*HEADER    TRANSCRIPTION, METAL BINDING PROTEIN    27-MAR-06   2GHF              
*TITLE     SOLUTION STRUCTURE OF THE COMPLETE ZINC-FINGER REGION OF              
*TITLE    2 HUMAN ZINC-FINGERS AND HOMEOBOXES 1 (ZHX1)                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC FINGERS AND HOMEOBOXES PROTEIN 1;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: ZINC-FINGER REGION;                                        
*COMPND   5 SYNONYM: ZHX1;                                                       
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: ZHX1;                                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: ROSETTA (NOVAGEN);                         
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PDEST-14                                  
*KEYWDS    C2H2 ZINC FINGERS; 4-STRANDED PARALLEL/ANTI-PARALLEL BETA-            
*KEYWDS   2 SHEET, STRUCTURAL GENOMICS, STRUCTURAL PROTEOMICS IN EUROPE,         
*KEYWDS   3 SPINE                                                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    H.WIENK, STRUCTURAL PROTEOMICS IN EUROPE (SPINE)                      
*REVDAT   1   11-APR-06 2GHF    0                                                


assign ( resid  40 and name  HB1 ) ( resid  41 and name   HN ) 3.86 3.86 0.00 
  peak 1
assign ( resid  30 and name   HN ) ( resid  33 and name   HN ) 4.80 4.80 0.00 
  peak 2
assign ( resid  33 and name   HN ) ( resid  33 and name  HG2 ) 3.77 3.77 0.00 
  peak 4
assign ( resid  19 and name   HA ) ( resid  20 and name   HN ) 2.91 2.91 0.00 
  peak 6
assign ( resid  66 and name   HN ) ( resid  67 and name   HN ) 3.13 3.13 0.00 
  peak 8
assign ( resid  70 and name   HN ) ( resid  71 and name   HN ) 3.16 3.16 0.00 
  peak 9
assign ( resid  94 and name   HN ) ( resid  94 and name  HB+ ) 3.36 3.36 0.00 
  peak 10
assign ( resid  95 and name   HA ) ( resid  96 and name   HN ) 2.92 2.92 0.00 
  peak 11
assign ( resid  72 and name  HG2 ) ( resid  73 and name   HN ) 3.88 3.88 0.00 
  peak 12
assign ( resid  44 and name  HB+ ) ( resid  45 and name   HN ) 4.14 4.14 0.00 
  peak 13
assign ( resid  57 and name   HA ) ( resid  58 and name   HN ) 2.86 2.86 0.00 
  peak 17
assign ( resid  91 and name   HN ) ( resid  91 and name   HB ) 3.57 3.57 0.00 
  peak 19
assign ( resid  98 and name   HN ) ( resid  98 and name  HB1 ) 3.38 3.38 0.00 
  peak 20
assign ( resid  93 and name  HB1 ) ( resid  94 and name   HN ) 3.90 3.90 0.00 
  peak 21
assign ( resid  31 and name   HN ) ( resid  31 and name  HB1 ) 3.40 3.40 0.00 
  peak 25
assign ( resid  41 and name   HN ) ( resid  41 and name  HB+ ) 3.59 3.59 0.00 
  peak 26
assign ( resid  92 and name   HN ) ( resid  92 and name   HB ) 3.81 3.81 0.00 
  peak 30
assign ( resid  53 and name   HA ) ( resid  56 and name   HN ) 4.27 4.27 0.00 
  peak 31
assign ( resid  87 and name   HN ) ( resid  87 and name  HB2 ) 3.06 3.06 0.00 
  peak 33
assign ( resid  96 and name   HB ) ( resid  97 and name   HN ) 3.25 3.25 0.00 
  peak 34
assign ( resid  18 and name  HA2 ) ( resid  19 and name   HN ) 3.20 3.20 0.00 
  peak 35
assign ( resid  79 and name   HN ) ( resid  79 and name HD21 ) 3.54 3.54 0.00 
  peak 39
assign ( resid  71 and name   HN ) ( resid  72 and name   HN ) 2.87 2.87 0.00 
  peak 41
assign ( resid  69 and name   HN ) ( resid  69 and name   HA ) 2.88 2.88 0.00 
  peak 42
assign ( resid  94 and name  HG2 ) ( resid  95 and name   HN ) 4.56 4.56 0.00 
  peak 43
assign ( resid  27 and name   HA ) ( resid  28 and name   HN ) 2.48 2.48 0.00 
