid   6 and name hn)  2.88  0.98  1.68
assign (resid  36 and name hn) (resid  35 and name hb2)  3.07  1.16  1.16
assign (resid   3 and name hn) (resid   2 and name hb*)  2.91  1.01  1.71
assign (resid  13 and name hn) (resid  12 and name hb1)  2.86  0.95  0.95
assign (resid  13 and name hn) (resid  12 and name hg*)  3.20  1.30  2.00
assign (resid  54 and name hn) (resid  54 and name hb*)  2.70  0.80  1.50
assign (resid  51 and name hn) (resid  48 and name hb2)  3.20  1.30  1.30
assign (resid   5 and name hn) (resid   2 and name hb*)  3.20  1.30  2.00
assign (resid  97 and name hb2) (resid   7 and name hn)  3.20  1.30  1.30
assign (resid  60 and name hn) (resid  60 and name hb2)  3.20  1.30  1.30
assign (resid 105 and name hmd*) (resid 105 and name had*)  3.90  2.00  3.30
assign (resid 105 and name hmd*) (resid  49 and name hg2*)  4.70  2.80  4.00
assign (resid 105 and name hmd*) (resid 105 and name hbd*)  3.88  1.98  3.28
assign (resid 105 and name hbd*) (resid  78 and name hg1)  3.20  1.30  2.00
assign (resid  78 and name hg1) (resid  75 and name hg2*)  3.90  2.00  2.60
assign (resid  78 and name hn) (resid  75 and name hg2*)  3.76  1.86  2.46
assign (resid  78 and name hn) (resid  49 and name hg2*)  4.16  2.26  2.86
assign (resid  82 and name hn) (resid  81 and name hg2*)  3.74  1.84  2.43
assign (resid  89 and name hg2*) (resid  88 and name hn)  3.90  2.00  2.60
assign (resid  99 and name hn) (resid  98 and name hb2)  3.01  1.11  1.11
assign (resid  81 and name hn) (resid  81 and name hg2*)  3.90  2.00  2.60
assign (resid  53 and name hb2) (resid  52 and name hn)  3.45  1.55  1.55
assign (resid  75 and name hg2*) (resid  52 and name hn)  4.16  2.26  2.86
assign (resid  64 and name hn) (resid  61 and name hb2)  3.20  1.30  1.70
assign (resid  95 and name hn) (resid  94 and name hb1)  2.72  0.82  0.82
assign (resid  20 and name hg2*) (resid  10 and name he1)  6.02  4.12  4.72
assign (resid  11 and name hg2*) (resid  10 and name he1)  6.02  4.12  4.72
assign (resid  87 and name hn) (resid  86 and name hg*)  2.81  0.91  1.61
assign (resid  15 and name hn) (resid  11 and name hg1*)  3.90  2.00  2.60
assign (resid  89 and name hn) (resid  89 and name hg2*)  3.32  1.41  2.01
assign (resid   9 and name hg1*) (resid   7 and name hn)  3.15  1.25  1.95
assign (resid  59 and name he1) (resid  35 and name hd2*)  3.87  1.97  2.57
assign (resid  59 and name he1) (resid  40 and name hg2*)  3.67  1.77  2.37
assign (resid  58 and name hg2*) (resid  37 and name hn)  3.89  1.99  2.59
assign (resid  41 and name hn) (resid  40 and name hg2*)  3.90  2.00  2.60
assign (resid  82 and name hn) (resid  81 and name hd1*)  4.16  2.26  2.86
assign (resid  99 and name hn) (resid  98 and name hd2*)  3.90  2.00  2.60
assign (resid  99 and name hn) (resid  35 and name hd1*)  3.90  2.00  2.60
assign (resid  99 and name hn) (resid  95 and name hg2*)  3.90  2.00  2.60
assign (resid  98 and name hn) (resid  94 and name hd2*)  4.16  2.26  2.86
assign (resid  98 and name hn) (resid  98 and name hd2*)  3.62  1.71  2.32
assign (resid  98 and name hn) (resid  95 and name hg2*)  3.90  2.00  2.60
assign (resid  59 and name hn) (resid  58 and name hg2*)  3.68  1.78  2.38
assign (resid  36 and name hn) (resid  35 and name hd1*)  3.90  2.00  2.60
assign (resid  13 and name hn) (resid   9 and name hg2*)  3.90  2.00  2.60
assign (resid  95 and name hn) (resid  94 and name hg)  3.20  1.30  1.
assign (resid  10 and name hn) (resid   9 and name hg1*)  3.20  1.30  2.00
assign (resid  10 and name hn) (resid   9 and name hd1*)  3.90  2.00  2.60
assign (resid  98 and name hd2*) (resid  10 and name he1)  6.02  4.12  4.72
assign (resid  58 and name hn) (resid  57 and name hg2*)  3.55  1.64  2.24
assign (resid  58 and name hn) (resid  58 and name hg2*)  3.90  2.00  2.60
assign (resid  87 and name hn) (resid  85 and name hg2*)  3.63  1.72  2.32
assign (resid  58 and name hg2*) (resid  38 and name hn)  3.90  2.00  2.60
assign (resid   9 and name hg1*) (resid   7 and name hn)  3.20  1.30  2.00
assign (resid  48 and name hn) (resid  47 and name hg2*)  3.87  1.96  2.57
assign (resid  85 and name hn) (resid  85 and name hg1*)  3.15  1.25  1.95
assign (resid  85 and name hn) (resid  85 and name hg2*)  3.90  2.00  2.60
assign (resid 105 and name hmd*) (resid 105 and name hbd*)  3.90  2.00  3.30
assign (resid 105 and name hmd*) (resid  29 and name ha*)  3.90  2.00  3.30
assign (resid 105 and name hmd*) (resid  28 and name hg2*)  4.54  2.64  3.84
assign (resid  59 and name he1) (resid  57 and name hd1*)  3.90  2.00  2.60
assign (resid  99 and name hn) (resid  98 and name hd1*)  3.90  2.00  2.60
assign (resid  98 and name hn) (resid  98 and name hd1*)  3.84  1.93  2.53
assign (resid  59 and name hn) (resid  57 and name hd1*)  3.90  2.00  2.60
assign (resid  64 and name hn) (resid  64 and name hd1*)  3.90  2.00  2.60
assign (resid  64 and name hn) (resid  64 and name hd2*)  3.78  1.88  2.48
assign (resid  86 and name hn) (resid  85 and name hd1*)  3.90  2.00  2.60
assign (resid  86 and name hn) (resid  68 and name hd2*)  4.16  2.26  2.86
assign (resid  58 and name hn) (resid  57 and name hd1*)  3.82  1.92  2.52
assign (resid  65 and name hn) (resid  64 and name hd1*)  3.90  2.00  2.60
assign (resid  65 and name hn) (resid  64 and name hd2*)  3.90  2.00  2.60
assign (resid  68 and name hn) (resid  68 and name hd2*)  3.64  1.74  2.34
assign (resid  68 and name hn) (resid  68 and name hb*)  2.85  0.94  1.64
assign (resid  85 and name hn) (resid  85 and name hd1*)  3.89  1.99  2.59
assign (resid  64 and name hd1*) (resid  60 and name hn)  3.90  2.00  2.60
assign (resid  68 and name hn) (resid  68 and name hd1*)  3.82  1.91  2.51
assign (resid  94 and name hn) (resid  10 and name hd1)  5.32  3.42  3.42
assign (resid  15 and name ha) (resid  10 and name he2)  5.15  3.25  3.25
assign (resid  15 and name ha) (resid  10 and name hd1)  5.32  3.42  3.42
assign (resid  73 and name hz1) (resid  70 and name hn)  3.20  1.30  1.30
assign (resid  74 and name he*) (resid  67 and name hd1)  3.01  1.11  5.11
assign (resid  74 and name he*) (resid  67 and name hd1)  3.01  1.11  5.11
assign (resid 102 and name hn) (resid 102 and name hb)  2.58  0.68  0.68
assign (resid  74 and name hd*) (resid  67 and name ha)  2.95  1.05  5.05
assign (resid  74 and name hd*) (resid  67 and name ha)  2.95  1.05  5.05
assign (resid  73 and name hn) (resid  72 and name ha)  3.02  1.12  1.12
assign (resid  74 and name hd*) (resid  71 and name ha)  3.20  1.30  5.30
assign (resid  74 and name hd*) (resid  71 and name ha)  3.20  1.30  5.30
assign (resid  42 and name hn) (resid  42 and name ha)  2.97  1.07  1.07
assign (resid 104 and name hn) (resid 104 and name ha)  2.86  0.95  0.95
assign (resid 104 and name hn) (resid 103 and name ha)  3.17  1.27  1.27
assign (resid  40 and name hg1) (resid  40 and name hb)  2.85  0.95  0.95
assign (resid 104 and name ha) (resid 103 and name hn)  3.20  1.30  1.30
assign (resid 103 and name hn) (resid 102 and name ha)  3.20  1.30  1.30
assign (resid  59 and name hd1) (resid  40 and name ha)  3.05  1.15  1.15
assign (resid  97 and name hn) (resid  96 and name ha)  2.74  0.84  0.84
assign (resid  56 and name hn) (resid  56 and name ha*)  2.58  0.68  1.38
assign (resid  96 and name hn) (resid  95 and name ha)  2.93  1.03  1.03
assign (resid  73 and name hn) (resid  70 and name hb*)  3.02  1.12  1.82
assign (resid  96 and name hn) (resid  96 and name ha)  2.58  0.68  0.68
assign (resid  75 and name hb) (resid  74 and name hd*)  3.20  1.30  5.30
assign (resid  75 and name hb) (resid  74 and name hd*)  3.20  1.30  5.30
assign (resid   9 and name hn) (resid   8 and name ha)  2.83  0.93  0.93
assign (resid   9 and name hn) (resid   9 and name ha)  2.84  0.94  0.94
assign (resid  64 and name ha) (resid  59 and name he3)  3.06  1.15  1.15
assign (resid  36 and name hd*) (resid  36 and name hb1)  2.57  0.67  4.66
assign (resid  36 and name hd*) (resid  36 and name hb1)  2.57  0.67  4.66
assign (resid  36 and name hd*) (resid  36 and name ha)  2.84  0.94  4.94
assign (resid  36 and name hd*) (resid  36 and name ha)  2.84  0.94  4.94
assign (resid  35 and name hn) (resid  34 and name ha*)  2.98  1.08  1.78
assign (resid  91 and name hn) (resid  91 and name ha)  2.59  0.69  0.69
assign (resid  64 and name ha) (resid  63 and name hn)  3.20  1.30  1.80
assign (resid  63 and name hn) (resid  62 and name ha)  3.02  1.12  1.12
assign (resid  46 and name ha) (resid  26 and name hd1)  3.05  1.15  1.15
assign (resid   8 and name hn) (resid   8 and name ha)  2.59  0.69  0.69
assign (resid  10 and name hd2) (resid  10 and name hb1)  4.78  2.88  2.88
assign (resid  59 and name hd1) (resid  59 and name hb1)  2.73  0.83  0.83
assign (resid  69 and name hn) (resid  69 and name ha)  2.83  0.93  0.93
assign (resid  74 and name he*) (resid  67 and name hb2)  3.01  1.11  5.11
assign (resid  74 and name he*) (resid  67 and name hb2)  3.01  1.11  5.11
assign (resid  70 and name hn) (resid  69 and name ha)  2.91  1.02  1.02
assign (resid  70 and name hn) (resid  70 and name hb*)  2.99  1.09  1.79
assign (resid  66 and name hn) (resid  64 and name ha)  3.20  1.30  1.30
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assign (resid  78 and name hn) (resid  78 and name hb)  2.53  0.63  0.63
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assign (resid  41 and name hn) (resid  40 and name hb)  3.20  1.30  1.30
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assign (resid   2 and name hn) (resid   1 and name ha1)  3.45  1.55  1.55
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assign (resid  52 and name hn) (resid  52 and name hb2)  2.56  0.66  0.76
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assign (resid  16 and name hn) (resid  16 and name hg*)  3.20  1.30  2.00
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assign (resid  19 and name hg1) (resid  31 and name hb1)  2.78  0.88  0.88
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assign (resid 100 and name hn) (resid  98 and name ha)  3.20  1.30  1.30
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assign (resid  36 and name he*) (resid  36 and name hb1)  3.20  1.30  5.30
assign (resid  36 and name he*) (resid  36 and name hb1)  3.20  1.30  5.30
assign (resid  10 and name hd1) (resid  20 and name hg2*)  6.02  4.12  4.72
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assign (resid  36 and name he*) (resid  98 and name ha)  3.20  1.30  5.30
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assign (resid  82 and name he*) (resid  85 and name hd1*)  3.90  2.00  6.60
assign (resid  32 and name hb2) (resid 102 and name hg2*)  3.90  2.00  2.60
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assign (resid  78 and name hg1) (resid  78 and name hn)  3.20  1.30  1.30
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assign (resid  37 and name hn) (resid  38 and name hb*)  3.20  1.30  2.00
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assign (resid  18 and name hb2) (resid  10 and name hz)  3.20  1.30  1.30
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assign (resid 102 and name hn) (resid  98 and name ha)  3.20  1.30  1.30
assign (resid  94 and name hn) (resid  91 and name ha)  3.20  1.30  1.30
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assign (resid  96 and name ha) (resid  95 and name hg2*)  3.90  2.00  2.60
assign (resid 105 and name hbc*) (resid 105 and name hhd)  3.90  2.00  2.60
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assign (resid  63 and name ha) (resid  66 and name hb2)  3.20  1.30  1.30
assign (resid  89 and name hb) (resid  90 and name hn)  3.20  1.30  1.30
assign (resid  89 and name ha) (resid  90 and name hn)  3.20  1.30  1.30
assign (resid  10 and name ha) (resid  11 and name hn)  3.20  1.30  1.30
assign (resid  88 and name ha) (resid  92 and name hn)  3.20  1.30  1.30
assign (resid  98 and name ha) (resid  99 and name hn)  3.20  1.30  1.30
assign (resid  96 and name ha) (resid 100 and name hn)  3.20  1.30  1.30
assign (resid  91 and name hb1) (resid  88 and name ha)  3.20  1.30  1.30
assign (resid  94 and name hb2) (resid  91 and name ha)  3.20  1.30  1.30
assign (resid  96 and name hb*) (resid  93 and name ha)  3.90  2.00  2.60
assign (resid  97 and name hb2) (resid  94 and name ha)  3.20  1.30  1.30
assign (resid 105 and name haa*) (resid 105 and name hba*)  3.20  1.30  2.70
assign (resid 105 and name hhd) (resid 105 and name hmd*)  3.90  2.00  2.60
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assign (resid  80 and name hn) (resid  78 and name hg1)  3.20  1.30  1.30
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assign (resid  17 and name hn) (resid  17 and name hb1)  3.20  1.30  1.30
assign (resid  81 and name hn) (resid  80 and name ha)  3.20  1.30  1.30
assign (resid  48 and name hd1) (resid  46 and name hz)  5.32  3.42  3.42
assign (resid  48 and name hd2) (resid  52 and name hb1)  5.32  3.42  3.42
assign (resid  82 and name hd*) (resid  82 and name hb*)  3.20  1.30  6.00
assign (resid  82 and name hd*) (resid  82 and name hb*)  3.20  1.30  6.00
assign (resid  29 and name hn) (resid  29 and name ha*)  3.20  1.30  2.00
assign (resid  46 and name hd1) (resid  46 and name ha)  5.32  3.42  3.42
assign (resid  71 and name ha) (resid  71 and name hd*)  3.20  1.30  2.00
assign (resid  82 and name ha) (resid  82 and name hb*)  3.20  1.30  2.00
assign (resid 105 and name hhc) (resid 105 and name hab)  3.20  1.30  1.30
assign (resid 105 and name hac) (resid 105 and name hhd)  3.20  1.30  1.30
assign (resid  30 and name ha) (resid  30 and name hd*)  3.20  1.30  2.00
assign (resid  30 and name hb*) (resid  30 and name hd*)  3.20  1.30  2.70
assign (resid  30 and name hg*) (resid  30 and name hd*)  3.20  1.30  2.70
assign (resid  29 and name ha1) (resid  29 and name ha2)  3.20  1.30  2.70
assign (resid  30 and name hg*) (resid  30 and name hd*)  3.20  1.30  2.70
assign (resid  48 and name he2) (resid  46 and name hn)  5.32  3.42  3.42
assign (resid  68 and name hb*) (resid  68 and name hd2*)  3.90  2.00  3.30
assign (resid  17 and name hn) (resid  17 and name hb2)  3.20  1.30  1.30
assign (resid  67 and name he2) (resid  82 and name hd*)  3.20  1.30  5.30
assign (resid  67 and name he2) (resid  82 and name hd*)  3.20  1.30  5.30
assign (resid  68 and name hd2*) (resid 105 and name hbb*)  4.70  2.80  4.00
assign (resid  18 and name hb2) (resid  18 and name ha)  3.20  1.30  1.30
assign (resid  64 and name hn) (resid  65 and name hn)  3.20  1.30  1.30
assign (resid  75 and name hn) (resid  74 and name hd*)  3.20  1.30  5.30
assign (resid  32 and name ha) (resid  32 and name hb1)  3.20  1.30  1.30
assign (resid  74 and name hb*) (resid  67 and name hb2)  3.20  1.30  2.00
assign (resid 105 and name hac) (resid  28 and name hg2*)  3.90  2.00  2.60
assign (resid  18 and name hn) (resid  17 and name hb2)  3.20  1.30  1.30
assign (resid  32 and name hn) (resid  10 and name he1)  5.32  3.42  3.42
assign (resid  80 and name hn) (resid  80 and name ha)  3.20  1.30  1.30
assign (resid  56 and name hn) (resid  40 and name hg1)  3.20  1.30  1.30
assign (resid  31 and name ha) (resid  19 and name hb)  3.20  1.30  1.30
assign (resid  46 and name he1) (resid 105 and name hbd*)  5.32  3.42  4.12
assign (resid  53 and name ha) (resid  41 and name ha1)  3.20  1.30  1.30
assign (resid  26 and name hb*) (resid  46 and name hb1)  3.20  1.30  2.00
assign (resid  19 and name hn) (resid  32 and name hn)  3.20  1.30  1.30
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assign (resid  36 and name he*) (resid  60 and name ha)  3.20  1.30  5.30
assign (resid  97 and name hd1) (resid  97 and name ha)  5.32  3.42  3.42
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assign (resid  82 and name hd*) (resid  71 and name hd*)  3.20  1.30  6.00
assign (resid  82 and name hd*) (resid  82 and name ha)  3.20  1.30  5.30
assign (resid  82 and name hd*) (resid  82 and name ha)  3.20  1.30  5.30
assign (resid  57 and name hn) (resid  57 and name ha)  3.20  1.30  1.30
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assign (resid  98 and name hg) (resid  97 and name hd1)  5.32  3.42  3.42
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assign (resid  71 and name ha) (resid  71 and name hg*)  3.20  1.30  2.00
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assign (resid  46 and name he1) (resid  26 and name hb*)  5.32  3.42  4.12
assign (resid  60 and name ha) (resid  60 and name hb2)  3.20  1.30  1.30
assign (resid  10 and name ha) (resid  10 and name hb2)  3.20  1.30  1.30
assign (resid  10 and name hb2) (resid   7 and name ha)  3.20  1.30  1.30
assign (resid  99 and name ha) (resid  99 and name hb*)  3.20  1.30  2.00
assign (resid   6 and name ha2) (resid   9 and name hd1*)  3.90  2.00  2.60
assign (resid  12 and name hb2) (resid   9 and name hd1*)  3.90  2.00  2.60
assign (resid 100 and name hb*) (resid 101 and name hb*)  3.90  2.00  3.30
assign (resid  94 and name hg) (resid  98 and name hd1*)  3.90  2.00  2.60
assign (resid 105 and name hab) (resid 105 and name hbb*)  3.90  2.00  2.60
assign (resid  18 and name hn) (resid  18 and name ha)  3.20  1.30  1.30
assign (resid  23 and name hn) (resid  24 and name hn)  3.20  1.30  1.30
assign (resid   6 and name hn) (resid   9 and name hn)  3.20  1.30  1.30
assign (resid  25 and name hn) (resid  19 and name hb)  3.20  1.30  1.30
assign (resid  59 and name hn) (resid  59 and name ha)  3.20  1.30  1.30
assign (resid 102 and name hn) (resid 102 and name ha)  3.20  1.30  1.30
assign (resid  64 and name hn) (resid  61 and name ha)  3.20  1.30  1.30
assign (resid  52 and name hn) (resid  49 and name hg2*)  3.90  2.00  2.60
assign (resid  74 and name hd*) (resid  67 and name hd2)  5.32  3.42  7.42
assign (resid  74 and name hd*) (resid  67 and name hd2)  5.32  3.42  7.42
assign (resid  10 and name hd1) (resid  10 and name ha)  5.32  3.42  3.42
assign (resid  59 and name he3) (resid  59 and name hb1)  3.20  1.30  1.30
assign (resid  55 and name hn) (resid  53 and name ha)  3.20  1.30  1.30
assign (resid  26 and name hd2) (resid  46 and name ha)  3.20  1.30  1.30
assign (resid  97 and name hd1) (resid  98 and name ha)  5.32  3.42  3.42