  peak 44
assign ( resid  89 and name  HB2 ) ( resid  90 and name   HN ) 3.49 3.49 0.00 
  peak 46
assign ( resid  99 and name   HN ) ( resid  99 and name  HB1 ) 3.44 3.44 0.00 
  peak 47
assign ( resid  66 and name   HN ) ( resid  66 and name  HB2 ) 3.26 3.26 0.00 
  peak 50
assign ( resid  65 and name   HN ) ( resid  65 and name  HB+ ) 2.53 2.53 0.00 
  peak 52
assign ( resid  77 and name   HN ) ( resid  77 and name   HA ) 2.90 2.90 0.00 
  peak 56
assign ( resid  28 and name HG2+ ) ( resid  32 and name   HN ) 5.50 5.50 0.00 
  peak 58
assign ( resid  31 and name   HG ) ( resid  32 and name   HN ) 5.50 5.50 0.00 
  peak 58
assign ( resid  57 and name  HB1 ) ( resid  57 and name HD21 ) 3.17 3.17 0.00 
  peak 59
assign ( resid  33 and name   HN ) ( resid  35 and name   HN ) 4.46 4.46 0.00 
  peak 63
assign ( resid  79 and name  HB1 ) ( resid  80 and name   HN ) 4.04 4.04 0.00 
  peak 64
assign ( resid  83 and name   HN ) ( resid  83 and name   HB ) 3.60 3.60 0.00 
  peak 66
assign ( resid  32 and name  HB1 ) ( resid  33 and name   HN ) 3.31 3.31 0.00 
  peak 67
assign ( resid  18 and name  HA1 ) ( resid  19 and name   HN ) 2.85 2.85 0.00 
  peak 71
assign ( resid  79 and name  HB2 ) ( resid  98 and name HD22 ) 2.77 2.77 0.00 
  peak 72
assign ( resid  68 and name   HN ) ( resid  68 and name  HB2 ) 2.93 2.93 0.00 
  peak 73
assign ( resid  96 and name   HA ) ( resid  97 and name   HN ) 2.62 2.62 0.00 
  peak 74
assign ( resid  40 and name   HN ) ( resid  40 and name  HB1 ) 2.98 2.98 0.00 
  peak 75
assign ( resid  97 and name   HB ) ( resid  98 and name   HN ) 3.54 3.54 0.00 
  peak 76
assign ( resid  57 and name   HN ) ( resid  57 and name  HB2 ) 3.09 3.09 0.00 
  peak 77
assign ( resid  79 and name   HA ) ( resid  80 and name   HN ) 2.40 2.40 0.00 
  peak 80
assign ( resid  79 and name   HN ) ( resid  80 and name   HN ) 3.60 3.60 0.00 
  peak 82
assign ( resid  38 and name   HN ) ( resid  38 and name   HB ) 3.00 3.00 0.00 
  peak 84
assign ( resid  66 and name   HN ) ( resid  66 and name HD2+ ) 3.28 3.28 0.00 
  peak 85
assign ( resid  79 and name   HA ) ( resid  79 and name HD21 ) 4.00 4.00 0.00 
  peak 86
assign ( resid  93 and name   HA ) ( resid  94 and name   HN ) 3.03 3.03 0.00 
  peak 87
assign ( resid  96 and name   HN ) ( resid  96 and name   HB ) 3.76 3.76 0.00 
  peak 89
assign ( resid  77 and name  HG2 ) ( resid  78 and name   HN ) 4.71 4.71 0.00 
  peak 91
assign ( resid  36 and name   HN ) ( resid  37 and name   HN ) 3.24 3.24 0.00 
  peak 92
assign ( resid  96 and name HG2+ ) ( resid  97 and name   HN ) 2.91 2.91 0.00 
  peak 93
assign ( resid  56 and name   HN ) ( resid  56 and name  HB2 ) 3.00 3.00 0.00 
  peak 95
assign ( resid  77 and name  HG1 ) ( resid  78 and name   HN ) 4.71 4.71 0.00 
  peak 96
assign ( resid  89 and name  HB1 ) ( resid  90 and name   HN ) 3.65 3.65 0.00 
  peak 99
assign ( resid  32 and name   HN ) ( resid  32 and name HD22 ) 5.50 5.50 0.00 
  peak 100
assign ( resid  32 and name   HN ) ( resid  32 and name  HB2 ) 3.53 3.53 0.00 
  peak 102
assign ( resid  35 and name HG2+ ) ( resid  36 and name   HN ) 3.14 3.14 0.00 
  peak 103
assign ( resid  96 and name   HN ) ( resid  97 and name   HN ) 4.75 4.75 0.00 
  peak 104
assign ( resid  98 and name HD21 ) ( resid  99 and name   HN ) 4.38 4.38 0.00 
  peak 105
assign ( resid  86 and name   HN ) ( resid  86 and name  HB2 ) 3.10 3.10 0.00 
  peak 106
assign ( resid  82 and name  HB+ ) ( resid  83 and name   HN ) 3.30 3.30 0.00 
  peak 107
assign ( resid  66 and name  HB2 ) ( resid  67 and name   HN ) 3.14 3.14 0.00 
  peak 110
assign ( resid  90 and name   HA ) ( resid  91 and name   HN ) 2.59 2.59 0.00 
  peak 111
assign ( resid  65 and name   HN ) ( resid  66 and name   HN ) 3.00 3.00 0.00 
  peak 112
assign ( resid  39 and name   HN ) ( resid  41 and name   HN ) 4.29 4.29 0.00 
  peak 114
assign ( resid  29 and name  HB1 ) ( resid  30 and name   HN ) 4.56 4.56 0.00 
  peak 116
assign ( resid  35 and name   HN ) ( resid  35 and name   HB ) 3.19 3.19 0.00 
  peak 119
assign ( resid  66 and name   HA ) ( resid  69 and name   HN ) 3.41 3.41 0.00 
  peak 121
assign ( resid  84 and name   HA ) ( resid  85 and name   HN ) 3.50 3.50 0.00 
  peak 123
assign ( resid  39 and name   HA ) ( resid  42 and name   HN ) 4.52 4.52 0.00 
  peak 125
assign ( resid  60 and name   HN ) ( resid  60 and name   HB ) 3.83 3.83 0.00 
  peak 126
assign ( resid  35 and name   HA ) ( resid  39 and name   HN ) 4.29 4.29 0.00 
  peak 127
assign ( resid  91 and name   HA ) ( resid  92 and name   HN ) 2.65 2.65 0.00 
  peak 128
assign ( resid  72 and name   HN ) ( resid  72 and name  HG1 ) 3.21 3.21 0.00 
  peak 129
assign ( resid  86 and name   HA ) ( resid  87 and name   HN ) 2.66 2.66 0.00 
  peak 131
assign ( resid  66 and name   HN ) ( resid  68 and name   HN ) 4.14 4.14 0.00 
  peak 132
assign ( resid  86 and name   HN ) ( resid  86 and name  HB1 ) 3.19 3.19 0.00 
  peak 135
assign ( resid  85 and name   HN ) ( resid  86 and name   HN ) 3.88 3.88 0.00 
  peak 136
assign ( resid  38 and name   HA ) ( resid  42 and name   HN ) 2.94 2.94 0.00 
  peak 138
assign ( resid  19 and name   HN ) ( resid  28 and name HG2+ ) 4.53 4.53 0.00 
  peak 140
assign ( resid  97 and name   HB ) ( resid 100 and name   HN ) 3.06 3.06 0.00 
  peak 143
assign ( resid 100 and name   HN ) ( resid 100 and name  HB2 ) 3.28 3.28 0.00 
  peak 143
assign ( resid  64 and name   HA ) ( resid  66 and name   HN ) 4.00 4.00 0.00 
  peak 144
assign ( resid  39 and name   HN ) ( resid  39 and name  HB1 ) 3.51 3.51 0.00 
  peak 148
assign ( resid  54 and name   HA ) ( resid  57 and name   HN ) 3.22 3.22 0.00 
  peak 151
assign ( resid  77 and name   HA ) ( resid  78 and name   HN ) 2.91 2.91 0.00 
  peak 154
assign ( resid  36 and name   HN ) ( resid  36 and name  HB1 ) 2.78 2.78 0.00 
  peak 155
assign ( resid  70 and name   HA ) ( resid  73 and name   HN ) 4.34 4.34 0.00 
  peak 157
assign ( resid  41 and name   HN ) ( resid  42 and name   HN ) 2.77 2.77 0.00 
  peak 158
assign ( resid  97 and name   HB ) ( resid 101 and name   HN ) 3.58 3.58 0.00 
  peak 159
assign ( resid  69 and name   HN ) ( resid  69 and name  HB1 ) 2.90 2.90 0.00 
  peak 161
assign ( resid  32 and name   HN ) ( resid  35 and name HG2+ ) 4.78 4.78 0.00 
  peak 162
assign ( resid  93 and name   HN ) ( resid  93 and name  HB1 ) 3.85 3.85 0.00 
  peak 163
assign ( resid  32 and name   HN ) ( resid  32 and name HD21 ) 4.70 4.70 0.00 
  peak 165
assign ( resid  86 and name  HG+ ) ( resid  87 and name   HN ) 3.30 3.30 0.00 
  peak 168
assign ( resid  31 and name   HN ) ( resid  31 and name HD1+ ) 4.34 4.34 0.00 
  peak 169
assign ( resid  70 and name   HA ) ( resid  74 and name   HN ) 3.23 3.23 0.00 
  peak 170
assign ( resid  76 and name   HN ) ( resid  77 and name   HN ) 3.69 3.69 0.00 
  peak 173
assign ( resid  84 and name   HN ) ( resid  85 and name HG2+ ) 3.79 3.79 0.00 
  peak 174
assign ( resid  45 and name   HB ) ( resid  46 and name   HN ) 4.68 4.68 0.00 
  peak 175
assign ( resid  35 and name   HA ) ( resid  37 and name   HN ) 5.32 5.32 0.00 
  peak 178