assign (resid  36 and name hd*) (resid  60 and name hb1)  3.20  1.30  5.30
assign (resid  36 and name hd*) (resid  60 and name hb1)  3.20  1.30  5.30
assign (resid  82 and name hd*) (resid  16 and name hb*)  3.20  1.30  6.00
assign (resid  82 and name hd*) (resid  16 and name hb*)  3.20  1.30  6.00
assign (resid  90 and name hn) (resid  89 and name hg2*)  3.20  1.30  1.90
assign (resid  59 and name hd1) (resid  35 and name hd1*)  3.90  2.00  2.60
assign (resid 105 and name hmb*) (resid  68 and name hd2*)  4.70  2.80  4.00
assign (resid  78 and name hb) (resid  78 and name ha)  3.20  1.30  1.30
assign (resid  76 and name ha) (resid  76 and name hg*)  3.20  1.30  2.00
assign (resid  38 and name ha) (resid  38 and name hg*)  3.20  1.30  2.00
assign (resid  93 and name ha) (resid   1 and name ha2)  3.20  1.30  1.30
assign (resid  43 and name ha) (resid  43 and name hb*)  3.90  2.00  2.60
assign (resid  94 and name ha) (resid  94 and name hb1)  3.20  1.30  1.30
assign (resid  10 and name ha) (resid   9 and name hg2*)  3.90  2.00  2.60
assign (resid  95 and name ha) (resid  98 and name hd1*)  3.90  2.00  2.60
assign (resid  99 and name hn) (resid  97 and name hn)  3.20  1.30  1.30
assign (resid  19 and name hg1) (resid  31 and name ha)  3.20  1.30  1.30
assign (resid  92 and name hn) (resid  91 and name ha)  3.20  1.30  1.30
assign (resid  39 and name hn) (resid  37 and name ha1)  3.20  1.30  1.30
assign (resid  37 and name hn) (resid  59 and name hb2)  3.20  1.30  1.30
assign (resid  40 and name hn) (resid  40 and name hb)  3.20  1.30  1.30
assign (resid  36 and name hd*) (resid  37 and name ha2)  3.20  1.30  5.30
assign (resid  36 and name hd*) (resid  37 and name ha2)  3.20  1.30  5.30
assign (resid  55 and name hn) (resid  55 and name ha)  3.20  1.30  1.30
assign (resid 100 and name hn) (resid 100 and name ha)  3.20  1.30  1.30
assign (resid  19 and name ha) (resid  19 and name hb)  3.20  1.30  1.30
assign (resid  97 and name hd1) (resid  97 and name hb1)  5.32  3.42  3.42
assign (resid  73 and name hn) (resid  72 and name hb*)  3.20  1.30  2.00
assign (resid  36 and name hd*) (resid  99 and name ha)  3.20  1.30  5.30
assign (resid  36 and name hd*) (resid  99 and name ha)  3.20  1.30  5.30
assign (resid  73 and name hn) (resid  73 and name hd*)  3.20  1.30  2.00
assign (resid  74 and name hd*) (resid  66 and name hb1)  3.20  1.30  5.30
assign (resid  74 and name hd*) (resid  66 and name hb1)  3.20  1.30  5.30
assign (resid  42 and name hn) (resid  42 and name hb*)  3.20  1.30  2.00
assign (resid  36 and name hd*) (resid  35 and name hg)  3.20  1.30  5.30
assign (resid  36 and name hd*) (resid  35 and name hg)  3.20  1.30  5.30
assign (resid  10 and name hd2) (resid  11 and name hg2*)  6.02  4.12  4.72
assign (resid  36 and name he*) (resid 102 and name hg2*)  3.90  2.00  6.60
assign (resid  36 and name he*) (resid 102 and name hg2*)  3.90  2.00  6.60
assign (resid  91 and name hn) (resid  85 and name hd1*)  3.90  2.00  2.60
assign (resid  97 and name he1) (resid  10 and name hb2)  5.32  3.42  3.42
assign (resid  55 and name ha) (resid  55 and name hb*)  3.20  1.30  2.00
assign (resid  63 and name ha) (resid  63 and name hg2*)  3.90  2.00  2.60
assign (resid  94 and name ha) (resid  97 and name hb1)  3.20  1.30  1.30
assign (resid  10 and name ha) (resid  10 and name hb1)  3.20  1.30  1.30
assign (resid  44 and name hb*) (resid  44 and name hg*)  3.20  1.30  2.70
assign (resid  98 and name ha) (resid 102 and name hg2*)  3.90  2.00  2.60
assign (resid  91 and name ha) (resid  94 and name hb1)  3.20  1.30  1.30
assign (resid  52 and name hb1) (resid  75 and name hg2*)  3.90  2.00  2.60
assign (resid  12 and name hb1) (resid  11 and name hg1*)  3.90  2.00  2.60
assign (resid  97 and name hb2) (resid  94 and name hd2*)  3.90  2.00  2.60
assign (resid  30 and name ha) (resid  30 and name hg*)  3.20  1.30  2.00
assign (resid  94 and name hb1) (resid  94 and name hg)  3.20  1.30  1.30
assign (resid  98 and name hb2) (resid  98 and name hd1*)  3.90  2.00  2.60
assign (resid  64 and name hb1) (resid  64 and name hd2*)  3.90  2.00  2.60
assign (resid  94 and name hd2*) (resid 105 and name hbb*)  4.70  2.80  4.00
assign (resid  93 and name hn) (resid  94 and name hn)  3.20  1.30  1.30
assign (resid  27 and name hn) (resid  26 and name ha)  3.20  1.30  1.30
assign (resid  74 and name hn) (resid  71 and name ha)  3.20  1.30  1.30
assign (resid  45 and name hn) (resid  44 and name ha)  3.20  1.30  1.30
assign (resid  52 and name hn) (resid  52 and name ha)  3.20  1.30  1.30
assign (resid  72 and name hn) (resid  71 and name hd*)  3.20  1.30  2.00
assign (resid 101 and name hn) (resid  98 and name ha)  3.20  1.30  1.30
assign (resid 103 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid 103 and name hn) (resid  36 and name he*)  3.20  1.30  5.30
assign (resid   9 and name hn) (resid   6 and name ha2)  3.20  1.30  1.30
assign (resid  35 and name hn) (resid  35 and name ha)  3.20  1.30  1.30
assign (resid  97 and name hd1) (resid   7 and name ha)  5.32  3.42  3.42
assign (resid  74 and name hd*) (resid  75 and name hg2*)  3.90  2.00  6.60
assign (resid  74 and name hd*) (resid  75 and name hg2*)  3.90  2.00  6.60
assign (resid  91 and name hn) (resid  89 and name hg2*)  3.90  2.00  2.60
assign (resid  59 and name hz3) (resid  57 and name hd1*)  3.90  2.00  2.60
assign (resid  82 and name he*) (resid 105 and name hab)  3.20  1.30  5.30
assign (resid  82 and name he*) (resid 105 and name hab)  3.20  1.30  5.30
assign (resid  44 and name hd*) (resid  44 and name hg*)  3.20  1.30  2.70
assign (resid   4 and name ha) (resid   4 and name hb*)  3.20  1.30  2.00
assign (resid  48 and name ha) (resid  48 and name hb1)  3.20  1.30  1.30
assign (resid  97 and name he1) (resid  98 and name hd2*)  6.02  4.12  4.72
assign (resid  57 and name ha) (resid  57 and name hb)  3.20  1.30  1.30
assign (resid  78 and name hg2*) (resid  76 and name hb1)  3.90  2.00  2.60
assign (resid  97 and name hb1) (resid   7 and name ha)  3.20  1.30  1.30
assign (resid  53 and name ha) (resid  53 and name hb2)  3.20  1.30  1.30
assign (resid  46 and name ha) (resid  46 and name hb2)  3.20  1.30  1.30
assign (resid  59 and name hb1) (resid  35 and name hg)  3.20  1.30  1.30
assign (resid  92 and name ha) (resid  92 and name hg*)  3.20  1.30  2.00
assign (resid  10 and name ha) (resid  94 and name hd2*)  3.90  2.00  2.60
assign (resid 102 and name hg2*) (resid 101 and name hb*)  4.70  2.80  4.00
assign (resid 102 and name hg2*) (resid  35 and name hd1*)  4.70  2.80  4.00
assign (resid  35 and name hg) (resid  35 and name hd1*)  3.90  2.00  2.60
assign (resid  57 and name hb) (resid  57 and name hd1*)  3.90  2.00  2.60
assign (resid  28 and name hg2*) (resid 105 and name hhd)  3.90  2.00  2.60
assign (resid  96 and name hn) (resid  93 and name ha)  3.20  1.30  1.30
assign (resid   7 and name hn) (resid  97 and name hd2)  5.32  3.42  3.42
assign (resid  74 and name hn) (resid  72 and name ha)  3.20  1.30  1.30
assign (resid  53 and name hn) (resid  50 and name ha)  3.20  1.30  1.30
assign (resid  74 and name hn) (resid  73 and name ha)  3.20  1.30  1.30
assign (resid  60 and name hn) (resid  60 and name ha)  3.20  1.30  1.30
assign (resid  82 and name hn) (resid  82 and name hb*)  3.20  1.30  2.00
assign (resid  14 and name hn) (resid  10 and name ha)  3.20  1.30  1.30
assign (resid  15 and name hn) (resid  14 and name hb2)  3.20  1.30  1.30
assign (resid  10 and name hd1) (resid  97 and name hd1)  7.44  5.54  5.54
assign (resid  56 and name hn) (resid  55 and name ha)  3.20  1.30  1.30
assign (resid  36 and name hd*) (resid 102 and name hg2*)  3.90  2.00  6.60
assign (resid  36 and name hd*) (resid 102 and name hg2*)  3.90  2.00  6.60
assign (resid 103 and name hn) (resid 102 and name hg2*)  3.90  2.00  2.60
assign (resid  36 and name hz) (resid  98 and name hb2)  3.20  1.30  1.30
assign (resid  57 and name hn) (resid  57 and name hg1*)  3.20  1.30  2.00
assign (resid  67 and name hd1) (resid  57 and name hd1*)  6.02  4.12  4.72
assign (resid  33 and name ha) (resid  33 and name hb*)  3.20  1.30  2.00
assign (resid  12 and name ha) (resid  12 and name hg*)  3.20  1.30  2.00
assign (resid  78 and name ha) (resid  49 and name hg2*)  3.90  2.00  2.60
assign (resid  63 and name ha) (resid  57 and name hg2*)  3.90  2.00  2.60
assign (resid  13 and name ha) (resid  13 and name hb*)  3.20  1.30  2.00
assign (resid  51 and name ha) (resid  51 and name hb*)  3.90  2.00  2.60
assign (resid  90 and name ha) (resid   9 and name hd1*)  3.90  2.00  2.60
assign (resid  36 and name ha) (resid  36 and name hb2)  3.20  1.30  1.30
assign (resid  72 and name hb*) (resid  72 and name hg*)  3.20  1.30  2.70
assign (resid  91 and name ha) (resid  91 and name hb2)  3.20  1.30  1.30
assign (resid  92 and name hb*) (resid  89 and name hg2*)  3.90  2.00  3.30
assign (resid  64 and name ha) (resid  64 and name hb2)  3.20  1.30  1.30
assign (resid  95 and name ha) (resid  95 and name hd1*)  3.90  2.00  2.60
assign (resid  10 and name hb1) (resid  94 and name hd2*)  3.90  2.00  2.60
assign (resid  61 and name ha) (resid  64 and name hd2*)  3.90  2.00  2.60
assign (resid   8 and name hb1) (resid   8 and name hg*)  3.20  1.30  2.00
assign (resid  57 and name hb) (resid  57 and name hg1*)  3.20  1.30  2.00
assign (resid  99 and name hb*) (resid  35 and name hd1*)  4.41  2.51  3.82
assign (resid  94 and name hb2) (resid  94 and name hd2*)  3.90  2.00  2.60
assign (resid   9 and name hg1*) (resid   9 and name hg2*)  3.90  2.00  3.30
assign (resid  30 and name hb*) (resid  30 and name hg*)  3.20  1.30  2.70
assign (resid  64 and name hg) (resid  64 and name hd2*)  3.90  2.00  2.60
assign (resid  68 and name hg) (resid  68 and name hd2*)  3.90  2.00  2.60
assign (resid  95 and name hd1*) (resid  64 and name hd1*)  4.70  2.80  4.00
assign (resid  59 and name hn) (resid  38 and name hn)  3.20  1.30  1.30
assign (resid  88 and name hn) (resid  89 and name hn)  3.20  1.30  1.30
assign (resid  89 and name hn) (resid  90 and name hn)  3.20  1.30  1.30
assign (resid  65 and name ha) (resid  66 and name hn)  3.20  1.30  1.30
assign (resid   6 and name ha1) (resid   9 and name hn)  3.20  1.30  1.30
assign (resid   7 and name ha) (resid  10 and name hn)  3.20  1.30  1.30
assign (resid  63 and name ha) (resid  66 and name hn)  3.20  1.30  1.30
assign (resid  65 and name ha) (resid  68 and name hn)  3.20  1.30  1.30
assign (resid  66 and name ha) (resid  69 and name hn)  3.20  1.30  1.30
assign (resid   6 and name ha2) (resid  10 and name hn)  3.20  1.30  1.30
assign (resid  65 and name ha) (resid  69 and name hn)  3.20  1.30  1.30
assign (resid  10 and name ha) (resid  13 and name hb*)  3.20  1.30  2.00
assign (resid  63 and name hn) (resid  63 and name hb)  3.20  1.30  1.30
assign (resid  41 and name hn) (resid  40 and name ha)  3.45  1.55  1.55
assign (resid   3 and name hn) (resid   3 and name hb)  3.45  1.55  1.55
assign (resid  77 and name ha*) (resid  76 and name ha)  3.45  1.55  2.25
assign (resid 105 and name hmc*) (resid 105 and name hab)  3.45  1.55  2.15
assign (resid  77 and name hn) (resid  76 and name hb1)  3.45  1.55  1.55
assign (resid  86 and name hb*) (resid  86 and name hg*)  3.45  1.55  2.95
assign (resid  12 and name hn) (resid  12 and name hb2)  3.45  1.55  1.55
assign (resid  96 and name hn) (resid  95 and name hg2*)  3.95  2.05  2.65
assign (resid  36 and name hn) (resid  36 and name hb2)  3.45  1.55  1.55
assign (resid  11 and name hn) (resid  10 and name hb2)  3.45  1.55  1.55
assign (resid  97 and name he1) (resid  10 and name hb1)  3.45  1.55  1.55
assign (resid  36 and name hn) (resid  36 and name hb1)  3.45  1.55  1.55
assign (resid  59 and name hh2) (resid  40 and name hg2*)  3.95  2.05  2.65
assign (resid  97 and name he1) (resid   7 and name ha)  3.45  1.55  1.55
assign (resid  42 and name hn) (resid  41 and name ha1)  3.45  1.55  1.55
assign (resid  82 and name hz) (resid  85 and name hb)  3.45  1.55  1.55
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assign (resid  58 and name ha) (resid  40 and name hg2*)  2.20  0.30  0.90
assign (resid  97 and name hd1) (resid  10 and name hb2)  3.45  1.55  1.55
assign (resid  97 and name he2) (resid  10 and name hb2)  3.45  1.55  1.55
assign (resid  97 and name he2) (resid  10 and name hb1)  4.70  2.80  2.80
assign (resid  81 and name ha) (resid  81 and name hg2*)  3.95  2.05  2.65
assign (resid  60 and name ha) (resid  36 and name hb2)  3.45  1.55  1.55
assign (resid  40 and name ha) (resid  41 and name ha1)  3.45  1.55  1.55
assign (resid  20 and name ha) (resid 101 and name hb*)  3.95  2.05  2.65
assign (resid  32 and name hn) (resid  20 and name ha)  2.70  0.80  0.80
assign (resid  64 and name hn) (resid  59 and name he3)  2.70  0.80  0.80
assign (resid  59 and name he3) (resid  59 and name hz3)  2.20  0.30  0.30
assign (resid  44 and name ha) (resid  44 and name hg*)  3.45  1.55  2.25
assign (resid  10 and name ha) (resid  94 and name hd1*)  3.95  2.05  2.65
assign (resid  12 and name hg*) (resid   9 and name hg1*)  3.45  1.55  2.95
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assign (resid  10 and name hn) (resid   9 and name ha)  3.45  1.55  1.55
assign (resid  95 and name hn) (resid  92 and name ha)  3.45  1.55  1.55
assign (resid  92 and name hn) (resid  92 and name ha)  2.70  0.80  0.80
assign (resid 101 and name hb*) (resid  20 and name hb)  3.95  2.05  2.65
assign (resid  99 and name hn) (resid  96 and name ha)  3.45  1.55  1.55
assign (resid  11 and name hn) (resid   8 and name ha)  2.70  0.80  0.80
assign (resid  36 and name hn) (resid  36 and name ha)  3.45  1.55  1.55
assign (resid  59 and name hn) (resid  58 and name ha)  3.45  1.55  1.55
assign (resid  65 and name hn) (resid  64 and name ha)  3.45  1.55  1.55
assign (resid  99 and name hb*) (resid  36 and name he*)  4.70  2.80  7.50
assign (resid  95 and name hg2*) (resid  36 and name he*)  4.70  2.80  7.40
assign (resid  97 and name he2) (resid 101 and name hb*)  3.20  1.30  1.90
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assign (resid  10 and name hd1) (resid  98 and name hd2*)  3.95  2.05  2.65
assign (resid  10 and name hd1) (resid  94 and name hd2*)  3.95  2.05  2.65
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assign (resid   9 and name hn) (resid   9 and name hd1*)  3.95  2.05  2.65
assign (resid   9 and name hn) (resid   9 and name hg1*)  2.70  0.80  1.50
assign (resid  10 and name hd2) (resid  94 and name hd2*)  3.95  2.05  2.65
assign (resid  10 and name hd2) (resid  98 and name hd2*)  3.95  2.05  2.65
assign (resid  91 and name hn) (resid  85 and name hg2*)  2.70  0.80  1.40
assign (resid 103 and name hn) (resid 101 and name hb*)  3.95  2.05  2.65
assign (resid  59 and name hd1) (resid  35 and name hd2*)  2.70  0.80  1.40
assign (resid  74 and name he*) (resid  47 and name hg2*)  4.70  2.80  7.40
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assign (resid  36 and name he*) (resid  98 and name hd2*)  4.70  2.80  7.40
assign (resid  97 and name hd1) (resid  98 and name hd2*)  3.95  2.05  2.65
assign (resid  97 and name hd1) (resid  94 and name hd2*)  3.20  1.30  1.90
assign (resid 105 and name hmb*) (resid  94 and name hg)  3.95  2.05  2.65
assign (resid  36 and name he*) (resid  99 and name hb*)  4.70  2.80  7.50
assign (resid  97 and name hd1) (resid  98 and name hb2)  3.45  1.55  1.55
assign (resid  74 and name he*) (resid  63 and name hg2*)  4.70  2.80  7.40
assign (resid  82 and name hz) (resid  85 and name hd1*)  3.20  1.30  1.90
assign (resid  82 and name hz) (resid  85 and name hg2*)  3.95  2.05  2.65
assign (resid  82 and name he*) (resid  85 and name hg2*)  4.70  2.80  7.40
assign (resid  82 and name he*) (resid  85 and name hb)  4.70  2.80  6.80
assign (resid  82 and name he*) (resid  13 and name hb*)  4.70  2.80  7.50
assign (resid  82 and name hz) (resid  13 and name hb*)  3.45  1.55  2.25
assign (resid  81 and name ha) (resid  81 and name hg1*)  3.45  1.55  2.25
assign (resid  98 and name ha) (resid 101 and name hb*)  3.20  1.30  1.90
assign (resid  58 and name ha) (resid  58 and name hg2*)  2.70  0.80  1.40
assign (resid  57 and name ha) (resid  63 and name hg2*)  3.95  2.05  2.65
assign (resid  95 and name ha) (resid  95 and name hg2*)  3.20  1.30  1.90
assign (resid  92 and name ha) (resid  95 and name hg2*)  3.95  2.05  2.65
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assign (resid  55 and name ha) (resid  54 and name hb*)  3.45  1.55  2.25
assign (resid  36 and name hb1) (resid  35 and name hb1)  3.45  1.55  1.55
assign (resid  28 and name hn) (resid  16 and name hg*)  2.70  0.80  1.50
assign (resid  52 and name ha) (resid 105 and name hbd*)  3.45  1.55  2.25
assign (resid  63 and name ha) (resid  66 and name hb1)  3.45  1.55  1.55
assign (resid  37 and name ha1) (resid  58 and name hg2*)  3.20  1.30  1.90
assign (resid  97 and name ha) (resid  97 and name hb2)  2.20  0.30  0.30
assign (resid  46 and name hd1) (resid  46 and name hb1)  2.70  0.80  0.80
assign (resid  97 and name he1) (resid  98 and name hb2)  3.45  1.55  1.55
assign (resid  82 and name ha) (resid  81 and name hg2*)  3.95  2.05  2.65
assign (resid  44 and name ha) (resid  44 and name hb*)  2.20  0.30  1.00
assign (resid  70 and name ha) (resid  71 and name hd*)  3.45  1.55  2.25
assign (resid  82 and name hz) (resid  13 and name ha)  3.45  1.55  1.55
assign (resid  76 and name ha) (resid  76 and name hb2)  3.45  1.55  1.55
assign (resid  76 and name ha) (resid  72 and name hb*)  3.45  1.55  2.25
assign (resid  59 and name hb1) (resid  35 and name hb1)  3.45  1.55  1.55
assign (resid   6 and name ha2) (resid   9 and name hg2*)  3.95  2.05  2.65
assign (resid  35 and name hb2) (resid  35 and name hd2*)  3.20  1.30  1.90
assign (resid  54 and name hb*) (resid  53 and name hg*)  2.70  0.80  2.20
assign (resid  52 and name hb1) (resid  51 and name hb*)  3.20  1.30  1.90
assign (resid  95 and name ha) (resid  95 and name hb)  3.45  1.55  1.55
assign (resid  10 and name hb2) (resid  94 and name hd2*)  3.20  1.30  1.90
assign (resid  69 and name hb*) (resid  86 and name hg*)  2.20  0.30  1.70