assign ( resid  45 and name HG1+ ) ( resid  46 and name   HN ) 4.53 4.53 0.00 
  peak 179
assign ( resid  99 and name  HB2 ) ( resid 100 and name   HN ) 3.53 3.53 0.00 
  peak 180
assign ( resid  53 and name   HN ) ( resid  53 and name  HB2 ) 3.48 3.48 0.00 
  peak 181
assign ( resid  33 and name   HN ) ( resid  33 and name  HB1 ) 3.73 3.73 0.00 
  peak 182
assign ( resid  66 and name   HA ) ( resid  68 and name   HN ) 4.66 4.66 0.00 
  peak 183
assign ( resid  37 and name   HN ) ( resid  38 and name   HN ) 3.67 3.67 0.00 
  peak 185
assign ( resid  95 and name  HB+ ) ( resid  96 and name   HN ) 3.99 3.99 0.00 
  peak 188
assign ( resid  65 and name   HA ) ( resid  66 and name   HN ) 3.55 3.55 0.00 
  peak 189
assign ( resid  86 and name  HD+ ) ( resid  87 and name   HN ) 4.00 4.00 0.00 
  peak 194
assign ( resid  34 and name   HN ) ( resid  35 and name HG2+ ) 4.24 4.24 0.00 
  peak 195
assign ( resid  35 and name HG2+ ) ( resid  38 and name   HN ) 5.03 5.03 0.00 
  peak 197
assign ( resid  94 and name   HN ) ( resid  94 and name  HG1 ) 3.57 3.57 0.00 
  peak 198
assign ( resid  77 and name   HN ) ( resid  78 and name   HN ) 4.51 4.51 0.00 
  peak 199
assign ( resid  31 and name HD1+ ) ( resid  34 and name   HN ) 4.22 4.22 0.00 
  peak 202
assign ( resid  68 and name   HN ) ( resid  69 and name   HN ) 2.91 2.91 0.00 
  peak 203
assign ( resid  92 and name   HA ) ( resid  93 and name   HN ) 3.20 3.20 0.00 
  peak 208
assign ( resid  97 and name   HN ) ( resid  97 and name   HB ) 3.03 3.03 0.00 
  peak 209
assign ( resid  95 and name   HN ) ( resid  95 and name  HB+ ) 3.65 3.65 0.00 
  peak 212
assign ( resid  72 and name   HN ) ( resid  72 and name  HE+ ) 4.59 4.59 0.00 
  peak 214
assign ( resid  53 and name   HN ) ( resid  54 and name   HN ) 4.24 4.24 0.00 
  peak 215
assign ( resid  72 and name   HN ) ( resid  73 and name   HN ) 2.91 2.91 0.00 
  peak 217
assign ( resid  30 and name   HA ) ( resid  31 and name   HN ) 2.92 2.92 0.00 
  peak 220
assign ( resid  74 and name   HN ) ( resid  74 and name  HB1 ) 3.85 3.85 0.00 
  peak 223
assign ( resid  32 and name HD21 ) ( resid  33 and name   HN ) 4.57 4.57 0.00 
  peak 224
assign ( resid  71 and name   HG ) ( resid  72 and name   HN ) 3.06 3.06 0.00 
  peak 228
assign ( resid  58 and name   HN ) ( resid  59 and name   HN ) 4.29 4.29 0.00 
  peak 229
assign ( resid  97 and name   HN ) ( resid  97 and name HD1+ ) 3.35 3.35 0.00 
  peak 233
assign ( resid  78 and name  HB1 ) ( resid  79 and name   HN ) 4.48 4.48 0.00 
  peak 234
assign ( resid  67 and name   HN ) ( resid  69 and name   HN ) 3.83 3.83 0.00 
  peak 237
assign ( resid  94 and name   HN ) ( resid  95 and name   HN ) 4.59 4.59 0.00 
  peak 238
assign ( resid  68 and name  HG2 ) ( resid  69 and name   HN ) 4.33 4.33 0.00 
  peak 239
assign ( resid  32 and name   HA ) ( resid  32 and name HD22 ) 4.52 4.52 0.00 
  peak 240
assign ( resid  79 and name HD21 ) ( resid 100 and name   HG ) 5.50 5.50 0.00 
  peak 243
assign ( resid  36 and name   HN ) ( resid  36 and name   HA ) 2.92 2.92 0.00 
  peak 244
assign ( resid  90 and name  HB1 ) ( resid  90 and name HE21 ) 3.94 3.94 0.00 
  peak 245
assign ( resid  30 and name   HN ) ( resid  31 and name   HN ) 4.31 4.31 0.00 
  peak 247
assign ( resid  81 and name   HN ) ( resid  81 and name  HG2 ) 3.80 3.80 0.00 
  peak 248
assign ( resid  50 and name   HN ) ( resid  51 and name   HN ) 4.49 4.49 0.00 
  peak 249
assign ( resid  85 and name   HA ) ( resid  86 and name   HN ) 2.40 2.40 0.00 
  peak 254