assign (resid  35 and name hd2*) (resid  35 and name hd1*)  2.70  0.80  2.00
assign (resid  94 and name hd2*) (resid  94 and name hd1*)  2.70  0.80  2.00
assign (resid  35 and name hb2) (resid  35 and name hd1*)  3.20  1.30  1.90
assign (resid  59 and name hb1) (resid  35 and name hd1*)  3.95  2.05  2.65
assign (resid 102 and name ha) (resid 102 and name hg2*)  3.20  1.30  1.90
assign (resid 102 and name ha) (resid  20 and name hg2*)  3.95  2.05  2.65
assign (resid   7 and name ha) (resid  11 and name hg2*)  2.70  0.80  1.40
assign (resid  48 and name hb2) (resid  49 and name hg2*)  3.95  2.05  2.65
assign (resid  48 and name hb1) (resid  53 and name hg*)  2.70  0.80  1.50
assign (resid  65 and name ha) (resid  68 and name hb*)  3.45  1.55  2.25
assign (resid  65 and name ha) (resid  64 and name hb2)  3.45  1.55  1.55
assign (resid  59 and name hb1) (resid  35 and name hd2*)  2.70  0.80  1.40
assign (resid   6 and name ha2) (resid  94 and name hd2*)  3.95  2.05  2.65
assign (resid   6 and name ha2) (resid   9 and name hg1*)  3.45  1.55  2.25
assign (resid  72 and name hb*) (resid  76 and name hg*)  2.70  0.80  2.20
assign (resid   9 and name hb) (resid   9 and name hg1*)  2.20  0.30  1.00
assign (resid  32 and name hd1*) (resid  35 and name hd2*)  4.20  2.30  3.50
assign (resid   9 and name hb) (resid   9 and name hd1*)  2.70  0.80  1.40
assign (resid 105 and name hbd*) (resid 105 and name had*)  3.45  1.55  2.95
assign (resid  85 and name ha) (resid  85 and name hd1*)  3.20  1.30  1.90
assign (resid  94 and name ha) (resid  94 and name hd1*)  3.20  1.30  1.90
assign (resid  94 and name ha) (resid  98 and name hd1*)  3.95  2.05  2.65
assign (resid  96 and name ha) (resid  96 and name hb*)  2.70  0.80  1.40
assign (resid  96 and name ha) (resid  99 and name hb*)  3.45  1.55  2.25
assign (resid  64 and name hg) (resid  64 and name hd1*)  2.70  0.80  1.40
assign (resid  57 and name hg1*) (resid  57 and name hd1*)  3.20  1.30  2.60
assign (resid  95 and name hg1*) (resid  35 and name hd1*)  3.20  1.30  2.60
assign (resid  94 and name hb1) (resid  94 and name hd1*)  3.95  2.05  2.65
assign (resid  32 and name hb2) (resid  35 and name hd1*)  3.20  1.30  1.90
assign (resid  99 and name ha) (resid  35 and name hd1*)  3.20  1.30  1.90
assign (resid  95 and name hg1*) (resid  35 and name hd2*)  3.20  1.30  2.60
assign (resid   9 and name hb) (resid   9 and name hg2*)  3.20  1.30  1.90
assign (resid  30 and name hg*) (resid 105 and name hhd)  2.20  0.30  1.00
assign (resid   9 and name hg2*) (resid  85 and name hd1*)  2.70  0.80  2.00
assign (resid  98 and name hd2*) (resid  98 and name hd1*)  2.70  0.80  2.00
assign (resid   9 and name hd1*) (resid  85 and name hd1*)  3.20  1.30  2.50
assign (resid   1 and name ha2) (resid   2 and name hb*)  3.45  1.55  2.25
assign (resid  92 and name ha) (resid  91 and name hb2)  3.45  1.55  1.55
assign (resid  65 and name ha) (resid  91 and name hb2)  3.45  1.55  1.55
assign (resid   9 and name ha) (resid  12 and name hb1)  3.45  1.55  1.55
assign (resid  20 and name ha) (resid  20 and name hg2*)  3.20  1.30  1.90
assign (resid  20 and name ha) (resid 102 and name hg2*)  3.95  2.05  2.65
assign (resid  24 and name ha1) (resid 102 and name hg2*)  3.95  2.05  2.65
assign (resid  96 and name ha) (resid  99 and name hb*)  3.45  1.55  2.25
assign (resid  96 and name ha) (resid  99 and name ha)  3.45  1.55  1.55
assign (resid  25 and name ha) (resid  25 and name hb*)  2.20  0.30  1.00
assign (resid  13 and name hb*) (resid  85 and name hd1*)  3.95  2.05  3.35
assign (resid  32 and name ha) (resid  35 and name hd1*)  3.95  2.05  2.65
assign (resid  17 and name ha) (resid  28 and name hg2*)  3.95  2.05  2.65
assign (resid  36 and name he*) (resid  36 and name ha)  4.70  2.80  6.80
assign (resid  82 and name he*) (resid  71 and name hg*)  4.70  2.80  7.50
assign (resid  82 and name he*) (resid  82 and name hb*)  4.70  2.80  7.50
assign (resid  82 and name hz) (resid  85 and name ha)  3.45  1.55  1.55
assign (resid  72 and name ha) (resid  72 and name hb*)  2.70  0.80  1.50
assign (resid  71 and name hb*) (resid  71 and name hg*)  3.45  1.55  2.95
assign (resid  97 and name he1) (resid  98 and name ha)  3.45  1.55  1.55
assign (resid  97 and name he1) (resid  10 and name ha)  3.45  1.55  1.55
assign (resid  81 and name ha) (resid  72 and name hg*)  3.45  1.55  2.25
assign (resid 103 and name ha) (resid 104 and name ha)  3.45  1.55  1.55
assign (resid  70 and name ha) (resid  71 and name hd*)  3.45  1.55  2.25
assign (resid  77 and name ha1) (resid  77 and name ha2)  3.45  1.55  2.95
assign (resid  43 and name ha) (resid  44 and name ha)  3.45  1.55  1.55
assign (resid  82 and name ha) (resid  83 and name ha)  3.45  1.55  1.55
assign (resid  58 and name ha) (resid  58 and name hb)  2.70  0.80  0.80
assign (resid  97 and name ha) (resid   6 and name ha2)  3.45  1.55  1.55
assign (resid  67 and name ha) (resid  67 and name hb2)  2.70  0.80  0.80
assign (resid  44 and name hd1) (resid  44 and name hd2)  2.20  0.30  1.70
assign (resid  42 and name ha) (resid  34 and name ha*)  3.45  1.55  2.25
assign (resid  44 and name ha) (resid  44 and name hd*)  3.45  1.55  2.25
assign (resid  70 and name ha) (resid  71 and name hg*)  3.45  1.55  2.25
assign (resid  59 and name hb1) (resid  35 and name hb2)  3.45  1.55  1.55
assign (resid  92 and name ha) (resid  92 and name hb*)  3.45  1.55  2.25
assign (resid  76 and name hd*) (resid  76 and name hb2)  3.45  1.55  2.25
assign (resid  78 and name hg2*) (resid  72 and name hb*)  3.20  1.30  2.60
assign (resid  85 and name ha) (resid  85 and name hg2*)  2.70  0.80  1.40
assign (resid  85 and name ha) (resid  85 and name hg1*)  2.70  0.80  1.50
assign (resid  64 and name ha) (resid  95 and name hd1*)  3.20  1.30  1.90
assign (resid  94 and name ha) (resid   9 and name hg2*)  3.95  2.05  2.65
assign (resid  95 and name hn) (resid  95 and name hg2*)  3.95  2.05  2.65
assign (resid  13 and name hn) (resid  13 and name hb*)  2.70  0.80  1.50
assign (resid  94 and name hn) (resid  94 and name hg)  3.45  1.55  1.55
assign (resid  94 and name hn) (resid  94 and name hd2*)  3.95  2.05  2.65
assign (resid  10 and name hn) (resid  94 and name hd2*)  3.20  1.30  1.90
assign (resid   9 and name hn) (resid   9 and name hg2*)  3.20  1.30  1.90
assign (resid  36 and name hz) (resid  98 and name hd2*)  3.20  1.30  1.90
assign (resid  36 and name hz) (resid  35 and name hd1*)  3.20  1.30  1.90
assign (resid  36 and name he*) (resid  35 and name hd1*)  4.70  2.80  7.40
assign (resid  36 and name hd*) (resid  35 and name hd1*)  4.70  2.80  7.40
assign (resid  36 and name hd*) (resid  35 and name hd2*)  4.70  2.80  7.40
assign (resid  35 and name hn) (resid  35 and name hb2)  3.45  1.55  1.55
assign (resid  35 and name hn) (resid  59 and name hb1)  3.45  1.55  1.55
assign (resid  46 and name hn) (resid  43 and name hb*)  3.95  2.05  2.65
assign (resid  74 and name he*) (resid  66 and name hb1)  4.70  2.80  6.80
assign (resid  74 and name he*) (resid  57 and name hb)  4.70  2.80  6.80
assign (resid  74 and name he*) (resid  67 and name hb1)  4.70  2.80  6.80
assign (resid  36 and name hd*) (resid  59 and name hb1)  4.70  2.80  6.80
assign (resid  91 and name hn) (resid  90 and name ha)  3.45  1.55  1.55
assign (resid  74 and name he*) (resid  67 and name ha)  4.70  2.80  6.80
assign (resid  47 and name hn) (resid  48 and name ha)  3.45  1.55  1.55
assign (resid  91 and name hn) (resid  88 and name ha)  2.70  0.80  0.80
assign (resid  36 and name he*) (resid  59 and name hb1)  4.70  2.80  6.80
assign (resid  26 and name hd2) (resid  26 and name hb*)  2.70  0.80  1.50
assign (resid  82 and name he*) (resid  85 and name ha)  4.70  2.80  6.80
assign (resid  59 and name he3) (resid  63 and name ha)  3.45  1.55  1.55
assign (resid  97 and name hd2) (resid  98 and name ha)  3.45  1.55  1.55
assign (resid  10 and name hn) (resid  97 and name he1)  3.45  1.55  1.55
assign (resid  64 and name hn) (resid  63 and name ha)  3.45  1.55  1.55
assign (resid  67 and name hn) (resid  66 and name ha)  3.45  1.55  1.55
assign (resid  78 and name hg2*) (resid  75 and name hn)  3.95  2.05  2.65
assign (resid  98 and name hn) (resid  97 and name ha)  3.45  1.55  1.55
assign (resid  99 and name hn) (resid  97 and name ha)  3.45  1.55  1.55
assign (resid  11 and name hn) (resid  11 and name hb)  2.70  0.80  0.80
assign (resid  83 and name hn) (resid  82 and name ha)  3.45  1.55  1.55
assign (resid  67 and name hn) (resid  63 and name ha)  3.45  1.55  1.55
assign (resid  93 and name hn) (resid  93 and name ha)  2.70  0.80  0.80
assign (resid   7 and name hn) (resid   4 and name ha)  3.45  1.55  1.55
assign (resid  94 and name hn) (resid  93 and name ha)  3.45  1.55  1.55
assign (resid  42 and name hn) (resid  44 and name hd*)  3.45  1.55  2.25
assign (resid  97 and name hn) (resid   6 and name ha2)  3.45  1.55  1.55
assign (resid  12 and name hn) (resid   9 and name ha)  3.45  1.55  1.55
assign (resid  96 and name hn) (resid  92 and name ha)  3.45  1.55  1.55
assign (resid  59 and name he1) (resid  40 and name hn)  3.45  1.55  1.55
assign (resid  75 and name hn) (resid  74 and name hn)  3.45  1.55  1.55
assign (resid  11 and name hn) (resid  10 and name hd1)  4.70  2.80  2.80
assign (resid  64 and name hn) (resid  60 and name hn)  2.70  0.80  0.80
assign (resid  13 and name hn) (resid  14 and name hn)  2.20  0.30  0.30
assign (resid  59 and name he1) (resid  59 and name hh2)  3.45  1.55  1.55
assign (resid  59 and name he1) (resid  59 and name hd1)  2.70  0.80  0.80
assign (resid  99 and name hn) (resid  36 and name he*)  4.70  2.80  6.80
assign (resid  10 and name hz) (resid  19 and name ha)  2.70  0.80  0.80
assign (resid  67 and name hn) (resid  59 and name hh2)  3.45  1.55  1.55
assign (resid  26 and name he1) (resid  26 and name hd2)  3.45  1.55  1.55
assign (resid  59 and name he3) (resid  59 and name hh2)  3.45  1.55  1.55
assign (resid  26 and name he1) (resid  43 and name ha)  3.45  1.55  1.55
assign (resid  59 and name he3) (resid  59 and name ha)  2.70  0.80  0.80
assign (resid  74 and name he*) (resid  63 and name ha)  4.70  2.80  6.80
assign (resid  82 and name he*) (resid  82 and name ha)  4.70  2.80  6.80
assign (resid  82 and name he*) (resid  71 and name hd*)  4.70  2.80  7.50
assign (resid  19 and name ha) (resid  20 and name ha)  3.45  1.55  1.55
assign (resid  71 and name hb1) (resid  71 and name hb2)  3.45  1.55  2.95
assign (resid  48 and name ha) (resid  52 and name hb1)  3.45  1.55  1.55
assign (resid  81 and name ha) (resid  81 and name hd1*)  2.70  0.80  1.40
assign (resid  78 and name hb) (resid  49 and name hg2*)  3.20  1.30  1.90
assign (resid  76 and name ha) (resid  76 and name hb1)  3.45  1.55  1.55
assign (resid  72 and name ha) (resid  72 and name hg*)  2.70  0.80  1.50
assign (resid  20 and name ha) (resid  20 and name hb)  2.70  0.80  0.80
assign (resid  76 and name hd*) (resid  76 and name ha)  3.45  1.55  2.25
assign (resid  26 and name ha) (resid  30 and name ha)  2.70  0.80  0.80
assign (resid  70 and name ha) (resid  70 and name hb*)  3.45  1.55  2.25
assign (resid  46 and name hd1) (resid  30 and name ha)  2.70  0.80  0.80
assign (resid  46 and name hd1) (resid  26 and name hb*)  3.45  1.55  2.25
assign (resid  57 and name ha) (resid  57 and name hg2*)  2.70  0.80  1.40
assign (resid  44 and name ha) (resid  46 and name hb2)  3.45  1.55  1.55
assign (resid  48 and name ha) (resid 105 and name hbd*)  2.20  0.30  1.00
assign (resid  27 and name ha) (resid  25 and name hb*)  2.70  0.80  1.50
assign (resid   2 and name ha) (resid   2 and name hb*)  2.70  0.80  1.50
assign (resid  92 and name ha) (resid  95 and name hd1*)  3.95  2.05  2.65
assign (resid   6 and name ha1) (resid   9 and name hg1*)  3.45  1.55  2.25
assign (resid  85 and name ha) (resid  85 and name hb)  3.45  1.55  1.55
assign (resid   9 and name ha) (resid   9 and name hg1*)  2.95  1.05  1.75
assign (resid  32 and name hb2) (resid  20 and name hg1*)  3.20  1.30  1.90
assign (resid  59 and name hb1) (resid  64 and name hb1)  3.45  1.55  1.55
assign (resid   9 and name ha) (resid   9 and name hb)  2.70  0.80  0.80
assign (resid  10 and name ha) (resid   9 and name hb)  2.95  1.05  1.05
assign (resid  65 and name ha) (resid  61 and name hb2)  3.45  1.55  1.55
assign (resid  76 and name hb2) (resid  76 and name hb1)  2.20  0.30  0.30
assign (resid  72 and name hg1) (resid  72 and name hg2)  2.20  0.30  1.70
assign (resid  72 and name hb*) (resid  72 and name hg*)  2.70  0.80  2.20
assign (resid   2 and name hb*) (resid  93 and name hb*)  2.20  0.30  1.70
assign (resid   9 and name ha) (resid  12 and name hg*)  3.45  1.55  2.25
assign (resid  67 and name hb1) (resid  64 and name hd1*)  3.20  1.30  1.90
assign (resid  81 and name hb) (resid  81 and name hd1*)  3.95  2.05  2.65
assign (resid   3 and name hb) (resid   3 and name hg2*)  2.70  0.80  1.40
assign (resid   3 and name hb) (resid   3 and name hg1*)  2.70  0.80  1.40
assign (resid  20 and name hb) (resid  20 and name hg2*)  2.70  0.80  1.40
assign (resid  81 and name hb) (resid  81 and name hg2*)  2.70  0.80  1.40
assign (resid  64 and name hb1) (resid  64 and name hd1*)  3.95  2.05  2.65
assign (resid  85 and name hb) (resid  68 and name hd2*)  3.95  2.05  2.65
assign (resid  95 and name hg2*) (resid  64 and name hd1*)  4.20  2.30  3.50
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assign (resid  85 and name hg2*) (resid  85 and name hd1*)  2.70  0.80  2.00
assign (resid  68 and name hg) (resid  85 and name hd1*)  2.70  0.80  1.40
assign (resid  95 and name hd1*) (resid  94 and name hd1*)  4.20  2.30  3.50
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assign (resid  57 and name hd1*) (resid  63 and name hg2*)  2.70  0.80  2.00
assign (resid  98 and name hd1*) (resid  98 and name hg)  3.95  2.05  2.65
assign (resid  85 and name hd1*) (resid  91 and name hb1)  3.95  2.05  2.65
assign (resid  94 and name hd1*) (resid  68 and name hd2*)  2.70  0.80  2.00
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assign (resid 102 and name hg2*) (resid  98 and name hd1*)  4.20  2.30  3.50
assign (resid 102 and name ha) (resid  20 and name hb)  3.45  1.55  1.55
assign (resid  78 and name hb) (resid  49 and name hb)  3.45  1.55  1.55
assign (resid  59 and name he1) (resid  58 and name ha)  3.45  1.55  1.55
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assign (resid  97 and name he1) (resid  94 and name hd2*)  4.70  2.80  3.40
assign (resid  97 and name hd1) (resid  94 and name hg)  4.70  2.80  2.80
assign (resid  55 and name hb*) (resid  57 and name hg2*)  3.95  2.05  3.35
assign (resid  40 and name hb) (resid  41 and name ha1)  3.45  1.55  1.55
assign (resid  92 and name hn) (resid  90 and name ha)  3.45  1.55  1.55
assign (resid  60 and name hn) (resid  59 and name he3)  3.45  1.55  1.55
assign (resid  97 and name hn) (resid  97 and name hd1)  4.70  2.80  2.80
assign (resid  31 and name ha) (resid  19 and name hn)  3.45  1.55  1.55
assign (resid  16 and name hb1) (resid  16 and name hb2)  3.45  1.55  2.95
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assign (resid  38 and name hb1) (resid  38 and name hb2)  3.45  1.55  2.95
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assign (resid  46 and name hb2) (resid  46 and name hb1)  3.45  1.55  1.55
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assign (resid  60 and name hb2) (resid  60 and name hb1)  3.45  1.55  1.55
assign (resid  85 and name hg11) (resid  85 and name hg12)  3.45  1.55  2.95
assign (resid   9 and name hg11) (resid   9 and name hg12)  3.45  1.55  2.95
assign (resid  16 and name hg1) (resid  16 and name hg2)  3.45  1.55  2.95
assign (resid  66 and name hg1) (resid  66 and name hg2)  3.45  1.55  2.95
assign (resid  76 and name ha) (resid  72 and name hg*)  3.45  1.55  2.25
assign (resid  42 and name hg*) (resid  42 and name hn)  3.45  1.55  2.25
assign (resid  63 and name hb) (resid  59 and name he3)  3.45  1.55  1.55
assign (resid  98 and name hb1) (resid  36 and name he*)  4.45  2.55  6.55
assign (resid  78 and name ha) (resid  79 and name hn)  3.45  1.55  1.55
assign (resid  74 and name he*) (resid  59 and name hh2)  4.45  2.55  6.55
assign (resid  66 and name hb1) (resid  66 and name hg*)  3.45  1.55  2.25
assign (resid  57 and name hg1*) (resid  40 and name hg2*)  3.95  2.05  3.35
assign (resid  33 and name ha) (resid 102 and name hg2*)  3.95  2.05  2.65
assign (resid  44 and name hb*) (resid  44 and name hg*)  3.45  1.55  2.95
assign (resid  76 and name hg*) (resid  76 and name hb1)  3.45  1.55  2.25
assign (resid  36 and name ha) (resid  36 and name hb1)  3.45  1.55  1.55
assign (resid  60 and name ha) (resid  60 and name hb1)  3.45  1.55  1.55
assign (resid  72 and name hg*) (resid  72 and name hb*)  3.45  1.55  2.95
assign (resid  94 and name ha) (resid   6 and name ha1)  3.45  1.55  1.55
assign (resid  72 and name hb*) (resid  76 and name hb2)  3.45  1.55  2.25
assign (resid  46 and name hd1) (resid  46 and name hb2)  4.45  2.55  2.55
assign (resid  73 and name ha) (resid  73 and name hb*)  3.45  1.55  2.25
assign (resid  12 and name ha) (resid  12 and name hb2)  3.45  1.55  1.55
assign (resid  16 and name ha) (resid  16 and name hb*)  3.45  1.55  2.25
assign (resid  16 and name ha) (resid  16 and name hg*)  3.45  1.55  2.25
assign (resid  25 and name ha) (resid  26 and name hn)  3.45  1.55  1.55
assign (resid  10 and name hb2) (resid  10 and name hd2)  4.45  2.55  2.55
assign (resid  85 and name hg1*) (resid  85 and name hb)  3.45  1.55  2.25
assign (resid  73 and name hb*) (resid  73 and name hn)  3.45  1.55  2.25
assign (resid  10 and name he2) (resid  10 and name hz)  4.95  3.05  3.05
assign (resid  85 and name hb) (resid  85 and name hg2*)  3.95  2.05  2.65
assign (resid  10 and name hb1) (resid  10 and name hd1)  4.45  2.55  2.55
assign (resid  85 and name hg1*) (resid  85 and name hd1*)  3.95  2.05  3.35
assign (resid   9 and name hb) (resid   6 and name ha2)  3.45  1.55  1.55
assign (resid  10 and name hd1) (resid  10 and name he1)  4.95  3.05  3.05
assign (resid  36 and name hd*) (resid  36 and name he*)  4.95  3.05 11.05