assign ( resid  32 and name  HB1 ) ( resid  32 and name HD22 ) 3.81 3.81 0.00 
  peak 255
assign ( resid  32 and name   HN ) ( resid  32 and name  HB1 ) 3.59 3.59 0.00 
  peak 258
assign ( resid  66 and name   HN ) ( resid  66 and name   HG ) 4.07 4.07 0.00 
  peak 259
assign ( resid  57 and name HD21 ) ( resid  58 and name   HN ) 4.57 4.57 0.00 
  peak 261
assign ( resid  53 and name  HB2 ) ( resid  55 and name   HN ) 4.92 4.92 0.00 
  peak 263
assign ( resid  53 and name   HA ) ( resid  55 and name   HN ) 3.64 3.64 0.00 
  peak 264
assign ( resid  35 and name   HN ) ( resid  37 and name   HN ) 4.68 4.68 0.00 
  peak 265
assign ( resid  32 and name   HN ) ( resid  33 and name   HN ) 3.74 3.74 0.00 
  peak 267
assign ( resid  53 and name  HB1 ) ( resid  56 and name   HN ) 3.68 3.68 0.00 
  peak 268
assign ( resid  57 and name   HN ) ( resid  58 and name  HB+ ) 4.61 4.61 0.00 
  peak 272
assign ( resid 100 and name   HA ) ( resid 101 and name   HN ) 3.11 3.11 0.00 
  peak 275
assign ( resid  79 and name   HN ) ( resid  79 and name  HB1 ) 4.10 4.10 0.00 
  peak 276
assign ( resid  94 and name   HN ) ( resid  94 and name  HG2 ) 3.49 3.49 0.00 
  peak 277
assign ( resid  38 and name HG1+ ) ( resid  39 and name   HN ) 3.41 3.41 0.00 
  peak 278
assign ( resid  90 and name   HN ) ( resid  90 and name  HB1 ) 3.41 3.41 0.00 
  peak 280
assign ( resid  35 and name   HN ) ( resid  35 and name HG2+ ) 3.12 3.12 0.00 
  peak 281
assign ( resid  85 and name   HN ) ( resid  85 and name HG2+ ) 3.32 3.32 0.00 
  peak 283
assign ( resid  91 and name   HB ) ( resid  92 and name   HN ) 3.93 3.93 0.00 
  peak 285
assign ( resid  19 and name   HN ) ( resid  19 and name  HB2 ) 3.21 3.21 0.00 
  peak 286
assign ( resid 101 and name   HB ) ( resid 102 and name   HN ) 3.03 3.03 0.00 
  peak 287
assign ( resid  32 and name   HA ) ( resid  35 and name   HN ) 4.39 4.39 0.00 
  peak 292
assign ( resid  20 and name   HN ) ( resid  20 and name  HB1 ) 3.36 3.36 0.00 
  peak 295
assign ( resid  67 and name   HN ) ( resid  68 and name   HN ) 3.18 3.18 0.00 
  peak 300
assign ( resid  82 and name   HA ) ( resid  83 and name   HN ) 2.85 2.85 0.00 
  peak 302
assign ( resid  76 and name  HA1 ) ( resid  77 and name   HN ) 3.08 3.08 0.00 
  peak 303
assign ( resid  68 and name   HN ) ( resid  68 and name  HG2 ) 3.00 3.00 0.00 
  peak 304
assign ( resid  53 and name  HB2 ) ( resid  54 and name   HN ) 4.78 4.78 0.00 
  peak 306
assign ( resid  31 and name   HA ) ( resid  34 and name   HN ) 3.56 3.56 0.00 
  peak 307
assign ( resid  95 and name   HN ) ( resid  96 and name   HN ) 4.24 4.24 0.00 
  peak 309
assign ( resid  71 and name   HN ) ( resid  73 and name   HN ) 3.79 3.79 0.00 
  peak 310
assign ( resid  53 and name   HA ) ( resid  54 and name   HN ) 3.22 3.22 0.00 
  peak 311
assign ( resid  54 and name HG2+ ) ( resid  56 and name   HN ) 4.83 4.83 0.00 
  peak 314
assign ( resid  71 and name   HN ) ( resid  71 and name  HB2 ) 3.20 3.20 0.00 
  peak 317
assign ( resid  90 and name  HB1 ) ( resid  90 and name HE22 ) 4.20 4.20 0.00 
  peak 318
assign ( resid  30 and name  HB1 ) ( resid  33 and name   HN ) 3.17 3.17 0.00 
  peak 321
assign ( resid  33 and name   HN ) ( resid  33 and name  HB2 ) 3.73 3.73 0.00 
  peak 321
assign ( resid  89 and name   HA ) ( resid  89 and name HD22 ) 5.00 5.00 0.00 
  peak 322
assign ( resid  68 and name  HG1 ) ( resid  69 and name   HN ) 4.37 4.37 0.00 
  peak 323
assign ( resid  38 and name HG1+ ) ( resid  42 and name   HN ) 3.89 3.89 0.00 
  peak 324
assign ( resid  97 and name   HN ) ( resid  97 and name HG12 ) 3.70 3.70 0.00 