assign (resid  97 and name hd1) (resid  97 and name he1)  4.95  3.05  3.05
assign (resid  10 and name he1) (resid  10 and name hz)  4.95  3.05  3.05
assign (resid  86 and name ha) (resid  86 and name hg*)  3.45  1.55  2.25
assign (resid  54 and name ha) (resid  54 and name hb*)  3.45  1.55  2.25
assign (resid 103 and name hn) (resid 103 and name hb*)  3.45  1.55  2.25
assign (resid  31 and name ha) (resid  31 and name hb1)  3.45  1.55  1.55
assign (resid  35 and name ha) (resid  35 and name hd2*)  3.95  2.05  2.65
assign (resid  67 and name hb2) (resid  59 and name hz3)  3.45  1.55  1.55
assign (resid  64 and name ha) (resid  59 and name hz3)  3.45  1.55  1.55
assign (resid  16 and name hb*) (resid  16 and name hg*)  3.45  1.55  2.95
assign (resid  59 and name hb2) (resid  35 and name hd2*)  3.95  2.05  2.65
assign (resid  95 and name hg2*) (resid  95 and name hg1*)  3.95  2.05  3.35
assign (resid  73 and name hb*) (resid  73 and name hn)  3.45  1.55  2.25
assign (resid  85 and name ha) (resid  85 and name hg1*)  3.45  1.55  2.25
assign (resid  94 and name ha) (resid   6 and name ha2)  3.45  1.55  1.55
assign (resid  98 and name ha) (resid  98 and name hb2)  3.45  1.55  1.55
assign (resid  48 and name hb2) (resid  53 and name hb2)  3.45  1.55  1.55
assign (resid  85 and name hb) (resid  85 and name hn)  3.45  1.55  1.55
assign (resid  98 and name hd2*) (resid  35 and name hd1*)  4.45  2.55  3.75
assign (resid  57 and name hn) (resid  40 and name hg2*)  3.95  2.05  2.65
assign (resid  94 and name hd2*) (resid  94 and name hb1)  3.95  2.05  2.65
assign (resid  94 and name hd1*) (resid  94 and name hb2)  3.95  2.05  2.65
assign (resid  66 and name hb1) (resid  66 and name ha)  3.45  1.55  1.55
assign (resid 100 and name hb*) (resid 100 and name hn)  3.45  1.55  2.25
assign (resid  28 and name hb) (resid  17 and name ha)  3.45  1.55  1.55
assign (resid  31 and name hb2) (resid  24 and name ha2)  3.45  1.55  1.55
assign (resid  66 and name hg*) (resid  66 and name hb1)  3.45  1.55  2.25
assign (resid  64 and name hd2*) (resid  64 and name hb2)  3.95  2.05  2.65
assign (resid   5 and name hb*) (resid  93 and name hb*)  3.45  1.55  2.95
assign (resid  72 and name ha) (resid  72 and name hg*)  3.45  1.55  2.25
assign (resid  12 and name hb2) (resid  12 and name hg*)  3.45  1.55  2.25
assign (resid  59 and name hz2) (resid  40 and name hb)  3.45  1.55  1.55
assign (resid  63 and name hg2*) (resid  57 and name hb)  3.95  2.05  2.65
assign (resid  16 and name hb*) (resid  16 and name hg*)  3.45  1.55  2.95
assign (resid  68 and name hb*) (resid  68 and name hd2*)  3.95  2.05  3.35
assign (resid 100 and name ha) (resid 103 and name hb*)  3.45  1.55  2.25
assign (resid  74 and name hd*) (resid  59 and name hh2)  4.45  2.55  6.55
assign (resid  12 and name ha) (resid  12 and name hb1)  3.45  1.55  1.55
assign (resid  16 and name ha) (resid  16 and name hb*)  3.45  1.55  2.25
assign (resid  73 and name ha) (resid  73 and name hb*)  3.45  1.55  2.25
assign (resid  85 and name hb) (resid  85 and name hg1*)  3.45  1.55  2.25
assign (resid  81 and name hg1*) (resid  81 and name hb)  3.45  1.55  2.25
assign (resid  67 and name hb1) (resid  59 and name hz3)  3.45  1.55  1.55
assign (resid  78 and name hg2*) (resid  72 and name ha)  3.95  2.05  2.65
assign (resid  78 and name hb) (resid  75 and name hg2*)  3.95  2.05  2.65
assign (resid  24 and name ha1) (resid  31 and name hb1)  3.45  1.55  1.55
assign (resid   9 and name hd1*) (resid   9 and name hg2*)  4.45  2.55  3.75
assign (resid  36 and name ha) (resid  60 and name ha)  3.45  1.55  1.55
assign (resid   3 and name hb) (resid   4 and name hn)  3.45  1.55  1.55
assign (resid  63 and name hb) (resid  59 and name hz3)  3.45  1.55  1.55
assign (resid  95 and name ha) (resid  98 and name hb2)  3.45  1.55  1.55
assign (resid  26 and name ha) (resid  31 and name hb1)  3.45  1.55  1.55
assign (resid  86 and name ha) (resid  86 and name hg*)  3.45  1.55  2.25
assign (resid  26 and name hb*) (resid  46 and name hd2)  4.45  2.55  3.25
assign (resid  46 and name ha) (resid  47 and name hn)  3.45  1.55  1.55
assign (resid  42 and name hg*) (resid  42 and name hn)  3.45  1.55  2.25
assign (resid  76 and name ha) (resid  72 and name hg*)  3.45  1.55  2.25
assign (resid  46 and name ha) (resid  26 and name hb*)  3.45  1.55  2.25
assign (resid  75 and name hb) (resid  78 and name hb)  3.45  1.55  1.55
assign (resid   5 and name hb*) (resid   5 and name hn)  3.45  1.55  2.25
assign (resid  74 and name he*) (resid  57 and name hd1*)  4.95  3.05  7.65
assign (resid  73 and name ha) (resid  73 and name hg*)  3.45  1.55  2.25
assign (resid  68 and name hg) (resid  68 and name ha)  3.45  1.55  1.55
assign (resid  59 and name hz3) (resid  63 and name hg2*)  3.95  2.05  2.65
assign (resid  11 and name ha) (resid  10 and name hd2)  4.45  2.55  2.55
assign (resid   8 and name ha) (resid  12 and name hg*)  3.45  1.55  2.25
assign (resid  62 and name hb*) (resid  63 and name hn)  3.45  1.55  2.25
assign (resid  36 and name he*) (resid  64 and name hd2*)  4.95  3.05  7.65
assign (resid  97 and name hd1) (resid   6 and name ha1)  4.45  2.55  2.55
assign (resid   2 and name hb*) (resid   5 and name hb*)  3.45  1.55  2.95
assign (resid  94 and name hg) (resid   9 and name hg2*)  3.95  2.05  2.65
assign (resid  59 and name hz2) (resid  67 and name hd1)  4.45  2.55  2.55
assign (resid  46 and name he1) (resid  47 and name hg2*)  4.95  3.05  3.65
assign (resid  59 and name he3) (resid  63 and name hg2*)  3.95  2.05  2.65
assign (resid  50 and name ha) (resid  53 and name hb2)  3.45  1.55  1.55
assign (resid  44 and name hb*) (resid  44 and name hd*)  3.45  1.55  2.95
assign (resid  10 and name hb2) (resid  10 and name hd1)  4.45  2.55  2.55
assign (resid  83 and name ha) (resid  82 and name hd*)  4.45  2.55  6.55
assign (resid  57 and name hg1*) (resid  57 and name hg2*)  3.95  2.05  3.35
assign (resid  67 and name hb1) (resid  59 and name hh2)  3.45  1.55  1.55
assign (resid  98 and name hb2) (resid  35 and name hd1*)  3.95  2.05  2.65
assign (resid  13 and name ha) (resid  82 and name he*)  4.45  2.55  6.55
assign (resid  97 and name hd2) (resid 101 and name hb*)  4.95  3.05  3.65
assign (resid  74 and name hd*) (resid  59 and name hz3)  4.45  2.55  6.55
assign (resid  36 and name he*) (resid  64 and name hd2*)  4.95  3.05  7.65
assign (resid  73 and name ha) (resid  70 and name hb*)  3.45  1.55  2.25
assign (resid 105 and name had*) (resid  67 and name hh)  3.45  1.55  2.25
assign (resid   6 and name ha1) (resid   9 and name hb)  3.45  1.55  1.55
assign (resid  64 and name hg) (resid  59 and name hz3)  3.45  1.55  1.55
assign (resid  57 and name hd1*) (resid  40 and name hg2*)  4.45  2.55  3.75
assign (resid  35 and name hg) (resid  98 and name hd2*)  3.95  2.05  2.65
assign (resid  61 and name ha) (resid  36 and name he*)  4.45  2.55  6.55
assign (resid  30 and name ha) (resid  26 and name hb*)  3.45  1.55  2.25
assign (resid  95 and name ha) (resid  64 and name hd2*)  3.95  2.05  2.65
assign (resid  57 and name hn) (resid  57 and name hg2*)  3.95  2.05  2.65
assign (resid  78 and name hb) (resid  52 and name hb1)  3.45  1.55  1.55
assign (resid  95 and name hg2*) (resid  95 and name hd1*)  4.45  2.55  3.75
assign (resid  68 and name hg) (resid  94 and name hb1)  3.45  1.55  1.55
assign (resid  48 and name hb1) (resid  44 and name hb*)  3.45  1.55  2.25
assign (resid  59 and name he3) (resid  64 and name hd2*)  3.95  2.05  2.65
assign (resid   3 and name ha) (resid  97 and name ha)  3.45  1.55  1.55
assign (resid  30 and name hb*) (resid  46 and name hb2)  3.45  1.55  2.25
assign (resid  71 and name hg*) (resid  72 and name hb*)  3.45  1.55  2.95
assign (resid  94 and name hb2) (resid   6 and name ha2)  3.45  1.55  1.55
assign (resid  97 and name hd1) (resid  97 and name hd2)  4.95  3.05  3.05
assign (resid  46 and name hd2) (resid  46 and name hd1)  4.95  3.05  3.05
assign (resid  10 and name he1) (resid  10 and name he2)  4.45  2.55  2.55
assign (resid  46 and name he1) (resid  46 and name he2)  4.95  3.05  3.05
assign (resid  10 and name hd1) (resid  10 and name hd2)  4.95  3.05  3.05
assign (resid  10 and name hd1) (resid  10 and name hz)  4.95  3.05  3.05
assign (resid  72 and name ha) (resid  76 and name hb2)  3.45  1.55  1.55
assign (resid  40 and name hb) (resid  57 and name hd1*)  3.95  2.05  2.65
assign (resid  59 and name hz2) (resid  57 and name hd1*)  3.95  2.05  2.65
assign (resid  74 and name he*) (resid  59 and name hz3)  4.45  2.55  6.55
assign (resid  73 and name ha) (resid  70 and name hb*)  3.45  1.55  2.25
assign (resid   1 and name ha2) (resid   2 and name ha)  3.45  1.55  1.55
assign (resid  71 and name hd*) (resid  86 and name hb*)  3.45  1.55  2.95
assign (resid  72 and name hg*) (resid  76 and name hb1)  3.45  1.55  2.25
assign (resid  79 and name hn) (resid  49 and name hg2*)  3.95  2.05  2.65
assign (resid   3 and name ha) (resid   2 and name ha)  3.45  1.55  1.55
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assign (resid  24 and name ha1) (resid  20 and name hn)  3.45  1.55  1.55
assign (resid  95 and name hb) (resid  64 and name hb2)  3.45  1.55  1.55
assign (resid  59 and name hb1) (resid  64 and name hd2*)  3.95  2.05  2.65
assign (resid   3 and name ha) (resid   4 and name ha)  3.45  1.55  1.55
assign (resid  94 and name hb2) (resid  85 and name hd1*)  3.95  2.05  2.65
assign (resid  98 and name hn) (resid  98 and name hg)  3.45  1.55  1.55
assign (resid  10 and name ha) (resid  94 and name hg)  3.45  1.55  1.55
assign (resid   9 and name hg1*) (resid  94 and name hd1*)  3.95  2.05  3.35
assign (resid  52 and name hb2) (resid  49 and name hg2*)  3.95  2.05  2.65
assign (resid  12 and name ha) (resid  11 and name ha)  3.45  1.55  1.55
assign (resid  52 and name hb1) (resid  49 and name hg2*)  3.95  2.05  2.65
assign (resid  63 and name ha) (resid  62 and name hb*)  3.45  1.55  2.25
assign (resid  35 and name hg) (resid  36 and name he*)  4.45  2.55  6.55
assign (resid  95 and name hg2*) (resid  64 and name hd2*)  4.45  2.55  3.75
assign (resid  11 and name ha) (resid  12 and name hg*)  3.45  1.55  2.25
assign (resid  22 and name ha) (resid  23 and name ha*)  3.45  1.55  2.25
assign (resid 103 and name hb*) (resid 100 and name ha)  3.45  1.55  2.25
assign (resid  76 and name hg*) (resid  72 and name hb*)  3.45  1.55  2.95
assign (resid  17 and name ha) (resid  16 and name hg*)  3.45  1.55  2.25
assign (resid 105 and name had*) (resid  47 and name hg2*)  3.95  2.05  3.35
assign (resid  10 and name hb1) (resid  10 and name he1)  4.45  2.55  2.55
assign (resid  62 and name hg*) (resid  63 and name hn)  3.45  1.55  2.25
assign (resid  10 and name ha) (resid  10 and name he1)  4.45  2.55  2.55
assign (resid  98 and name ha) (resid  97 and name ha)  3.45  1.55  1.55
assign (resid  10 and name hb2) (resid   9 and name hb)  3.45  1.55  1.55
assign (resid  94 and name hb2) (resid   6 and name ha1)  3.45  1.55  1.55
assign (resid  10 and name hd1) (resid  94 and name hd1*)  4.95  3.05  3.65
assign (resid  28 and name hb) (resid  16 and name ha)  3.45  1.55  1.55
assign (resid  10 and name hb1) (resid  94 and name hd1*)  3.95  2.05  2.65
assign (resid  71 and name ha) (resid  73 and name hb*)  3.45  1.55  2.25
assign (resid  94 and name ha) (resid  10 and name hb1)  3.45  1.55  1.55
assign (resid  85 and name hg1*) (resid  68 and name hd2*)  3.95  2.05  3.35
assign (resid  40 and name hg2*) (resid  63 and name hg2*)  4.45  2.55  3.75
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assign (resid 101 and name ha) (resid  97 and name hd2)  4.45  2.55  2.55
assign (resid  38 and name ha) (resid  40 and name hg2*)  3.95  2.05  2.65
assign (resid  72 and name ha) (resid  78 and name hb)  3.45  1.55  1.55
assign (resid  94 and name ha) (resid  95 and name ha)  3.45  1.55  1.55
assign (resid  59 and name hb2) (resid  35 and name hd1*)  3.95  2.05  2.65
assign (resid   9 and name ha) (resid  12 and name hb2)  3.45  1.55  1.55
assign (resid  85 and name hd1*) (resid  94 and name hg)  3.95  2.05  2.65
assign (resid  72 and name ha) (resid  73 and name ha)  3.45  1.55  1.55
assign (resid  58 and name hb) (resid  63 and name hg2*)  3.95  2.05  2.65
assign (resid  95 and name ha) (resid  64 and name hb2)  3.45  1.55  1.55
assign (resid  85 and name hg1*) (resid  94 and name hd1*)  3.95  2.05  3.35
assign (resid  64 and name hg) (resid  36 and name he*)  4.45  2.55  6.55
assign (resid  73 and name hg*) (resid  66 and name hg*)  3.45  1.55  2.95
assign (resid  83 and name hb*) (resid  86 and name hb*)  3.95  2.05  3.35
assign (resid  89 and name ha) (resid  92 and name hb*)  3.45  1.55  2.25
assign (resid  10 and name hd2) (resid  10 and name he1)  4.95  3.05  3.05
assign (resid  36 and name hd*) (resid  36 and name he*)  4.45  2.55 10.55
assign (resid  46 and name he2) (resid  46 and name hd1)  4.95  3.05  3.05
assign (resid  63 and name ha) (resid  62 and name hb*)  3.45  1.55  2.25
assign (resid  59 and name hz2) (resid  40 and name hg2*)  3.95  2.05  2.65
assign (resid   4 and name ha) (resid   3 and name hg1*)  3.95  2.05  2.65
assign (resid   3 and name hb) (resid   2 and name hb*)  3.45  1.55  2.25 
assign (resid  59 and name ha) (resid  36 and name ha)  3.45  1.55  1.55
assign (resid  40 and name hb) (resid  59 and name hh2)  3.45  1.55  1.55
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assign (resid  35 and name hg) (resid  98 and name hb1)  3.45  1.55  1.55
assign (resid  36 and name ha) (resid  36 and name he*)  4.45  2.55  6.55
assign (resid  59 and name ha) (resid  40 and name hg2*)  3.95  2.05  2.65
assign (resid  85 and name hg1*) (resid   9 and name hg2*)  3.95  2.05  3.35
assign (resid  94 and name hb1) (resid  85 and name hd1*)  3.95  2.05  2.65
assign (resid   2 and name hb*) (resid   5 and name ha)  3.45  1.55  2.25
assign (resid  36 and name ha) (resid  60 and name hb2)  3.45  1.55  1.55
assign (resid  58 and name ha) (resid  40 and name hb)  3.45  1.55  1.55
assign (resid  50 and name hb*) (resid  51 and name hb*)  3.95  2.05  3.35
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assign (resid  75 and name hb) (resid  72 and name ha)  3.45  1.55  1.55
assign (resid  95 and name hg1*) (resid  35 and name hd1*)  3.95  2.05  3.35
assign (resid  72 and name hb*) (resid  71 and name hb*)  3.45  1.55  2.95
assign (resid  46 and name hb1) (resid  46 and name he1)  4.45  2.55  2.55
assign (resid  52 and name hb2) (resid  51 and name hb*)  3.95  2.05  2.65
assign (resid  67 and name ha) (resid  59 and name hh2)  3.45  1.55  1.55
assign (resid 103 and name hb*) (resid 102 and name hg2*)  3.95  2.05  3.35
assign (resid   3 and name ha) (resid  97 and name hd2)  4.45  2.55  2.55
assign (resid  78 and name hb) (resid  52 and name hb2)  3.45  1.55  1.55
assign (resid  46 and name hd2) (resid  47 and name hg2*)  4.95  3.05  3.65
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assign (resid 63 and name c) (resid 64 and name n)
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assign (resid 65 and name c) (resid 66 and name n)
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assign (resid 67 and name c) (resid 68 and name n)
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assign (resid 68 and name c) (resid 69 and name n)
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assign (resid 71 and name c) (resid 72 and name n)
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assign (resid 80 and name c) (resid 81 and name n)
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assign (resid 82 and name c) (resid 83 and name n)
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assign (resid 90 and name c) (resid 91 and name n)
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assign (resid 92 and name c) (resid 93 and name n)
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assign (resid 93 and name c) (resid 94 and name n)
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assign (resid 94 and name c) (resid 95 and name n)
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assign (resid 95 and name c) (resid 96 and name n)
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assign (resid 97 and name c) (resid 98 and name n)
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assign (resid 2 and name c) (resid 3 and name n)
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assign (resid 3 and name c) (resid 4 and name n)
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assign (resid 4 and name c) (resid 5 and name n)
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assign (resid 15 and name c) (resid 16 and name n)
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assign (resid 20 and name c) (resid 21 and name n)
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assign (resid 26 and name c) (resid 27 and name n)
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assign (resid 27 and name c) (resid 28 and name n)
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assign (resid 28 and name c) (resid 29 and name n)
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assign (resid 32 and name c) (resid 33 and name n)
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assign (resid 35 and name c) (resid 36 and name n)
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assign (resid 40 and name c) (resid 41 and name n)
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assign (resid 47 and name c) (resid 48 and name n)
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assign (resid 50 and name c) (resid 51 and name n)
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assign (resid 52 and name c) (resid 53 and name n)
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assign (resid 58 and name c) (resid 59 and name n)
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assign (resid 64 and name c) (resid 65 and name n)
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assign (resid 74 and name c) (resid 75 and name n)
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assign (resid 75 and name c) (resid 76 and name n)
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assign (resid 76 and name c) (resid 77 and name n)
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assign (resid 81 and name c) (resid 82 and name n)
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assign (resid 83 and name c) (resid 84 and name n)
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assign (resid 84 and name c) (resid 85 and name n)
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assign (resid 87 and name c) (resid 88 and name n)
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assign (resid 88 and name c) (resid 89 and name n)
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assign (resid 91 and name c) (resid 92 and name n)
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assign (resid 96 and name c) (resid 97 and name n)
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file: oc.wat
assign (resid  19 and name hn) (resid  200 and name OH2) 2.95 1.05 1.05
assign (resid  19 and name ha) (resid  200 and name OH2) 2.95 1.05 1.05
assign (resid  31 and name hb2) (resid  200 and name OH2) 2.95 1.05 1.05
assign (resid  31 and name hb1) (resid  200 and name OH2) 2.95 1.05 1.05
assign (resid  31 and name ha) (resid  200 and name OH2) 2.95 1.05 1.05
assign (resid  49 and name hn) (resid  201 and name OH2) 2.95 1.05 1.05
assign (resid  74 and name he1) (resid  201 and name OH2) 2.95 1.05 1.05
assign (resid  75 and name hb) (resid  201 and name OH2) 2.95 1.05 1.05
assign (resid  75 and name hg2*) (resid  201 and name OH2) 2.95 1.05 1.05
assign (resid  78 and name hb) (resid  201 and name OH2) 2.95 1.05 1.05
assign (resid  53 and name hn) (resid  201 and name OH2) 2.95 1.05 1.05 
assign (resid  70 and name hb*) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  81 and name hd*) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  81 and name hg1*) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  81 and name hg2*) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  83 and name ha) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  83 and name hb*) (resid  202 and name OH2) 2.95 1.05 1.05
assign (resid  42 and name hb*) (resid  203 and name OH2) 2.95 1.05 1.05
assign (resid  42 and name hg*) (resid  203 and name OH2) 2.95 1.05 1.05
assign (resid  44 and name ha) (resid  203 and name OH2) 2.95 1.05 1.05
assign (resid  44 and name hd*) (resid  203 and name OH2) 2.95 1.05 1.05
assign (resid  46 and name hn) (resid  203 and name OH2) 2.95 1.05 1.05 
assign (resid  57 and name hb) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  57 and name hd1*) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  57 and name hg1*) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  57 and name hg2*) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  59 and name hh2) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  59 and name hz2) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  59 and name he3) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  63 and name ha) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  63 and name hg2*) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  74 and name hd1) (resid  204 and name OH2) 2.95 1.05 1.05
assign (resid  35 and name hd*) (resid  205 and name OH2) 2.95 1.05 1.05
assign (resid  35 and name hg) (resid  205 and name OH2) 2.95 1.05 1.05
assign (resid  36 and name he*) (resid  205 and name OH2) 2.95 1.05 1.05
assign (resid  36 and name hz) (resid  205 and name OH2) 2.95 1.05 1.05
assign (resid  97 and name hd1) (resid  205 and name OH2) 2.95 1.05 1.05
assign (resid  97 and name he1) (resid  205 and name OH2) 2.95 1.05 1.05 
file: oc.hbond
assign  (resid  3  and  name  o)  (resid  7  and  name  hn)  2.0  0.25  0.4
assign  (resid  4  and  name  o)  (resid  8  and  name  hn)  2.0  0.25  0.4
assign  (resid  5  and  name  o)  (resid  9  and  name  hn)  2.0  0.25  0.4
assign  (resid  6  and  name  o)  (resid  10  and  name  hn)  2.0  0.25  0.4
assign  (resid  7  and  name  o)  (resid  11  and  name  hn)  2.0  0.25  0.4
assign  (resid  8  and  name  o)  (resid  12  and  name  hn)  2.0  0.25  0.4
assign  (resid  9  and  name  o)  (resid  13  and  name  hn)  2.0  0.25  0.4
assign  (resid  10  and  name  o)  (resid  14  and  name  hn)  2.0  0.25  0.4
assign  (resid  14  and  name  o)  (resid  18  and  name  hn)  2.0  0.25  0.4
assign  (resid  19  and  name  o)  (resid  32  and  name  hn)  2.0  0.25  0.4
assign  (resid  32  and  name  o)  (resid  35  and  name  hn)  2.0  0.25  0.4
assign  (resid  43  and  name  o)  (resid  46  and  name  hn)  2.0  0.25  0.4
assign  (resid  51  and  name  o)  (resid  55  and  name  hn)  2.0  0.25  0.4
assign  (resid  60  and  name  o)  (resid  64  and  name  hn)  2.0  0.25  0.4
assign  (resid  61  and  name  o)  (resid  64  and  name  hn)  2.0  0.25  0.4
assign  (resid  61  and  name  o)  (resid  65  and  name  hn)  2.0  0.25  0.4
assign  (resid  62  and  name  o)  (resid  66  and  name  hn)  2.0  0.25  0.4
assign  (resid  63  and  name  o)  (resid  67  and  name  hn)  2.0  0.25  0.4
assign  (resid  64  and  name  o)  (resid  67  and  name  hn)  2.0  0.25  0.4
assign  (resid  64  and  name  o)  (resid  68  and  name  hn)  2.0  0.25  0.4
assign  (resid  66  and  name  o)  (resid  69  and  name  hn)  2.0  0.25  0.4
assign  (resid  67  and  name  o)  (resid  70  and  name  hn)  2.0  0.25  0.4
assign  (resid  70  and  name  o)  (resid  73  and  name  hn)  2.0  0.25  0.4
assign  (resid  71  and  name  o)  (resid  74  and  name  hn)  2.0  0.25  0.4
assign  (resid  72  and  name  o)  (resid  75  and  name  hn)  2.0  0.25  0.4
assign  (resid  75  and  name  o)  (resid  78  and  name  hn)  2.0  0.25  0.4
assign  (resid  88  and  name  o)  (resid  91  and  name  hn)  2.0  0.25  0.4
assign  (resid  88  and  name  o)  (resid  92  and  name  hn)  2.0  0.25  0.4
assign  (resid  89  and  name  o)  (resid  92  and  name  hn)  2.0  0.25  0.4
assign  (resid  89  and  name  o)  (resid  93  and  name  hn)  2.0  0.25  0.4
assign  (resid  90  and  name  o)  (resid  93  and  name  hn)  2.0  0.25  0.4
assign  (resid  90  and  name  o)  (resid  94  and  name  hn)  2.0  0.25  0.4
assign  (resid  91  and  name  o)  (resid  94  and  name  hn)  2.0  0.25  0.4
assign  (resid  91  and  name  o)  (resid  95  and  name  hn)  2.0  0.25  0.4
assign  (resid  92  and  name  o)  (resid  95  and  name  hn)  2.0  0.25  0.4
assign  (resid  92  and  name  o)  (resid  96  and  name  hn)  2.0  0.25  0.4
assign  (resid  93  and  name  o)  (resid  97  and  name  hn)  2.0  0.25  0.4
assign  (resid  94  and  name  o)  (resid  98  and  name  hn)  2.0  0.25  0.4
assign  (resid  95  and  name  o)  (resid  99  and  name  hn)  2.0  0.25  0.4
assign  (resid  96  and  name  o)  (resid  99  and  name  hn)  2.0  0.25  0.4
assign  (resid  97  and  name  o)  (resid  100  and  name  hn)  2.0  0.25  0.4
assign  (resid  97  and  name  o)  (resid  101  and  name  hn)  2.0  0.25  0.4
assign  (resid  98  and  name  o)  (resid  102  and  name  hn)  2.0  0.25  0.4
assign  (resid  100  and  name  o)  (resid  103  and  name  hn)  2.0  0.25  0.4
assign  (resid  101  and  name  o)  (resid  104  and  name  hn)  2.0  0.25  0.4
assign  (resid  105  and  name  o*d)  (resid  49  and  name  hn)  2.0  0.25  1
assign  (resid  105  and  name  o2a)  (resid  52  and  name  hd2*)  2.0  0.25  1
assign  (resid  105  and  name  o1a)  (resid  59  and  name  he1)  2.0  0.25  0.4
assign  (resid  105  and  name  o*d)  (resid  79  and  name  hn)  2.0  0.25  1

  Entry H atom name         Submitted Coord H atom name
    1   1H    GLY   1           HT3      GLY   1 -12.404  -4.733  -8.946
    2   2H    GLY   1           HT2      GLY   1 -11.555  -6.023  -8.237
    3   3H    GLY   1           HT1      GLY   1 -13.247  -5.942  -8.107
    4   1HA   GLY   1           HA1      GLY   1 -12.517  -5.222  -6.036
    5   2HA   GLY   1           HA2      GLY   1 -11.210  -4.283  -6.758
    6    H    ASP   2           HN       ASP   2 -11.644  -2.139  -6.552
    7    HA   ASP   2           HA       ASP   2 -14.128  -1.039  -7.611
    8   1HB   ASP   2           HB2      ASP   2 -13.720  -1.384  -4.687
    9   2HB   ASP   2           HB1      ASP   2 -14.335   0.185  -5.209
   10    H    VAL   3           HN       VAL   3 -14.056   1.350  -7.617
   11    HA   VAL   3           HA       VAL   3 -11.237   2.327  -7.485
   12    HB   VAL   3           HB       VAL   3 -13.619   3.302  -9.087
   13   1HG1  VAL   3          HG11      VAL   3 -12.190   5.172  -8.276
   14   2HG1  VAL   3          HG13      VAL   3 -10.786   4.384  -8.996
   15   3HG1  VAL   3          HG12      VAL   3 -12.092   4.971 -10.026
   16   1HG2  VAL   3          HG21      VAL   3 -11.019   1.908  -9.767
   17   2HG2  VAL   3          HG22      VAL   3 -12.661   1.358 -10.103
   18   3HG2  VAL   3          HG23      VAL   3 -11.995   2.734 -10.982
   19    H    GLU   4           HN       GLU   4 -14.471   3.860  -7.271
   20    HA   GLU   4           HA       GLU   4 -13.599   5.948  -5.527
   21   1HB   GLU   4           HB2      GLU   4 -16.167   4.918  -6.536
   22   2HB   GLU   4           HB1      GLU   4 -16.272   5.659  -4.939
   23   1HG   GLU   4           HG2      GLU   4 -15.046   7.650  -5.844
   24   2HG   GLU   4           HG1      GLU   4 -15.133   6.921  -7.448
   25    H    LYS   5           HN       LYS   5 -14.654   2.659  -4.926
   26    HA   LYS   5           HA       LYS   5 -15.191   2.936  -2.124
   27   1HB   LYS   5           HB2      LYS   5 -15.464   0.901  -3.891
   28   2HB   LYS   5           HB1      LYS   5 -13.981   0.396  -3.082
   29   1HG   LYS   5           HG2      LYS   5 -15.458  -0.523  -1.590
   30   2HG   LYS   5           HG1      LYS   5 -15.444   1.111  -0.925
   31   1HD   LYS   5           HD1      LYS   5 -17.407   1.684  -2.326
   32   2HD   LYS   5           HD2      LYS   5 -17.431   0.034  -2.951
   33   1HE   LYS   5           HE2      LYS   5 -18.141  -0.865  -0.924
   34   2HE   LYS   5           HE1      LYS   5 -17.473   0.467   0.018
   35   1HZ   LYS   5           HZ1      LYS   5 -19.406   1.463  -1.766
   36   2HZ   LYS   5           HZ2      LYS   5 -20.081   0.168  -0.899
   37   3HZ   LYS   5           HZ3      LYS   5 -19.415   1.492  -0.068
   38    H    GLY   6           HN       GLY   6 -12.326   1.380  -3.600
   39   1HA   GLY   6           HA1      GLY   6 -10.728   1.653  -1.236
   40   2HA   GLY   6           HA2      GLY   6 -10.103   1.278  -2.841
   41    H    LYS   7           HN       LYS   7 -11.756   3.939  -3.515
   42    HA   LYS   7           HA       LYS   7  -9.412   5.655  -3.469
   43   1HB   LYS   7           HB2      LYS   7 -11.137   5.839  -5.252
   44   2HB   LYS   7           HB1      LYS   7 -12.314   6.349  -4.040
   45   1HG   LYS   7           HG1      LYS   7 -10.716   8.241  -3.456
   46   2HG   LYS   7           HG2      LYS   7  -9.804   7.804  -4.901
   47   1HD   LYS   7           HD1      LYS   7 -11.883   8.101  -6.253
   48   2HD   LYS   7           HD2      LYS   7 -12.718   8.645  -4.797
   49   1HE   LYS   7           HE2      LYS   7 -10.821  10.385  -4.586
   50   2HE   LYS   7           HE1      LYS   7 -10.437   9.980  -6.259
   51   1HZ   LYS   7           HZ1      LYS   7 -12.761  10.484  -6.831
   52   2HZ   LYS   7           HZ3      LYS   7 -13.036  10.984  -5.232
   53   3HZ   LYS   7           HZ2      LYS   7 -11.937  11.832  -6.210
   54    H    LYS   8           HN       LYS   8 -12.279   5.189  -1.537
   55    HA   LYS   8           HA       LYS   8 -11.643   7.502   0.180
   56   1HB   LYS   8           HB2      LYS   8 -14.013   6.294  -0.524
   57   2HB   LYS   8           HB1      LYS   8 -13.705   5.615   1.074
   58   1HG   LYS   8           HG2      LYS   8 -13.896   7.648   2.134
   59   2HG   LYS   8           HG1      LYS   8 -13.280   8.544   0.745
   60   1HD   LYS   8           HD1      LYS   8 -15.416   8.118  -0.451
   61   2HD   LYS   8           HD2      LYS   8 -16.030   7.283   0.976
   62   1HE   LYS   8           HE1      LYS   8 -15.414   9.488   2.232
   63   2HE   LYS   8           HE2      LYS   8 -15.409  10.209   0.622
   64   1HZ   LYS   8           HZ1      LYS   8 -17.677   8.957   0.445
   65   2HZ   LYS   8           HZ2      LYS   8 -17.638   9.060   2.140
   66   3HZ   LYS   8           HZ3      LYS   8 -17.584  10.475   1.202
   67    H    ILE   9           HN       ILE   9 -11.430   3.984   0.126
   68    HA   ILE   9           HA       ILE   9 -10.778   3.638   2.926
   69    HB   ILE   9           HB       ILE   9  -9.813   1.927   0.626
   70   1HG1  ILE   9          HG11      ILE   9 -12.346   2.469   0.646
   71   2HG1  ILE   9          HG12      ILE   9 -11.880   0.760   0.604
   72   1HG2  ILE   9          HG21      ILE   9  -9.723   1.759   3.519
   73   2HG2  ILE   9          HG23      ILE   9 -10.576   0.375   2.836
   74   3HG2  ILE   9          HG22      ILE   9  -8.930   0.740   2.318
   75   1HD1  ILE   9           HD1      ILE   9 -12.017   1.670   3.346
   76   2HD1  ILE   9           HD3      ILE   9 -13.524   2.060   2.518
   77   3HD1  ILE   9           HD2      ILE   9 -12.945   0.395   2.558
   78    H    PHE  10           HN       PHE  10  -8.985   4.428   0.043
   79    HA   PHE  10           HA       PHE  10  -6.380   4.083   1.284
   80   1HB   PHE  10           HB2      PHE  10  -6.768   3.780  -1.164
   81   2HB   PHE  10           HB1      PHE  10  -7.124   5.500  -1.289
   82    HD1  PHE  10           HD1      PHE  10  -4.482   3.101  -0.189
   83    HD2  PHE  10           HD2      PHE  10  -5.390   7.065  -1.550
   84    HE1  PHE  10           HE1      PHE  10  -2.063   3.595  -0.363
   85    HE2  PHE  10           HE2      PHE  10  -2.974   7.577  -1.692
   86    HZ   PHE  10           HZ       PHE  10  -1.320   5.863  -1.102
   87    H    VAL  11           HN       VAL  11  -8.173   6.924   0.051
   88    HA   VAL  11           HA       VAL  11  -6.336   8.817   1.180
   89    HB   VAL  11           HB       VAL  11  -9.226   9.396   0.540
   90   1HG1  VAL  11          HG13      VAL  11  -7.374  11.048   1.518
   91   2HG1  VAL  11          HG12      VAL  11  -6.901  11.131  -0.179
   92   3HG1  VAL  11          HG11      VAL  11  -8.534  11.588   0.304
   93   1HG2  VAL  11          HG21      VAL  11  -7.447   8.112  -1.198
   94   2HG2  VAL  11          HG22      VAL  11  -8.905   8.987  -1.662
   95   3HG2  VAL  11          HG23      VAL  11  -7.348   9.812  -1.654
   96    H    GLN  12           HN       GLN  12  -8.553   6.837   2.721
   97    HA   GLN  12           HA       GLN  12  -9.082   8.832   4.863
   98   1HB   GLN  12           HB2      GLN  12 -10.740   7.301   5.676
   99   2HB   GLN  12           HB1      GLN  12 -10.933   7.374   3.925
  100   1HG   GLN  12           HG1      GLN  12  -9.631   5.316   3.673
  101   2HG   GLN  12           HG2      GLN  12  -9.343   5.264   5.408
  102   1HE2  GLN  12          HE22      GLN  12 -12.409   3.670   6.080
  103   2HE2  GLN  12          HE21      GLN  12 -10.869   4.122   6.633
  104    H    LYS  13           HN       LYS  13  -7.498   5.708   4.297
  105    HA   LYS  13           HA       LYS  13  -6.492   5.802   7.103
  106   1HB   LYS  13           HB2      LYS  13  -6.939   3.580   5.135
  107   2HB   LYS  13           HB1      LYS  13  -5.796   3.363   6.459
  108   1HG   LYS  13           HG2      LYS  13  -8.735   4.072   6.699
  109   2HG   LYS  13           HG1      LYS  13  -7.971   2.559   7.183
  110   1HD   LYS  13           HD2      LYS  13  -7.678   3.472   9.225
  111   2HD   LYS  13           HD1      LYS  13  -6.494   4.551   8.490
  112   1HE   LYS  13           HE1      LYS  13  -7.851   6.295   8.912
  113   2HE   LYS  13           HE2      LYS  13  -9.073   5.578   7.862
  114   1HZ   LYS  13           HZ2      LYS  13  -8.939   4.287  10.406
  115   2HZ   LYS  13           HZ3      LYS  13  -9.279   5.944  10.558
  116   3HZ   LYS  13           HZ1      LYS  13 -10.278   4.957   9.603
  117    H    CYS  14           HN       CYS  14  -5.225   4.888   3.843
  118    HA   CYS  14           HA       CYS  14  -2.517   5.565   4.894
  119   1HB   CYS  14           HB2      CYS  14  -2.595   4.491   2.172
  120   2HB   CYS  14           HB1      CYS  14  -1.672   3.942   3.566
  121    H    ALA  15           HN       ALA  15  -4.232   7.746   4.304
  122    HA   ALA  15           HA       ALA  15  -3.379   8.717   1.644
  123   1HB   ALA  15           HB3      ALA  15  -5.647   9.148   3.165
  124   2HB   ALA  15           HB2      ALA  15  -4.731  10.632   3.419
  125   3HB   ALA  15           HB1      ALA  15  -5.154  10.126   1.784
  126    H    GLN  16           HN       GLN  16  -2.733   9.335   5.082
  127    HA   GLN  16           HA       GLN  16  -0.990  11.599   4.429
  128   1HB   GLN  16           HB1      GLN  16  -2.302  11.606   6.532
  129   2HB   GLN  16           HB2      GLN  16  -1.369  10.196   7.080
  130   1HG   GLN  16           HG1      GLN  16   0.688  11.449   7.072
  131   2HG   GLN  16           HG2      GLN  16  -0.072  12.810   6.222
  132   1HE2  GLN  16          HE22      GLN  16  -0.026  13.817   9.776
  133   2HE2  GLN  16          HE21      GLN  16   1.096  13.602   8.521
  134    H    CYS  17           HN       CYS  17  -0.615   8.325   4.257
  135    HA   CYS  17           HA       CYS  17   2.327   8.645   4.635
  136   1HB   CYS  17           HB2      CYS  17   0.565   7.042   6.140
  137   2HB   CYS  17           HB1      CYS  17   1.468   5.947   5.097
  138    H    HIS  18           HN       LIG  18  -0.222   7.748   2.586
  139    HA   HIS  18           HA       LIG  18   1.740   6.575   0.721
  140   1HB   HIS  18           HB2      LIG  18  -0.837   5.341   1.647
  141   2HB   HIS  18           HB1      LIG  18  -0.232   5.001   0.036
  142    HD1  HIS  18           HD1      LIG  18   2.279   3.958  -0.053
  143    HD2  HIS  18           HD2      LIG  18   0.392   3.871   3.657
  144    HE1  HIS  18           HE1      LIG  18   3.534   2.263   1.343
  145    H    THR  19           HN       THR  19   1.730   8.163  -0.797
  146    HA   THR  19           HA       THR  19  -0.835   9.426  -1.551