  peak 325
assign ( resid  50 and name   HN ) ( resid  50 and name  HB1 ) 3.67 3.67 0.00 
  peak 328
assign ( resid  29 and name  HG+ ) ( resid  30 and name   HN ) 3.23 3.23 0.00 
  peak 329
assign ( resid 101 and name   HN ) ( resid 101 and name HG2+ ) 3.83 3.83 0.00 
  peak 330
assign ( resid  59 and name   HN ) ( resid  59 and name  HB2 ) 2.81 2.81 0.00 
  peak 331
assign ( resid  69 and name   HN ) ( resid  69 and name  HB2 ) 2.93 2.93 0.00 
  peak 332
assign ( resid  86 and name  HG+ ) ( resid  92 and name   HN ) 3.52 3.52 0.00 
  peak 333
assign ( resid  95 and name  HG2 ) ( resid  96 and name   HN ) 3.59 3.59 0.00 
  peak 334
assign ( resid  79 and name  HB2 ) ( resid  79 and name HD22 ) 3.50 3.50 0.00 
  peak 338
assign ( resid  85 and name   HN ) ( resid  85 and name   HB ) 3.89 3.89 0.00 
  peak 342
assign ( resid  92 and name HG2+ ) ( resid  93 and name   HN ) 3.72 3.72 0.00 
  peak 347
assign ( resid  92 and name HD1+ ) ( resid  93 and name   HN ) 3.98 3.98 0.00 
  peak 347
assign ( resid  92 and name   HB ) ( resid  93 and name   HN ) 3.84 3.84 0.00 
  peak 349
assign ( resid  79 and name  HB2 ) ( resid  79 and name HD21 ) 3.07 3.07 0.00 
  peak 350
assign ( resid  72 and name  HB2 ) ( resid  73 and name   HN ) 3.18 3.18 0.00 
  peak 351
assign ( resid  55 and name   HN ) ( resid  57 and name   HN ) 3.59 3.59 0.00 
  peak 352
assign ( resid  56 and name   HN ) ( resid  57 and name   HN ) 2.82 2.82 0.00 
  peak 354
assign ( resid  41 and name  HG+ ) ( resid  42 and name   HN ) 4.11 4.11 0.00 
  peak 355
assign ( resid  66 and name HD2+ ) ( resid  67 and name   HN ) 4.55 4.55 0.00 
  peak 356
assign ( resid  97 and name HG2+ ) ( resid  98 and name   HN ) 2.70 2.70 0.00 
  peak 359
assign ( resid  55 and name   HN ) ( resid  56 and name   HN ) 2.99 2.99 0.00 
  peak 360
assign ( resid  37 and name   HA ) ( resid  38 and name   HN ) 3.53 3.53 0.00 
  peak 361
assign ( resid  21 and name   HN ) ( resid  21 and name  HB1 ) 3.64 3.64 0.00 
  peak 362
assign ( resid  84 and name  HB2 ) ( resid  85 and name   HN ) 4.66 4.66 0.00 
  peak 363
assign ( resid  29 and name   HA ) ( resid  30 and name   HN ) 3.57 3.57 0.00 
  peak 364
assign ( resid  59 and name HD1+ ) ( resid  90 and name HE22 ) 3.65 3.65 0.00 
  peak 365
assign ( resid  20 and name   HN ) ( resid  20 and name  HB2 ) 3.36 3.36 0.00 
  peak 366
assign ( resid  38 and name   HB ) ( resid  39 and name   HN ) 3.25 3.25 0.00 
  peak 370
assign ( resid  13 and name   HN ) ( resid  14 and name   HN ) 4.24 4.24 0.00 
  peak 372
assign ( resid  90 and name  HG+ ) ( resid  90 and name HE21 ) 2.89 2.89 0.00 
  peak 373
assign ( resid  31 and name   HN ) ( resid  32 and name   HN ) 4.40 4.40 0.00 
  peak 377
assign ( resid  35 and name   HA ) ( resid  36 and name   HN ) 3.54 3.54 0.00 
  peak 380
assign ( resid  33 and name   HA ) ( resid  36 and name   HN ) 3.40 3.40 0.00 
  peak 384
assign ( resid  93 and name   HN ) ( resid  94 and name   HN ) 4.74 4.74 0.00 
  peak 386
assign ( resid  57 and name   HN ) ( resid  57 and name   HA ) 2.45 2.45 0.00 
  peak 391
assign ( resid  35 and name   HN ) ( resid  36 and name   HN ) 3.19 3.19 0.00 
  peak 392
assign ( resid  54 and name   HA ) ( resid  55 and name   HN ) 3.57 3.57 0.00 
  peak 393
assign ( resid  80 and name   HA ) ( resid  81 and name   HN ) 2.67 2.67 0.00 
  peak 394
assign ( resid  31 and name   HN ) ( resid  31 and name  HB2 ) 3.35 3.35 0.00 
  peak 395
assign ( resid  36 and name   HA ) ( resid  38 and name   HN ) 4.33 4.33 0.00 
  peak 398