  147    HB   THR  19           HB       THR  19   0.805  10.863  -2.966
  148    HG1  THR  19           HG1      THR  19   2.685   9.888  -2.917
  149   1HG2  THR  19          HG23      THR  19  -0.316  11.434  -0.729
  150   2HG2  THR  19          HG21      THR  19   1.219  10.991   0.018
  151   3HG2  THR  19          HG22      THR  19   1.151  12.326  -1.132
  152    H    VAL  20           HN       VAL  20  -1.807   9.077  -3.496
  153    HA   VAL  20           HA       VAL  20  -0.271   7.650  -5.612
  154    HB   VAL  20           HB       VAL  20  -1.493   5.859  -4.628
  155   1HG1  VAL  20          HG12      VAL  20  -3.079   7.741  -3.518
  156   2HG1  VAL  20          HG11      VAL  20  -4.146   7.195  -4.808
  157   3HG1  VAL  20          HG13      VAL  20  -3.545   6.044  -3.616
  158   1HG2  VAL  20          HG21      VAL  20  -2.134   6.816  -7.211
  159   2HG2  VAL  20          HG23      VAL  20  -2.302   5.166  -6.615
  160   3HG2  VAL  20          HG22      VAL  20  -3.656   6.288  -6.497
  161    H    GLU  21           HN       GLU  21  -3.465   9.141  -4.932
  162    HA   GLU  21           HA       GLU  21  -3.548  10.142  -7.713
  163   1HB   GLU  21           HB2      GLU  21  -5.489   9.664  -5.565
  164   2HB   GLU  21           HB1      GLU  21  -5.748  11.193  -6.406
  165   1HG   GLU  21           HG2      GLU  21  -5.234   9.509  -8.503
  166   2HG   GLU  21           HG1      GLU  21  -6.072   8.430  -7.388
  167    H    LYS  22           HN       LYS  22  -2.414  11.189  -4.702
  168    HA   LYS  22           HA       LYS  22  -2.951  14.046  -5.168
  169   1HB   LYS  22           HB2      LYS  22  -1.919  12.383  -2.970
  170   2HB   LYS  22           HB1      LYS  22  -1.080  13.925  -3.148
  171   1HG   LYS  22           HG2      LYS  22  -3.828  14.491  -3.481
  172   2HG   LYS  22           HG1      LYS  22  -3.716  13.417  -2.087
  173   1HD   LYS  22           HD2      LYS  22  -2.663  14.983  -0.819
  174   2HD   LYS  22           HD1      LYS  22  -1.645  15.512  -2.159
  175   1HE   LYS  22           HE1      LYS  22  -3.085  17.172  -2.756
  176   2HE   LYS  22           HE2      LYS  22  -4.507  16.173  -2.458
  177   1HZ   LYS  22           HZ2      LYS  22  -2.853  17.244  -0.252
  178   2HZ   LYS  22           HZ1      LYS  22  -4.139  18.130  -0.921
  179   3HZ   LYS  22           HZ3      LYS  22  -4.435  16.630  -0.181
  180    H    GLY  23           HN       GLY  23  -0.229  11.782  -5.375
  181   1HA   GLY  23           HA2      GLY  23   1.094  13.252  -7.421
  182   2HA   GLY  23           HA1      GLY  23   1.824  13.688  -5.876
  183    H    GLY  24           HN       GLY  24   1.766  11.292  -4.505
  184   1HA   GLY  24           HA1      GLY  24   2.496   8.977  -4.651
  185   2HA   GLY  24           HA2      GLY  24   3.084   9.304  -6.276
  186    H    LYS  25           HN       LYS  25   3.744  11.579  -3.716
  187    HA   LYS  25           HA       LYS  25   6.639  11.069  -4.046
  188   1HB   LYS  25           HB2      LYS  25   5.067  13.195  -2.556
  189   2HB   LYS  25           HB1      LYS  25   6.829  13.096  -2.532
  190   1HG   LYS  25           HG2      LYS  25   6.668  13.091  -5.118
  191   2HG   LYS  25           HG1      LYS  25   5.016  13.661  -4.879
  192   1HD   LYS  25           HD2      LYS  25   5.696  15.701  -4.044
  193   2HD   LYS  25           HD1      LYS  25   7.183  15.044  -3.361
  194   1HE   LYS  25           HE2      LYS  25   8.245  15.923  -5.151
  195   2HE   LYS  25           HE1      LYS  25   7.478  14.654  -6.106
  196   1HZ   LYS  25           HZ3      LYS  25   5.878  17.017  -5.514
  197   2HZ   LYS  25           HZ2      LYS  25   7.146  17.213  -6.625
  198   3HZ   LYS  25           HZ1      LYS  25   5.931  16.064  -6.918
  199    H    HIS  26           HN       HIS  26   7.917  11.284  -1.859
  200    HA   HIS  26           HA       HIS  26   6.829   9.215  -0.049
  201   1HB   HIS  26           HB2      HIS  26   9.425  10.650   0.469
  202   2HB   HIS  26           HB1      HIS  26   8.999   8.955   0.778
  203    HD1  HIS  26           HD1      HIS  26   9.115   7.308  -1.249
  204    HD2  HIS  26           HD2      HIS  26  10.413  11.168  -2.129
  205    HE1  HIS  26           HE1      HIS  26  10.327   7.164  -3.474
  206    H    LYS  27           HN       LYS  27   5.135  11.181   0.207
  207    HA   LYS  27           HA       LYS  27   5.781  13.431   1.792
  208   1HB   LYS  27           HB2      LYS  27   3.530  12.645   0.587
  209   2HB   LYS  27           HB1      LYS  27   3.146  12.081   2.214
  210   1HG   LYS  27           HG2      LYS  27   2.909  14.191   3.021
  211   2HG   LYS  27           HG1      LYS  27   4.303  14.790   2.122
  212   1HD   LYS  27           HD2      LYS  27   2.845  14.639   0.029
  213   2HD   LYS  27           HD1      LYS  27   1.477  14.392   1.114
  214   1HE   LYS  27           HE2      LYS  27   1.988  16.528   2.244
  215   2HE   LYS  27           HE1      LYS  27   3.357  16.775   1.159
  216   1HZ   LYS  27           HZ2      LYS  27   1.530  16.414  -0.649
  217   2HZ   LYS  27           HZ3      LYS  27   0.483  16.910   0.592
  218   3HZ   LYS  27           HZ1      LYS  27   1.736  17.935   0.078
  219    H    THR  28           HN       THR  28   3.678  12.697   3.974
  220    HA   THR  28           HA       THR  28   5.500  12.057   6.040
  221    HB   THR  28           HB       THR  28   2.542  12.042   5.727
  222    HG1  THR  28           HG1      THR  28   3.199  13.796   6.699
  223   1HG2  THR  28          HG22      THR  28   3.946  10.463   7.905
  224   2HG2  THR  28          HG21      THR  28   2.258  10.969   7.988
  225   3HG2  THR  28          HG23      THR  28   2.781   9.844   6.735
  226    H    GLY  29           HN       GLY  29   4.027  10.096   3.609
  227   1HA   GLY  29           HA1      GLY  29   5.504   7.753   4.668
  228   2HA   GLY  29           HA2      GLY  29   3.776   7.556   4.331
  229    HA   PRO  30           HA       PRO  30   6.490   6.882   0.503
  230   1HB   PRO  30           HB2      PRO  30   5.879   4.116   0.451
  231   2HB   PRO  30           HB1      PRO  30   7.419   4.857   0.898
  232   1HG   PRO  30           HG2      PRO  30   5.503   3.540   2.639
  233   2HG   PRO  30           HG1      PRO  30   7.094   4.190   3.055
  234   1HD   PRO  30           HD2      PRO  30   4.501   5.300   3.664
  235   2HD   PRO  30           HD1      PRO  30   6.099   5.919   4.129
  236    H    ASN  31           HN       ASN  31   5.477   7.006  -1.493
  237    HA   ASN  31           HA       ASN  31   2.602   6.851  -1.678
  238   1HB   ASN  31           HB2      ASN  31   2.947   7.263  -4.091
  239   2HB   ASN  31           HB1      ASN  31   3.853   8.406  -3.085
  240   1HD2  ASN  31          HD22      ASN  31   5.959   6.628  -5.816
  241   2HD2  ASN  31          HD21      ASN  31   4.359   7.190  -5.903
  242    H    LEU  32           HN       LEU  32   1.931   5.591  -3.957
  243    HA   LEU  32           HA       LEU  32   2.774   2.767  -3.446
  244   1HB   LEU  32           HB2      LEU  32   0.135   4.026  -3.996
  245   2HB   LEU  32           HB1      LEU  32   0.436   2.492  -4.795
  246    HG   LEU  32           HG       LEU  32  -0.536   1.794  -2.795
  247   1HD1  LEU  32          HD22      LEU  32   1.898   0.937  -3.127
  248   2HD1  LEU  32          HD21      LEU  32   2.283   1.979  -1.759
  249   3HD1  LEU  32          HD23      LEU  32   1.118   0.671  -1.567
  250   1HD2  LEU  32          HD13      LEU  32  -0.658   4.052  -1.817
  251   2HD2  LEU  32          HD11      LEU  32  -0.134   2.860  -0.628
  252   3HD2  LEU  32          HD12      LEU  32   1.042   3.939  -1.370
  253    H    HIS  33           HN       HIS  33   4.300   4.394  -5.200
  254    HA   HIS  33           HA       HIS  33   3.398   3.917  -7.934
  255   1HB   HIS  33           HB2      HIS  33   4.885   5.840  -7.258
  256   2HB   HIS  33           HB1      HIS  33   6.181   4.672  -7.007
  257    HD1  HIS  33           HD1      HIS  33   7.013   6.477  -9.087
  258    HD2  HIS  33           HD2      HIS  33   4.387   3.373 -10.011
  259    HE1  HIS  33           HE1      HIS  33   7.174   6.124 -11.589
  260    H    GLY  34           HN       GLY  34   4.391   1.824  -5.675
  261   1HA   GLY  34           HA1      GLY  34   5.895   0.125  -7.619
  262   2HA   GLY  34           HA2      GLY  34   6.074   0.004  -5.867
  263    H    LEU  35           HN       LEU  35   2.967   0.538  -5.931
  264    HA   LEU  35           HA       LEU  35   2.060  -2.023  -5.325
  265   1HB   LEU  35           HB2      LEU  35   0.737   0.430  -6.400
  266   2HB   LEU  35           HB1      LEU  35  -0.176  -1.067  -6.431
  267    HG   LEU  35           HG       LEU  35   0.391   0.685  -4.192
  268   1HD1  LEU  35          HD11      LEU  35  -1.823  -0.069  -4.895
  269   2HD1  LEU  35          HD13      LEU  35  -1.358  -1.734  -4.554
  270   3HD1  LEU  35          HD12      LEU  35  -1.485  -0.576  -3.239
  271   1HD2  LEU  35          HD21      LEU  35   2.136  -1.094  -3.735
  272   2HD2  LEU  35          HD23      LEU  35   0.901  -0.919  -2.490
  273   3HD2  LEU  35          HD22      LEU  35   0.807  -2.246  -3.638
  274    H    PHE  36           HN       PHE  36   0.329  -3.175  -6.693
  275    HA   PHE  36           HA       PHE  36   0.801  -4.923  -8.455
  276   1HB   PHE  36           HB2      PHE  36  -0.877  -3.090 -10.014
  277   2HB   PHE  36           HB1      PHE  36  -1.264  -4.674  -9.358
  278    HD1  PHE  36           HD2      PHE  36  -2.129  -4.914  -7.055
  279    HD2  PHE  36           HD1      PHE  36  -1.304  -1.064  -8.759
  280    HE1  PHE  36           HE2      PHE  36  -3.432  -3.827  -5.246
  281    HE2  PHE  36           HE1      PHE  36  -2.613   0.020  -6.947
  282    HZ   PHE  36           HZ       PHE  36  -3.684  -1.377  -5.197
  283    H    GLY  37           HN       GLY  37   3.155  -4.267  -9.024
  284   1HA   GLY  37           HA1      GLY  37   3.160  -3.523 -11.865
  285   2HA   GLY  37           HA2      GLY  37   4.022  -2.403 -10.815
  286    H    ARG  38           HN       ARG  38   4.155  -5.627  -9.687
  287    HA   ARG  38           HA       ARG  38   5.783  -7.323  -9.912
  288   1HB   ARG  38           HB2      ARG  38   5.816  -6.539 -12.383
  289   2HB   ARG  38           HB1      ARG  38   7.262  -5.620 -11.916
  290   1HG   ARG  38           HG2      ARG  38   8.253  -7.744 -11.029
  291   2HG   ARG  38           HG1      ARG  38   6.860  -8.618 -11.668
  292   1HD   ARG  38           HD2      ARG  38   7.639  -8.519 -13.796
  293   2HD   ARG  38           HD1      ARG  38   8.105  -6.826 -13.633
  294    HE   ARG  38           HE       ARG  38  10.273  -7.528 -12.887
  295   1HH1  ARG  38          HH11      ARG  38  10.153  -9.652 -11.103
  296   2HH1  ARG  38          HH12      ARG  38  10.441 -11.087 -12.029
  297   1HH2  ARG  38          HH21      ARG  38   9.742  -9.582 -15.074
  298   2HH2  ARG  38          HH22      ARG  38  10.209 -11.048 -14.277
  299    H    LYS  39           HN       LYS  39   6.990  -3.953  -9.959
  300    HA   LYS  39           HA       LYS  39   9.258  -4.789  -8.248
  301   1HB   LYS  39           HB2      LYS  39   8.685  -2.520 -10.033
  302   2HB   LYS  39           HB1      LYS  39   9.474  -2.061  -8.523
  303   1HG   LYS  39           HG2      LYS  39  11.200  -3.812  -8.930
  304   2HG   LYS  39           HG1      LYS  39  10.440  -4.167 -10.481
  305   1HD   LYS  39           HD1      LYS  39  10.819  -1.815 -11.182
  306   2HD   LYS  39           HD2      LYS  39  11.626  -1.501  -9.646
  307   1HE   LYS  39           HE1      LYS  39  13.496  -2.724 -10.221
  308   2HE   LYS  39           HE2      LYS  39  12.586  -3.826 -11.254
  309   1HZ   LYS  39           HZ1      LYS  39  12.408  -1.235 -12.312
  310   2HZ   LYS  39           HZ3      LYS  39  14.044  -1.572 -12.009
  311   3HZ   LYS  39           HZ2      LYS  39  13.133  -2.608 -12.999
  312    H    THR  40           HN       THR  40   9.297  -4.405  -6.088
  313    HA   THR  40           HA       THR  40   6.940  -3.031  -4.898
  314    HB   THR  40           HB       THR  40   7.208  -4.389  -3.028
  315    HG1  THR  40           HG1      THR  40   9.149  -3.969  -2.231
  316   1HG2  THR  40          HG23      THR  40   7.834  -5.670  -5.545
  317   2HG2  THR  40          HG21      THR  40   8.610  -6.507  -4.214
  318   3HG2  THR  40          HG22      THR  40   6.869  -6.255  -4.211
  319    H    GLY  41           HN       GLY  41  10.446  -3.308  -4.180
  320   1HA   GLY  41           HA1      GLY  41  10.512  -0.812  -2.734
  321   2HA   GLY  41           HA2      GLY  41  11.924  -1.655  -3.370
  322    H    GLN  42           HN       GLN  42   9.358   0.644  -4.206
  323    HA   GLN  42           HA       GLN  42  10.059   1.177  -6.887
  324   1HB   GLN  42           HB2      GLN  42   9.266   3.633  -6.168
  325   2HB   GLN  42           HB1      GLN  42   8.119   2.295  -6.353
  326   1HG   GLN  42           HG2      GLN  42   9.282   2.328  -3.687
  327   2HG   GLN  42           HG1      GLN  42   8.501   3.858  -4.064
  328   1HE2  GLN  42          HE22      GLN  42   6.168   0.842  -3.026
  329   2HE2  GLN  42          HE21      GLN  42   7.805   1.008  -2.611
  330    H    ALA  43           HN       ALA  43  10.633   4.011  -4.979
  331    HA   ALA  43           HA       ALA  43  13.462   4.003  -5.910
  332   1HB   ALA  43           HB1      ALA  43  11.418   5.970  -5.982
  333   2HB   ALA  43           HB2      ALA  43  12.620   6.528  -4.818
  334   3HB   ALA  43           HB3      ALA  43  13.102   6.155  -6.473
  335    HA   PRO  44           HA       PRO  44  13.812   2.832  -1.489
  336   1HB   PRO  44           HB2      PRO  44  16.634   2.550  -2.099
  337   2HB   PRO  44           HB1      PRO  44  15.461   1.301  -1.667
  338   1HG   PRO  44           HG2      PRO  44  16.547   1.880  -4.285
  339   2HG   PRO  44           HG1      PRO  44  15.430   0.587  -3.825
  340   1HD   PRO  44           HD2      PRO  44  14.804   2.869  -5.391
  341   2HD   PRO  44           HD1      PRO  44  13.645   1.708  -4.684
  342    H    GLY  45           HN       GLY  45  15.282   5.363  -3.368
  343   1HA   GLY  45           HA2      GLY  45  16.999   6.583  -1.510
  344   2HA   GLY  45           HA1      GLY  45  16.024   7.484  -2.671
  345    H    PHE  46           HN       PHE  46  13.571   6.151  -1.352
  346    HA   PHE  46           HA       PHE  46  12.889   8.315   0.381
  347   1HB   PHE  46           HB2      PHE  46  11.185   7.011  -0.796
  348   2HB   PHE  46           HB1      PHE  46  11.645   5.559   0.112
  349    HD1  PHE  46           HD2      PHE  46  11.965   8.496   2.125
  350    HD2  PHE  46           HD1      PHE  46   9.084   5.671   0.648
  351    HE1  PHE  46           HE2      PHE  46  10.413   9.116   3.955
  352    HE2  PHE  46           HE1      PHE  46   7.538   6.298   2.478
  353    HZ   PHE  46           HZ       PHE  46   8.199   8.020   4.131
  354    H    THR  47           HN       THR  47  12.063   5.409   2.008
  355    HA   THR  47           HA       THR  47  14.426   5.494   3.768
  356    HB   THR  47           HB       THR  47  12.648   7.257   4.475
  357    HG1  THR  47           HG1      THR  47  13.140   6.815   6.620
  358   1HG2  THR  47          HG21      THR  47  10.822   5.402   4.194
  359   2HG2  THR  47          HG22      THR  47  11.338   4.900   5.804
  360   3HG2  THR  47          HG23      THR  47  10.705   6.526   5.548
  361    H    TYR  48           HN       TYR  48  12.709   3.551   2.014
  362    HA   TYR  48           HA       TYR  48  11.352   1.646   3.492
  363   1HB   TYR  48           HB2      TYR  48  13.402   1.114   1.325
  364   2HB   TYR  48           HB1      TYR  48  12.274  -0.083   1.937
  365    HD1  TYR  48           HD1      TYR  48  10.632   2.990   2.197
  366    HD2  TYR  48           HD2      TYR  48  11.826   0.101  -0.748
  367    HE1  TYR  48           HE1      TYR  48   8.867   3.806   0.672
  368    HE2  TYR  48           HE2      TYR  48  10.054   0.922  -2.269
  369    HH   TYR  48           HH       TYR  48   8.407   3.832  -1.768
  370    H    THR  49           HN       THR  49  12.034  -0.379   4.510
  371    HA   THR  49           HA       THR  49  14.362   0.047   6.237
  372    HB   THR  49           HB       THR  49  12.143  -1.122   6.874
  373    HG1  THR  49           HG1      THR  49  13.536  -1.442   8.415
  374   1HG2  THR  49          HG21      THR  49  12.540  -2.644   4.719
  375   2HG2  THR  49          HG22      THR  49  13.418  -3.634   5.884
  376   3HG2  THR  49          HG23      THR  49  11.713  -3.270   6.144
  377    H    ASP  50           HN       ASP  50  15.189  -2.757   6.311
  378    HA   ASP  50           HA       ASP  50  16.863  -2.725   3.872
  379   1HB   ASP  50           HB2      ASP  50  16.994  -4.031   6.546
  380   2HB   ASP  50           HB1      ASP  50  17.686  -4.934   5.197
  381    H    ALA  51           HN       ALA  51  14.342  -3.150   3.038
  382    HA   ALA  51           HA       ALA  51  14.444  -5.876   2.011
  383   1HB   ALA  51           HB2      ALA  51  12.553  -5.169   4.237
  384   2HB   ALA  51           HB3      ALA  51  12.072  -6.348   3.017
  385   3HB   ALA  51           HB1      ALA  51  13.500  -6.639   4.010
  386    H    ASN  52           HN       ASN  52  11.999  -3.340   2.725
  387    HA   ASN  52           HA       ASN  52  10.681  -3.750   0.169
  388   1HB   ASN  52           HB2      ASN  52   9.271  -2.808   1.812
  389   2HB   ASN  52           HB1      ASN  52  10.491  -1.656   2.313
  390   1HD2  ASN  52          HD22      ASN  52   9.070  -0.753  -1.407
  391   2HD2  ASN  52          HD21      ASN  52   9.756  -2.275  -1.099
  392    H    LYS  53           HN       LYS  53  13.172  -1.765   1.499
  393    HA   LYS  53           HA       LYS  53  13.600   0.287  -0.305
  394   1HB   LYS  53           HB2      LYS  53  15.109  -0.882   1.639
  395   2HB   LYS  53           HB1      LYS  53  16.011  -1.358   0.203