assign ( resid  37 and name   HN ) ( resid  39 and name   HN ) 4.65 4.65 0.00 
  peak 400
assign ( resid  70 and name   HA ) ( resid  72 and name   HN ) 4.48 4.48 0.00 
  peak 403
assign ( resid  64 and name  HB+ ) ( resid  67 and name   HN ) 4.84 4.84 0.00 
  peak 410
assign ( resid  32 and name   HN ) ( resid  34 and name   HN ) 4.13 4.13 0.00 
  peak 411
assign ( resid  84 and name   HN ) ( resid  84 and name  HG+ ) 4.14 4.14 0.00 
  peak 412
assign ( resid  97 and name   HA ) ( resid  98 and name   HN ) 2.52 2.52 0.00 
  peak 413
assign ( resid  36 and name   HA ) ( resid  40 and name   HN ) 4.66 4.66 0.00 
  peak 415
assign ( resid  84 and name   HN ) ( resid  84 and name  HB1 ) 3.83 3.83 0.00 
  peak 417
assign ( resid  78 and name   HN ) ( resid  79 and name   HN ) 3.84 3.84 0.00 
  peak 418
assign ( resid  68 and name  HB2 ) ( resid  69 and name   HN ) 3.50 3.50 0.00 
  peak 421
assign ( resid  94 and name  HB+ ) ( resid  95 and name   HN ) 3.80 3.80 0.00 
  peak 425
assign ( resid  77 and name  HB+ ) ( resid  78 and name   HN ) 3.19 3.19 0.00 
  peak 426
assign ( resid 100 and name HD1+ ) ( resid 101 and name   HN ) 4.91 4.91 0.00 
  peak 427
assign ( resid  92 and name   HN ) ( resid  92 and name HG11 ) 3.39 3.39 0.00 
  peak 428
assign ( resid  99 and name   HN ) ( resid 100 and name   HN ) 3.17 3.17 0.00 
  peak 429
assign ( resid  56 and name  HB2 ) ( resid  58 and name   HN ) 3.65 3.65 0.00 
  peak 430
assign ( resid  50 and name   HA ) ( resid  51 and name   HN ) 2.97 2.97 0.00 
  peak 434
assign ( resid  87 and name   HN ) ( resid  87 and name  HG+ ) 3.77 3.77 0.00 
  peak 437
assign ( resid  18 and name   HN ) ( resid  19 and name   HN ) 4.41 4.41 0.00 
  peak 438
assign ( resid  37 and name   HA ) ( resid  40 and name   HN ) 3.76 3.76 0.00 
  peak 441
assign ( resid  68 and name   HN ) ( resid  68 and name  HG1 ) 3.09 3.09 0.00 
  peak 442
assign ( resid  90 and name  HG+ ) ( resid  90 and name HE22 ) 3.32 3.32 0.00 
  peak 443
assign ( resid  69 and name   HN ) ( resid  70 and name   HN ) 3.16 3.16 0.00 
  peak 446
assign ( resid  69 and name  HB1 ) ( resid  70 and name   HN ) 3.35 3.35 0.00 
  peak 447
assign ( resid  98 and name   HN ) ( resid  98 and name HD22 ) 3.86 3.86 0.00 
  peak 456
assign ( resid  81 and name   HN ) ( resid  81 and name  HB1 ) 3.11 3.11 0.00 
  peak 457
assign ( resid  71 and name  HB1 ) ( resid  72 and name   HN ) 2.92 2.92 0.00 
  peak 459
assign ( resid  54 and name   HB ) ( resid  55 and name   HN ) 3.21 3.21 0.00 
  peak 460
assign ( resid  31 and name  HB2 ) ( resid  32 and name   HN ) 4.18 4.18 0.00 
  peak 465
assign ( resid  21 and name   HN ) ( resid  21 and name  HB2 ) 3.70 3.70 0.00 
  peak 467
assign ( resid  38 and name   HA ) ( resid  41 and name   HN ) 3.69 3.69 0.00 
  peak 468
assign ( resid  29 and name  HB2 ) ( resid  30 and name   HN ) 3.92 3.92 0.00 
  peak 471
assign ( resid  71 and name   HN ) ( resid  71 and name  HB1 ) 2.77 2.77 0.00 
  peak 472
assign ( resid 101 and name   HN ) ( resid 101 and name   HB ) 3.31 3.31 0.00 
  peak 473
assign ( resid  59 and name   HN ) ( resid  60 and name HG2+ ) 5.05 5.05 0.00 
  peak 474
assign ( resid  78 and name   HN ) ( resid  78 and name  HB1 ) 3.18 3.18 0.00 
  peak 476
assign ( resid  91 and name   HN ) ( resid  91 and name HG2+ ) 3.46 3.46 0.00 
  peak 477
assign ( resid  42 and name   HN ) ( resid  42 and name  HB2 ) 3.43 3.43 0.00 
  peak 479
assign ( resid  40 and name  HB2 ) ( resid  41 and name   HN ) 3.86 3.86 0.00 
  peak 481
assign ( resid  53 and name   HN ) ( resid  53 and name  HB1 ) 3.46 3.46 0.00 