  396   1HG   LYS  53           HG1      LYS  53  16.644   0.777  -0.271
  397   2HG   LYS  53           HG2      LYS  53  15.118   1.462   0.288
  398   1HD   LYS  53           HD1      LYS  53  15.949   1.856   2.357
  399   2HD   LYS  53           HD2      LYS  53  16.651   0.241   2.459
  400   1HE   LYS  53           HE2      LYS  53  18.416   1.177   0.772
  401   2HE   LYS  53           HE1      LYS  53  17.852   2.755   1.320
  402   1HZ   LYS  53           HZ2      LYS  53  18.210   1.836   3.645
  403   2HZ   LYS  53           HZ3      LYS  53  19.112   0.603   2.904
  404   3HZ   LYS  53           HZ1      LYS  53  19.597   2.222   2.745
  405    H    ASN  54           HN       ASN  54  15.125  -2.896  -0.713
  406    HA   ASN  54           HA       ASN  54  14.739  -2.625  -3.664
  407   1HB   ASN  54           HB2      ASN  54  17.073  -2.213  -3.178
  408   2HB   ASN  54           HB1      ASN  54  17.147  -3.625  -2.124
  409   1HD2  ASN  54          HD22      ASN  54  16.867  -4.305  -6.182
  410   2HD2  ASN  54          HD21      ASN  54  16.120  -2.930  -5.526
  411    H    LYS  55           HN       LYS  55  12.969  -3.865  -1.929
  412    HA   LYS  55           HA       LYS  55  13.310  -6.594  -1.374
  413   1HB   LYS  55           HB2      LYS  55  11.202  -4.730  -1.320
  414   2HB   LYS  55           HB1      LYS  55  10.615  -6.072  -2.296
  415   1HG   LYS  55           HG1      LYS  55  12.077  -6.992   0.057
  416   2HG   LYS  55           HG2      LYS  55  10.700  -5.982   0.491
  417   1HD   LYS  55           HD2      LYS  55   9.386  -7.783   0.165
  418   2HD   LYS  55           HD1      LYS  55   9.751  -7.655  -1.555
  419   1HE   LYS  55           HE2      LYS  55  10.258  -9.914  -0.419
  420   2HE   LYS  55           HE1      LYS  55  11.545  -9.208  -1.396
  421   1HZ   LYS  55           HZ1      LYS  55  11.579  -8.294   1.318
  422   2HZ   LYS  55           HZ2      LYS  55  11.754  -9.979   1.203
  423   3HZ   LYS  55           HZ3      LYS  55  12.833  -8.956   0.383
  424    H    GLY  56           HN       GLY  56  11.073  -7.711  -2.857
  425   1HA   GLY  56           HA2      GLY  56  11.703  -7.699  -5.687
  426   2HA   GLY  56           HA1      GLY  56  12.347  -9.124  -4.879
  427    H    ILE  57           HN       ILE  57   9.424  -7.950  -3.481
  428    HA   ILE  57           HA       ILE  57   7.958 -10.292  -4.539
  429    HB   ILE  57           HB       ILE  57   6.218  -9.630  -2.891
  430   1HG1  ILE  57          HG11      ILE  57   7.994  -7.212  -2.677
  431   2HG1  ILE  57          HG12      ILE  57   6.260  -7.280  -2.962
  432   1HG2  ILE  57          HG21      ILE  57   9.013  -9.593  -1.765
  433   2HG2  ILE  57          HG22      ILE  57   7.547  -9.798  -0.807
  434   3HG2  ILE  57          HG23      ILE  57   7.989 -11.008  -2.012
  435   1HD1  ILE  57           HD2      ILE  57   6.659  -8.546  -0.500
  436   2HD1  ILE  57           HD3      ILE  57   7.693  -7.114  -0.472
  437   3HD1  ILE  57           HD1      ILE  57   5.969  -6.953  -0.807
  438    H    THR  58           HN       THR  58   5.364  -8.894  -4.295
  439    HA   THR  58           HA       THR  58   5.516  -6.806  -6.374
  440    HB   THR  58           HB       THR  58   3.377  -8.891  -6.655
  441    HG1  THR  58           HG1      THR  58   4.698 -10.207  -7.777
  442   1HG2  THR  58          HG22      THR  58   4.564  -6.682  -8.196
  443   2HG2  THR  58          HG21      THR  58   4.281  -8.142  -9.145
  444   3HG2  THR  58          HG23      THR  58   2.944  -7.374  -8.288
  445    H    TRP  59           HN       TRP  59   2.716  -6.488  -6.641
  446    HA   TRP  59           HA       TRP  59   1.773  -6.275  -3.868
  447   1HB   TRP  59           HB2      TRP  59   2.268  -3.930  -5.674
  448   2HB   TRP  59           HB1      TRP  59   1.172  -3.845  -4.283
  449    HD1  TRP  59           HD1      TRP  59   4.493  -2.881  -4.923
  450    HE1  TRP  59           HE1      TRP  59   6.038  -3.165  -2.878
  451    HE3  TRP  59           HE3      TRP  59   1.610  -5.951  -2.074
  452    HZ2  TRP  59           HZ2      TRP  59   6.032  -4.574  -0.353
  453    HZ3  TRP  59           HZ3      TRP  59   2.387  -6.742   0.129
  454    HH2  TRP  59           HH2      TRP  59   4.583  -6.054   0.990
  455    H    LYS  60           HN       LYS  60   0.656  -7.982  -5.600
  456    HA   LYS  60           HA       LYS  60  -1.754  -6.694  -6.729
  457   1HB   LYS  60           HB2      LYS  60  -0.498  -8.643  -7.863
  458   2HB   LYS  60           HB1      LYS  60  -1.210  -9.670  -6.602
  459   1HG   LYS  60           HG1      LYS  60  -3.098  -9.777  -7.821
  460   2HG   LYS  60           HG2      LYS  60  -3.299  -8.037  -7.610
  461   1HD   LYS  60           HD2      LYS  60  -2.041  -7.575  -9.614
  462   2HD   LYS  60           HD1      LYS  60  -1.549  -9.262  -9.759
  463   1HE   LYS  60           HE2      LYS  60  -4.105  -9.758  -9.850
  464   2HE   LYS  60           HE1      LYS  60  -4.265  -8.042 -10.228
  465   1HZ   LYS  60           HZ3      LYS  60  -2.216  -9.413 -11.729
  466   2HZ   LYS  60           HZ2      LYS  60  -3.790  -9.970 -12.038
  467   3HZ   LYS  60           HZ1      LYS  60  -3.412  -8.329 -12.259
  468    H    GLU  61           HN       GLU  61  -2.979  -9.531  -5.766
  469    HA   GLU  61           HA       GLU  61  -4.110  -8.319  -3.355
  470   1HB   GLU  61           HB2      GLU  61  -5.196 -10.675  -3.196
  471   2HB   GLU  61           HB1      GLU  61  -5.749  -9.536  -4.422
  472   1HG   GLU  61           HG2      GLU  61  -4.914 -10.776  -6.146
  473   2HG   GLU  61           HG1      GLU  61  -3.475 -11.246  -5.240
  474    H    GLU  62           HN       GLU  62  -3.165 -11.742  -3.468
  475    HA   GLU  62           HA       GLU  62  -2.541 -12.195  -0.888
  476   1HB   GLU  62           HB2      GLU  62  -2.121 -13.740  -2.905
  477   2HB   GLU  62           HB1      GLU  62  -0.504 -13.033  -2.942
  478   1HG   GLU  62           HG1      GLU  62  -0.152 -13.689  -0.594
  479   2HG   GLU  62           HG2      GLU  62  -1.773 -14.382  -0.539
  480    H    THR  63           HN       THR  63  -0.382 -10.419  -3.073
  481    HA   THR  63           HA       THR  63   1.668 -10.047  -1.066
  482    HB   THR  63           HB       THR  63   2.034  -7.984  -2.847
  483    HG1  THR  63           HG1      THR  63   0.973 -10.127  -4.338
  484   1HG2  THR  63          HG21      THR  63   3.590  -9.849  -2.192
  485   2HG2  THR  63          HG23      THR  63   2.769 -10.869  -3.373
  486   3HG2  THR  63          HG22      THR  63   3.640  -9.432  -3.903
  487    H    LEU  64           HN       LEU  64  -0.940  -7.947  -2.397
  488    HA   LEU  64           HA       LEU  64  -0.401  -6.057  -0.224
  489   1HB   LEU  64           HB2      LEU  64  -2.591  -6.108  -2.318
  490   2HB   LEU  64           HB1      LEU  64  -2.411  -4.829  -1.101
  491    HG   LEU  64           HG       LEU  64  -0.255  -5.626  -3.082
  492   1HD1  LEU  64          HD22      LEU  64  -2.208  -3.310  -3.057
  493   2HD1  LEU  64          HD23      LEU  64  -0.784  -3.395  -4.094
  494   3HD1  LEU  64          HD21      LEU  64  -2.076  -4.578  -4.277
  495   1HD2  LEU  64          HD12      LEU  64  -0.503  -3.301  -1.150
  496   2HD2  LEU  64          HD13      LEU  64   0.582  -4.678  -0.963
  497   3HD2  LEU  64          HD11      LEU  64   0.817  -3.545  -2.293
  498    H    MET  65           HN       MET  65  -3.375  -7.768  -1.208
  499    HA   MET  65           HA       MET  65  -5.020  -7.630   0.906
  500   1HB   MET  65           HB2      MET  65  -4.890  -9.366  -1.133
  501   2HB   MET  65           HB1      MET  65  -4.383 -10.444   0.168
  502   1HG   MET  65           HG2      MET  65  -6.402 -10.157   1.356
  503   2HG   MET  65           HG1      MET  65  -6.819  -8.692   0.468
  504   1HE   MET  65           HE1      MET  65  -7.646 -11.913   1.205
  505   2HE   MET  65           HE2      MET  65  -8.187 -12.807  -0.215
  506   3HE   MET  65           HE3      MET  65  -6.467 -12.696   0.154
  507    H    GLU  66           HN       GLU  66  -1.922  -9.380   0.960
  508    HA   GLU  66           HA       GLU  66  -2.324 -10.379   3.674
  509   1HB   GLU  66           HB2      GLU  66   0.046 -10.209   1.794
  510   2HB   GLU  66           HB1      GLU  66   0.214 -10.766   3.467
  511   1HG   GLU  66           HG2      GLU  66  -1.874 -11.970   1.653
  512   2HG   GLU  66           HG1      GLU  66  -0.197 -12.553   1.620
  513    H    TYR  67           HN       TYR  67   0.037  -8.103   2.262
  514    HA   TYR  67           HA       TYR  67   1.036  -6.844   4.481
  515   1HB   TYR  67           HB2      TYR  67   1.450  -6.358   2.018
  516   2HB   TYR  67           HB1      TYR  67   0.028  -5.321   2.074
  517    HD1  TYR  67           HD2      TYR  67   0.141  -3.805   4.485
  518    HD2  TYR  67           HD1      TYR  67   3.409  -5.190   2.091
  519    HE1  TYR  67           HE2      TYR  67   1.582  -2.014   5.414
  520    HE2  TYR  67           HE1      TYR  67   4.842  -3.393   2.995
  521    HH   TYR  67           HH       TYR  67   4.982  -2.022   4.980
  522    H    LEU  68           HN       LEU  68  -1.718  -5.435   2.729
  523    HA   LEU  68           HA       LEU  68  -2.617  -3.490   4.335
  524   1HB   LEU  68           HB2      LEU  68  -3.783  -5.054   2.375
  525   2HB   LEU  68           HB1      LEU  68  -4.867  -5.263   3.766
  526    HG   LEU  68           HG       LEU  68  -4.022  -2.662   2.452
  527   1HD1  LEU  68          HD21      LEU  68  -5.941  -3.999   1.506
  528   2HD1  LEU  68          HD23      LEU  68  -6.764  -3.799   3.053
  529   3HD1  LEU  68          HD22      LEU  68  -6.388  -2.388   2.065
  530   1HD2  LEU  68          HD11      LEU  68  -5.449  -3.137   5.081
  531   2HD2  LEU  68          HD13      LEU  68  -3.918  -2.297   4.844
  532   3HD2  LEU  68          HD12      LEU  68  -5.413  -1.586   4.244
  533    H    GLU  69           HN       GLU  69  -3.551  -6.905   5.021
  534    HA   GLU  69           HA       GLU  69  -5.001  -6.537   7.354
  535   1HB   GLU  69           HB2      GLU  69  -3.411  -8.684   6.231
  536   2HB   GLU  69           HB1      GLU  69  -3.252  -8.652   7.987
  537   1HG   GLU  69           HG2      GLU  69  -5.978  -8.192   7.496
  538   2HG   GLU  69           HG1      GLU  69  -5.520  -9.474   6.375
  539    H    ASN  70           HN       ASN  70  -1.472  -7.030   7.287
  540    HA   ASN  70           HA       ASN  70  -1.142  -4.961   9.349
  541   1HB   ASN  70           HB2      ASN  70   0.361  -7.406  10.029
  542   2HB   ASN  70           HB1      ASN  70  -0.494  -6.282  11.083
  543   1HD2  ASN  70          HD22      ASN  70  -2.243  -9.762  10.216
  544   2HD2  ASN  70          HD21      ASN  70  -0.594  -9.445   9.968
  545    HA   PRO  71           HA       PRO  71   2.104  -4.222   6.451
  546   1HB   PRO  71           HB2      PRO  71   3.550  -2.770   8.515
  547   2HB   PRO  71           HB1      PRO  71   2.724  -2.134   7.072
  548   1HG   PRO  71           HG2      PRO  71   1.833  -1.984   9.804
  549   2HG   PRO  71           HG1      PRO  71   0.995  -1.398   8.364
  550   1HD   PRO  71           HD2      PRO  71   0.289  -3.643  10.003
  551   2HD   PRO  71           HD1      PRO  71  -0.501  -3.108   8.505
  552    H    LYS  72           HN       LYS  72   3.751  -4.266   9.603
  553    HA   LYS  72           HA       LYS  72   6.019  -5.621   8.908
  554   1HB   LYS  72           HB2      LYS  72   4.383  -5.731  11.421
  555   2HB   LYS  72           HB1      LYS  72   5.835  -6.723  11.269
  556   1HG   LYS  72           HG2      LYS  72   7.188  -4.746  10.779
  557   2HG   LYS  72           HG1      LYS  72   5.740  -3.719  10.823
  558   1HD   LYS  72           HD2      LYS  72   5.444  -4.077  13.163
  559   2HD   LYS  72           HD1      LYS  72   6.587  -5.419  13.181
  560   1HE   LYS  72           HE1      LYS  72   8.354  -3.721  12.421
  561   2HE   LYS  72           HE2      LYS  72   7.178  -2.474  12.837
  562   1HZ   LYS  72           HZ3      LYS  72   7.349  -4.365  14.923
  563   2HZ   LYS  72           HZ2      LYS  72   8.907  -3.805  14.546
  564   3HZ   LYS  72           HZ1      LYS  72   7.686  -2.701  14.964
  565    H    LYS  73           HN       LYS  73   2.828  -7.117   9.178
  566    HA   LYS  73           HA       LYS  73   3.611  -9.801   9.413
  567   1HB   LYS  73           HB2      LYS  73   1.382 -10.016   9.318
  568   2HB   LYS  73           HB1      LYS  73   1.229  -8.382   8.705
  569   1HG   LYS  73           HG2      LYS  73   1.037  -9.080   6.504
  570   2HG   LYS  73           HG1      LYS  73   2.008 -10.530   6.764
  571   1HD   LYS  73           HD1      LYS  73   0.133 -11.726   7.035
  572   2HD   LYS  73           HD2      LYS  73  -0.265 -10.748   8.447
  573   1HE   LYS  73           HE1      LYS  73  -1.263  -9.040   6.897
  574   2HE   LYS  73           HE2      LYS  73  -1.006 -10.170   5.567
  575   1HZ   LYS  73           HZ3      LYS  73  -2.297 -11.809   6.974
  576   2HZ   LYS  73           HZ1      LYS  73  -2.768 -10.481   7.921
  577   3HZ   LYS  73           HZ2      LYS  73  -3.186 -10.542   6.276
  578    H    TYR  74           HN       TYR  74   3.165  -7.991   6.332
  579    HA   TYR  74           HA       TYR  74   4.173 -10.136   4.722
  580   1HB   TYR  74           HB2      TYR  74   3.810  -8.731   2.965
  581   2HB   TYR  74           HB1      TYR  74   3.029  -7.706   4.164
  582    HD1  TYR  74           HD2      TYR  74   4.350  -5.865   5.258
  583    HD2  TYR  74           HD1      TYR  74   5.861  -8.069   1.905
  584    HE1  TYR  74           HE2      TYR  74   6.023  -4.092   4.857
  585    HE2  TYR  74           HE1      TYR  74   7.546  -6.282   1.504
  586    HH   TYR  74           HH       TYR  74   8.423  -4.402   2.252
  587    H    ILE  75           HN       ILE  75   5.710  -7.504   6.459
  588    HA   ILE  75           HA       ILE  75   8.295  -8.867   6.394
  589    HB   ILE  75           HB       ILE  75   7.820  -6.285   4.876
  590   1HG1  ILE  75          HG11      ILE  75   7.681  -8.318   3.536
  591   2HG1  ILE  75          HG12      ILE  75   9.196  -7.504   3.160
  592   1HG2  ILE  75          HG22      ILE  75  10.214  -7.207   6.376
  593   2HG2  ILE  75          HG23      ILE  75  10.510  -6.617   4.740
  594   3HG2  ILE  75          HG21      ILE  75   9.726  -5.573   5.926
  595   1HD1  ILE  75           HD1      ILE  75  10.288  -8.994   4.915
  596   2HD1  ILE  75           HD3      ILE  75   8.787  -9.920   4.938
  597   3HD1  ILE  75           HD2      ILE  75   9.738  -9.820   3.456
  598    HA   PRO  76           HA       PRO  76   7.385  -6.523  10.174
  599   1HB   PRO  76           HB2      PRO  76   9.249  -8.280  11.498
  600   2HB   PRO  76           HB1      PRO  76   7.489  -8.152  11.713
  601   1HG   PRO  76           HG2      PRO  76   8.899 -10.280  10.437
  602   2HG   PRO  76           HG1      PRO  76   7.146 -10.053  10.498
  603   1HD   PRO  76           HD2      PRO  76   8.948  -9.667   8.232
  604   2HD   PRO  76           HD1      PRO  76   7.172  -9.640   8.254
  605    H    GLY  77           HN       GLY  77  10.135  -7.073   8.346
  606   1HA   GLY  77           HA2      GLY  77  11.966  -5.520  10.041
  607   2HA   GLY  77           HA1      GLY  77  12.321  -6.131   8.409
  608    H    THR  78           HN       THR  78   9.295  -4.665   8.458
  609    HA   THR  78           HA       THR  78  10.203  -2.433   6.828
  610    HB   THR  78           HB       THR  78   8.055  -3.377   6.310
  611    HG1  THR  78           HG1      THR  78   7.364  -1.458   5.982
  612   1HG2  THR  78          HG21      THR  78   7.866  -3.694   9.119
  613   2HG2  THR  78          HG22      THR  78   6.529  -2.650   8.640
  614   3HG2  THR  78          HG23      THR  78   6.717  -4.237   7.897
  615    H    LYS  79           HN       LYS  79   9.151  -0.191   7.503
  616    HA   LYS  79           HA       LYS  79   9.755   0.272  10.394
  617   1HB   LYS  79           HB2      LYS  79  11.388   1.160   8.496
  618   2HB   LYS  79           HB1      LYS  79  10.173   2.431   8.358
  619   1HG   LYS  79           HG1      LYS  79  10.550   3.216  10.518
  620   2HG   LYS  79           HG2      LYS  79  11.187   1.670  11.078
  621   1HD   LYS  79           HD2      LYS  79  13.102   2.122   9.356
  622   2HD   LYS  79           HD1      LYS  79  12.554   3.796   9.442
  623   1HE   LYS  79           HE1      LYS  79  12.645   3.057  12.103
  624   2HE   LYS  79           HE2      LYS  79  14.032   2.207  11.423
  625   1HZ   LYS  79           HZ2      LYS  79  13.796   4.884  10.443
  626   2HZ   LYS  79           HZ1      LYS  79  13.955   4.835  12.133
  627   3HZ   LYS  79           HZ3      LYS  79  15.129   4.104  11.148
  628    H    MET  80           HN       MET  80   7.177  -0.206   8.913
  629    HA   MET  80           HA       MET  80   5.837   2.316   9.781
  630   1HB   MET  80           HB2      MET  80   4.372   2.272   7.876
  631   2HB   MET  80           HB1      MET  80   6.024   2.169   7.272
  632   1HG   MET  80           HG2      MET  80   5.646   0.143   6.346
  633   2HG   MET  80           HG1      MET  80   4.937  -0.475   7.836
  634   1HE   MET  80           HE3      MET  80   2.651  -0.209   8.599
  635   2HE   MET  80           HE2      MET  80   2.475   1.529   8.354
  636   3HE   MET  80           HE1      MET  80   1.268   0.419   7.703
  637    H    ILE  81           HN       ILE  81   3.707   2.039  10.559
  638    HA   ILE  81           HA       ILE  81   2.660  -0.702  10.760
  639    HB   ILE  81           HB       ILE  81   3.886   0.712  13.007
  640   1HG1  ILE  81          HG12      ILE  81   3.192  -2.044  12.079
  641   2HG1  ILE  81          HG11      ILE  81   4.738  -1.414  12.640
  642   1HG2  ILE  81          HG21      ILE  81   1.106  -0.480  13.311
  643   2HG2  ILE  81          HG22      ILE  81   2.172  -0.072  14.656
  644   3HG2  ILE  81          HG23      ILE  81   1.556   1.201  13.602
  645   1HD1  ILE  81           HD1      ILE  81   3.237  -1.216  14.909
  646   2HD1  ILE  81           HD2      ILE  81   2.535  -2.652  14.169
  647   3HD1  ILE  81           HD3      ILE  81   4.262  -2.597  14.526
  648    H    PHE  82           HN       PHE  82   0.454  -0.743  10.944
  649    HA   PHE  82           HA       PHE  82  -1.203   1.386  11.791
  650   1HB   PHE  82           HB2      PHE  82  -0.588   2.764   9.988
  651   2HB   PHE  82           HB1      PHE  82  -0.409   1.401   8.881
  652    HD1  PHE  82           HD2      PHE  82  -2.420   0.238   7.983
  653    HD2  PHE  82           HD1      PHE  82  -2.753   3.798  10.364
  654    HE1  PHE  82           HE2      PHE  82  -4.776   0.492   7.270
  655    HE2  PHE  82           HE1      PHE  82  -5.114   4.053   9.642
  656    HZ   PHE  82           HZ       PHE  82  -6.125   2.391   8.093
  657    H    ALA  83           HN       ALA  83  -2.703  -0.047  12.539
  658    HA   ALA  83           HA       ALA  83  -3.536  -2.264  10.732
  659   1HB   ALA  83           HB3      ALA  83  -2.722  -2.516  13.250
  660   2HB   ALA  83           HB1      ALA  83  -4.403  -2.106  13.593
  661   3HB   ALA  83           HB2      ALA  83  -4.023  -3.524  12.615
  662    H    GLY  84           HN       GLY  84  -4.802  -0.493   9.553
  663   1HA   GLY  84           HA2      GLY  84  -7.313   0.211  11.009
  664   2HA   GLY  84           HA1      GLY  84  -6.685   1.096   9.623
  665    H    ILE  85           HN       ILE  85  -6.547  -0.286   7.533
  666    HA   ILE  85           HA       ILE  85  -9.156  -1.598   7.215
  667    HB   ILE  85           HB       ILE  85  -7.044  -1.363   5.069
  668   1HG1  ILE  85          HG11      ILE  85  -9.123   0.741   5.255
  669   2HG1  ILE  85          HG12      ILE  85  -7.843   0.823   6.484
  670   1HG2  ILE  85          HG22      ILE  85  -9.690  -2.364   5.193
  671   2HG2  ILE  85          HG23      ILE  85  -9.767  -0.851   4.290
  672   3HG2  ILE  85          HG21      ILE  85  -8.691  -2.142   3.756
  673   1HD1  ILE  85           HD1      ILE  85  -6.528   0.237   4.062
  674   2HD1  ILE  85           HD2      ILE  85  -7.712   1.483   3.661
  675   3HD1  ILE  85           HD3      ILE  85  -6.520   1.776   4.927
  676    H    LYS  86           HN       LYS  86  -7.787  -3.181   8.914
  677    HA   LYS  86           HA       LYS  86  -6.293  -5.226   7.425
  678   1HB   LYS  86           HB2      LYS  86  -5.496  -4.739   9.642
  679   2HB   LYS  86           HB1      LYS  86  -7.104  -4.955  10.330
  680   1HG   LYS  86           HG1      LYS  86  -7.036  -7.353   9.610
  681   2HG   LYS  86           HG2      LYS  86  -5.375  -7.107   9.074
  682   1HD   LYS  86           HD1      LYS  86  -4.835  -7.736  11.195
  683   2HD   LYS  86           HD2      LYS  86  -5.286  -6.083  11.615
  684   1HE   LYS  86           HE1      LYS  86  -7.504  -6.754  12.233
  685   2HE   LYS  86           HE2      LYS  86  -7.281  -8.358  11.536
  686   1HZ   LYS  86           HZ2      LYS  86  -5.382  -8.568  13.196
  687   2HZ   LYS  86           HZ1      LYS  86  -6.072  -7.231  13.983
  688   3HZ   LYS  86           HZ3      LYS  86  -6.965  -8.664  13.804
  689    H    LYS  87           HN       LYS  87  -9.552  -4.586   8.131
  690    HA   LYS  87           HA       LYS  87 -10.724  -7.064   8.649
  691   1HB   LYS  87           HB2      LYS  87 -11.651  -4.832   6.825
  692   2HB   LYS  87           HB1      LYS  87 -12.659  -6.222   7.232
  693   1HG   LYS  87           HG2      LYS  87 -11.961  -5.566   9.712
  694   2HG   LYS  87           HG1      LYS  87 -11.728  -3.978   8.979
  695   1HD   LYS  87           HD1      LYS  87 -13.974  -3.724   8.488
  696   2HD   LYS  87           HD2      LYS  87 -14.246  -5.460   8.340
  697   1HE   LYS  87           HE2      LYS  87 -14.026  -5.703  10.788
  698   2HE   LYS  87           HE1      LYS  87 -13.759  -3.966  10.936
  699   1HZ   LYS  87           HZ2      LYS  87 -16.039  -4.170   9.457
  700   2HZ   LYS  87           HZ3      LYS  87 -16.206  -5.406  10.610
  701   3HZ   LYS  87           HZ1      LYS  87 -15.953  -3.804  11.113
  702    H    LYS  88           HN       LYS  88 -11.471  -6.182   5.366
  703    HA   LYS  88           HA       LYS  88  -9.653  -7.862   3.975
  704   1HB   LYS  88           HB2      LYS  88 -10.916  -9.560   5.461
  705   2HB   LYS  88           HB1      LYS  88 -12.290  -9.271   4.394
  706   1HG   LYS  88           HG2      LYS  88 -10.596  -9.727   2.469
  707   2HG   LYS  88           HG1      LYS  88  -9.608 -10.468   3.728
  708   1HD   LYS  88           HD1      LYS  88 -12.478 -11.249   3.662
  709   2HD   LYS  88           HD2      LYS  88 -11.469 -11.847   2.345
  710   1HE   LYS  88           HE2      LYS  88 -10.209 -13.175   3.734
  711   2HE   LYS  88           HE1      LYS  88 -10.342 -12.059   5.092
  712   1HZ   LYS  88           HZ1      LYS  88 -12.688 -12.741   5.307
  713   2HZ   LYS  88           HZ2      LYS  88 -12.440 -13.907   4.098
  714   3HZ   LYS  88           HZ3      LYS  88 -11.599 -14.018   5.570
  715    H    THR  89           HN       THR  89 -13.223  -7.819   3.716
  716    HA   THR  89           HA       THR  89 -13.454  -7.442   0.993
  717    HB   THR  89           HB       THR  89 -15.528  -6.040   1.535
  718    HG1  THR  89           HG1      THR  89 -15.972  -5.683   3.630
  719   1HG2  THR  89          HG21      THR  89 -15.292  -8.628   1.437
  720   2HG2  THR  89          HG23      THR  89 -15.410  -8.547   3.195
  721   3HG2  THR  89          HG22      THR  89 -16.731  -7.945   2.194
  722    H    GLU  90           HN       GLU  90 -13.533  -4.666   3.256
  723    HA   GLU  90           HA       GLU  90 -13.175  -2.643   1.354
  724   1HB   GLU  90           HB2      GLU  90 -12.102  -2.811   4.187
  725   2HB   GLU  90           HB1      GLU  90 -12.112  -1.335   3.219
  726   1HG   GLU  90           HG1      GLU  90 -14.545  -1.425   3.038
  727   2HG   GLU  90           HG2      GLU  90 -14.578  -2.963   3.901
  728    H    ARG  91           HN       ARG  91 -10.679  -4.570   3.040
  729    HA   ARG  91           HA       ARG  91  -8.357  -3.362   2.149
  730   1HB   ARG  91           HB2      ARG  91  -8.776  -6.356   2.010
  731   2HB   ARG  91           HB1      ARG  91  -7.267  -5.496   2.318
  732   1HG   ARG  91           HG2      ARG  91  -8.436  -4.508   4.377
  733   2HG   ARG  91           HG1      ARG  91  -9.677  -5.731   4.125
  734   1HD   ARG  91           HD2      ARG  91  -7.132  -6.021   5.413
  735   2HD   ARG  91           HD1      ARG  91  -8.394  -7.232   5.208
  736    HE   ARG  91           HE       ARG  91  -6.173  -6.785   3.257
  737   1HH1  ARG  91          HH21      ARG  91  -8.743  -8.189   2.358
  738   2HH1  ARG  91          HH22      ARG  91  -8.293  -9.850   2.551
  739   1HH2  ARG  91          HH11      ARG  91  -5.538  -9.149   4.535
  740   2HH2  ARG  91          HH12      ARG  91  -6.479 -10.393   3.783
  741    H    GLU  92           HN       GLU  92 -10.143  -5.869   0.308
  742    HA   GLU  92           HA       GLU  92  -8.605  -5.806  -2.035
  743   1HB   GLU  92           HB2      GLU  92 -11.098  -6.876  -1.265
  744   2HB   GLU  92           HB1      GLU  92 -11.422  -5.909  -2.705
  745   1HG   GLU  92           HG1      GLU  92  -9.598  -7.074  -3.896
  746   2HG   GLU  92           HG2      GLU  92  -9.284  -8.048  -2.459
  747    H    ASP  93           HN       ASP  93 -11.483  -3.805  -1.293
  748    HA   ASP  93           HA       ASP  93 -11.572  -2.216  -3.579
  749   1HB   ASP  93           HB2      ASP  93 -11.832  -1.121  -0.766
  750   2HB   ASP  93           HB1      ASP  93 -12.597  -0.497  -2.227
  751    H    LEU  94           HN       LEU  94  -9.492  -1.777  -0.742
  752    HA   LEU  94           HA       LEU  94  -8.171   0.592  -1.468
  753   1HB   LEU  94           HB2      LEU  94  -7.937  -1.262   0.554
  754   2HB   LEU  94           HB1      LEU  94  -6.423  -1.486  -0.324
  755    HG   LEU  94           HG       LEU  94  -7.501   1.144   0.696
  756   1HD1  LEU  94          HD11      LEU  94  -6.568  -0.551   2.370
  757   2HD1  LEU  94          HD12      LEU  94  -5.013  -0.316   1.572
  758   3HD1  LEU  94          HD13      LEU  94  -5.811   1.043   2.364
  759   1HD2  LEU  94          HD23      LEU  94  -5.591   0.510  -1.353
  760   2HD2  LEU  94          HD22      LEU  94  -6.086   2.099  -0.773
  761   3HD2  LEU  94          HD21      LEU  94  -4.748   1.254   0.004
  762    H    ILE  95           HN       ILE  95  -7.113  -2.745  -2.133
  763    HA   ILE  95           HA       ILE  95  -4.867  -2.053  -3.713
  764    HB   ILE  95           HB       ILE  95  -6.567  -4.474  -3.331
  765   1HG1  ILE  95          HG12      ILE  95  -3.751  -4.940  -3.586
  766   2HG1  ILE  95          HG11      ILE  95  -3.997  -3.490  -2.614
  767   1HG2  ILE  95          HG21      ILE  95  -5.198  -3.904  -5.900
  768   2HG2  ILE  95          HG22      ILE  95  -4.820  -5.465  -5.175
  769   3HG2  ILE  95          HG23      ILE  95  -6.492  -5.046  -5.543
  770   1HD1  ILE  95           HD3      ILE  95  -5.945  -5.267  -1.693
  771   2HD1  ILE  95           HD2      ILE  95  -4.520  -6.277  -1.936
  772   3HD1  ILE  95           HD1      ILE  95  -4.433  -4.868  -0.879
  773    H    ALA  96           HN       ALA  96  -7.790  -3.479  -5.240
  774    HA   ALA  96           HA       ALA  96  -7.413  -2.745  -7.841
  775   1HB   ALA  96           HB3      ALA  96  -9.807  -3.035  -6.156
  776   2HB   ALA  96           HB1      ALA  96 -10.056  -2.022  -7.578
  777   3HB   ALA  96           HB2      ALA  96  -9.480  -3.678  -7.766
  778    H    TYR  97           HN       TYR  97  -9.152  -0.499  -5.643
  779    HA   TYR  97           HA       TYR  97  -9.340   1.737  -7.227
  780   1HB   TYR  97           HB2      TYR  97 -10.090   2.331  -5.162
  781   2HB   TYR  97           HB1      TYR  97  -8.993   1.241  -4.346
  782    HD1  TYR  97           HD2      TYR  97  -9.251   4.604  -5.930
  783    HD2  TYR  97           HD1      TYR  97  -6.970   2.014  -3.388
  784    HE1  TYR  97           HE2      TYR  97  -7.789   6.507  -5.289
  785    HE2  TYR  97           HE1      TYR  97  -5.516   3.892  -2.757
  786    HH   TYR  97           HH       TYR  97  -5.930   7.114  -4.218
  787    H    LEU  98           HN       LEU  98  -6.572   1.209  -5.111
  788    HA   LEU  98           HA       LEU  98  -4.796   3.138  -6.043
  789   1HB   LEU  98           HB2      LEU  98  -4.709   1.136  -4.237
  790   2HB   LEU  98           HB1      LEU  98  -3.648   0.454  -5.476
  791    HG   LEU  98           HG       LEU  98  -2.171   1.660  -4.092
  792   1HD1  LEU  98          HD22      LEU  98  -3.031   3.467  -6.358
  793   2HD1  LEU  98          HD23      LEU  98  -1.594   3.755  -5.380
  794   3HD1  LEU  98          HD21      LEU  98  -1.717   2.293  -6.358
  795   1HD2  LEU  98          HD12      LEU  98  -4.023   2.791  -2.824
  796   2HD2  LEU  98          HD11      LEU  98  -2.627   3.823  -3.134
  797   3HD2  LEU  98          HD13      LEU  98  -4.087   4.000  -4.107
  798    H    LYS  99           HN       LYS  99  -5.160  -0.171  -7.310
  799    HA   LYS  99           HA       LYS  99  -3.174  -0.390  -9.154
  800   1HB   LYS  99           HB2      LYS  99  -4.902  -2.096  -8.862
  801   2HB   LYS  99           HB1      LYS  99  -6.091  -1.043  -9.628
  802   1HG   LYS  99           HG1      LYS  99  -4.469  -0.997 -11.641
  803   2HG   LYS  99           HG2      LYS  99  -3.700  -2.390 -10.881
  804   1HD   LYS  99           HD2      LYS  99  -6.292  -3.158 -10.731
  805   2HD   LYS  99           HD1      LYS  99  -6.356  -2.172 -12.192
  806   1HE   LYS  99           HE1      LYS  99  -4.663  -3.491 -13.260
  807   2HE   LYS  99           HE2      LYS  99  -4.266  -4.318 -11.754
  808   1HZ   LYS  99           HZ2      LYS  99  -6.542  -5.228 -11.757
  809   2HZ   LYS  99           HZ3      LYS  99  -6.803  -4.527 -13.281
  810   3HZ   LYS  99           HZ1      LYS  99  -5.627  -5.737 -13.094
  811    H    LYS 100           HN       LYS 100  -6.272   1.267  -9.841
  812    HA   LYS 100           HA       LYS 100  -4.989   2.456 -12.248
  813   1HB   LYS 100           HB2      LYS 100  -7.725   1.798 -11.435
  814   2HB   LYS 100           HB1      LYS 100  -7.590   3.401 -12.157
  815   1HG   LYS 100           HG1      LYS 100  -6.520   2.483 -14.133
  816   2HG   LYS 100           HG2      LYS 100  -6.451   0.881 -13.399
  817   1HD   LYS 100           HD1      LYS 100  -8.651   0.452 -13.828
  818   2HD   LYS 100           HD2      LYS 100  -9.143   2.108 -13.476
  819   1HE   LYS 100           HE2      LYS 100  -8.626   2.855 -15.642
  820   2HE   LYS 100           HE1      LYS 100  -7.549   1.494 -15.956
  821   1HZ   LYS 100           HZ2      LYS 100 -10.446   1.119 -15.500
  822   2HZ   LYS 100           HZ1      LYS 100  -9.819   1.442 -17.045
  823   3HZ   LYS 100           HZ3      LYS 100  -9.341   0.042 -16.211
  824    H    ALA 101           HN       ALA 101  -5.528   3.298  -9.007
  825    HA   ALA 101           HA       ALA 101  -6.129   6.104  -9.365
  826   1HB   ALA 101           HB3      ALA 101  -6.476   4.787  -7.227
  827   2HB   ALA 101           HB1      ALA 101  -4.727   4.818  -7.006
  828   3HB   ALA 101           HB2      ALA 101  -5.642   6.326  -7.013
  829    H    THR 102           HN       THR 102  -3.129   4.390  -8.478
  830    HA   THR 102           HA       THR 102  -1.556   6.785  -9.002
  831    HB   THR 102           HB       THR 102  -1.167   4.196  -7.744
  832    HG1  THR 102           HG1      THR 102  -0.266   6.818  -7.645
  833   1HG2  THR 102          HG23      THR 102   0.240   3.873  -9.839
  834   2HG2  THR 102          HG22      THR 102   1.212   5.243  -9.298
  835   3HG2  THR 102          HG21      THR 102   1.126   3.780  -8.316
  836    H    ASN 103           HN       ASN 103  -3.158   4.976 -11.105
  837    HA   ASN 103           HA       ASN 103  -0.955   4.576 -13.039
  838   1HB   ASN 103           HB2      ASN 103  -3.336   3.240 -12.639
  839   2HB   ASN 103           HB1      ASN 103  -3.739   4.309 -13.983
  840   1HD2  ASN 103          HD22      ASN 103  -2.294   1.868 -16.098
  841   2HD2  ASN 103          HD21      ASN 103  -3.706   2.701 -15.655
  842    H    GLU 104           HN       GLU 104  -2.520   7.137 -11.848
  843    HA   GLU 104           HA       GLU 104  -3.757   8.660 -13.733
  844   1HB   GLU 104           HB2      GLU 104  -3.070   9.419 -11.446
  845   2HB   GLU 104           HB1      GLU 104  -1.430   9.645 -12.054
  846   1HG   GLU 104           HG1      GLU 104  -2.526  11.131 -13.875
  847   2HG   GLU 104           HG2      GLU 104  -3.935  11.147 -12.813
  848    HHA  HEC 105           HHA      HEM 105   6.179  -0.584   2.459
  849    HHB  HEC 105           HHB      HEM 105  -0.023  -1.123   1.378
  850    HHC  HEC 105           HHC      HEM 105  -1.164   2.846   6.166
  851    HHD  HEC 105           HHD      HEM 105   4.879   4.555   5.804
  852   1HMA  HEC 105          HMA1      HEM 105   2.468  -3.346  -0.134
  853   2HMA  HEC 105          HMA2      HEM 105   1.993  -1.886  -1.034
  854   3HMA  HEC 105          HMA3      HEM 105   0.906  -2.562   0.203
  855   1HAA  HEC 105          HAA1      HEM 105   4.608  -2.609  -0.416
  856   2HAA  HEC 105          HAA2      HEM 105   5.505  -2.845   1.096
  857   1HBA  HEC 105          HBA1      HEM 105   7.092  -1.491   0.279
  858   2HBA  HEC 105          HBA2      HEM 105   5.927  -0.148   0.369
  859   1HMB  HEC 105          HMB1      HEM 105  -3.181  -0.929   2.831
  860   2HMB  HEC 105          HMB2      HEM 105  -2.021  -0.971   1.481
  861   3HMB  HEC 105          HMB3      HEM 105  -3.118   0.418   1.669
  862    HAB  HEC 105           HAB      HEM 105  -2.950   2.171   5.534
  863   1HBB  HEC 105          HBB1      HEM 105  -4.939   0.961   5.480
  864   2HBB  HEC 105          HBB2      HEM 105  -3.660  -0.272   5.397
  865   3HBB  HEC 105          HBB3      HEM 105  -4.543   0.195   3.924
  866   1HMC  HEC 105          HMC1      HEM 105   0.301   6.032   7.738
  867   2HMC  HEC 105          HMC2      HEM 105  -0.888   5.145   6.755
  868   3HMC  HEC 105          HMC3      HEM 105  -0.437   4.540   8.367
  869    HAC  HEC 105           HAC      HEM 105   4.059   5.369   7.815
  870   1HBC  HEC 105          HBC1      HEM 105   1.991   5.061   9.499
  871   2HBC  HEC 105          HBC2      HEM 105   1.752   6.757   9.015
  872   3HBC  HEC 105          HBC3      HEM 105   3.299   6.246   9.730
  873   1HMD  HEC 105          HMD1      HEM 105   6.985   4.291   6.044
  874   2HMD  HEC 105          HMD2      HEM 105   8.169   3.904   4.772
  875   3HMD  HEC 105          HMD3      HEM 105   8.090   2.910   6.247
  876   1HAD  HEC 105          HAD1      HEM 105   7.928   0.499   2.573
  877   2HAD  HEC 105          HAD2      HEM 105   8.625   2.033   3.118
  878   1HBD  HEC 105          HBD1      HEM 105   9.624  -0.298   3.881
  879   2HBD  HEC 105          HBD2      HEM 105   8.344  -0.184   5.107
  880   1H    HOH 200           H1       HOH 200  -0.016   5.855  -1.463
  881   2H    HOH 200           H2       HOH 200   1.429   6.247  -1.685
  882   1H    HOH 201           H1       HOH 201   9.465  -3.839   2.930
  883   2H    HOH 201           H2       HOH 201   9.962  -4.631   4.119
  884   1H    HOH 202           H1       HOH 202   0.604  -3.018  13.055
  885   2H    HOH 202           H2       HOH 202   0.878  -3.065  11.567
  886   1H    HOH 203           H1       HOH 203  10.692   3.849  -3.677
  887   2H    HOH 203           H2       HOH 203  10.353   3.890  -2.202
  888   1H    HOH 204           H1       HOH 204   3.597  -7.963  -0.762
  889   2H    HOH 204           H2       HOH 204   4.243  -9.302  -1.049
  890   1H    HOH 205           H1       HOH 205  -3.492  -0.563  -2.679
  891   2H    HOH 205           H2       HOH 205  -2.771   0.532  -1.921
   
  No H/Q in entry =         891