  peak 482
assign ( resid  56 and name   HA ) ( resid  57 and name   HN ) 3.40 3.40 0.00 
  peak 488
assign ( resid  53 and name  HB1 ) ( resid  55 and name   HN ) 4.52 4.52 0.00 
  peak 489
assign ( resid  22 and name   HN ) ( resid  59 and name   HN ) 4.81 4.81 0.00 
  peak 490
assign ( resid 100 and name   HN ) ( resid 101 and name   HN ) 3.19 3.19 0.00 
  peak 491
assign ( resid  54 and name   HN ) ( resid  54 and name   HB ) 3.49 3.49 0.00 
  peak 492
assign ( resid  45 and name   HN ) ( resid  45 and name HG1+ ) 3.97 3.97 0.00 
  peak 493
assign ( resid  56 and name   HN ) ( resid  56 and name  HB1 ) 3.80 3.80 0.00 
  peak 494
assign ( resid  99 and name  HB1 ) ( resid 100 and name   HN ) 2.96 2.96 0.00 
  peak 495
assign ( resid  33 and name   HA ) ( resid  35 and name   HN ) 4.74 4.74 0.00 
  peak 496
assign ( resid  95 and name   HN ) ( resid  95 and name  HG1 ) 4.52 4.52 0.00 
  peak 497
assign ( resid  57 and name   HN ) ( resid  58 and name   HN ) 3.15 3.15 0.00 
  peak 498
assign ( resid  38 and name   HN ) ( resid  39 and name   HN ) 3.41 3.41 0.00 
  peak 501
assign ( resid  50 and name  HB1 ) ( resid  51 and name   HN ) 3.73 3.73 0.00 
  peak 504
assign ( resid  28 and name   HN ) ( resid  28 and name HG2+ ) 2.70 2.70 0.00 
  peak 505
assign ( resid  55 and name   HN ) ( resid  55 and name  HG+ ) 2.74 2.74 0.00 
  peak 506
assign ( resid  64 and name  HB+ ) ( resid  65 and name   HN ) 3.41 3.41 0.00 
  peak 507
assign ( resid  36 and name   HN ) ( resid  36 and name  HB2 ) 3.10 3.10 0.00 
  peak 510
assign ( resid  67 and name  HB2 ) ( resid  68 and name   HN ) 3.37 3.37 0.00 
  peak 511
assign ( resid  53 and name   HN ) ( resid  60 and name HG2+ ) 4.15 4.15 0.00 
  peak 514
assign ( resid  28 and name   HN ) ( resid  28 and name   HB ) 3.48 3.48 0.00 
  peak 516
assign ( resid  72 and name  HG1 ) ( resid  73 and name   HN ) 3.80 3.80 0.00 
  peak 517
assign ( resid  50 and name  HB2 ) ( resid  51 and name   HN ) 3.73 3.73 0.00 
  peak 518
assign ( resid  31 and name   HN ) ( resid  31 and name HD2+ ) 3.52 3.52 0.00 
  peak 519
assign ( resid  33 and name  HB2 ) ( resid  34 and name   HN ) 4.04 4.04 0.00 
  peak 520
assign ( resid  83 and name   HA ) ( resid  84 and name   HN ) 3.17 3.17 0.00 
  peak 521
assign ( resid  53 and name  HB1 ) ( resid  54 and name   HN ) 4.59 4.59 0.00 
  peak 522
assign ( resid  39 and name   HN ) ( resid  39 and name  HB2 ) 3.51 3.51 0.00 
  peak 523
assign ( resid  58 and name   HN ) ( resid  58 and name  HB+ ) 3.18 3.18 0.00 
  peak 525
assign ( resid  98 and name   HA ) ( resid  99 and name   HN ) 3.23 3.23 0.00 
  peak 527
assign ( resid  80 and name  HB1 ) ( resid  81 and name   HN ) 3.21 3.21 0.00 
  peak 528
assign ( resid  52 and name   HA ) ( resid  53 and name   HN ) 2.80 2.80 0.00 
  peak 530
assign ( resid  51 and name   HN ) ( resid  51 and name  HB+ ) 3.59 3.59 0.00 
  peak 532
assign ( resid  40 and name   HN ) ( resid  42 and name   HN ) 3.99 3.99 0.00 
  peak 533
assign ( resid  79 and name   HN ) ( resid  79 and name  HB2 ) 3.48 3.48 0.00 
  peak 534
assign ( resid  81 and name   HN ) ( resid  81 and name  HD+ ) 4.07 4.07 0.00 
  peak 535
assign ( resid  59 and name   HN ) ( resid  60 and name   HN ) 4.80 4.80 0.00 
  peak 536
assign ( resid  75 and name  HB2 ) ( resid  76 and name   HN ) 4.33 4.33 0.00 
  peak 537
assign ( resid  94 and name   HA ) ( resid  95 and name   HN ) 3.18 3.18 0.00 
  peak 540
assign ( resid  82 and name   HN ) ( resid  83 and name   HN ) 4.46 4.46 0.00 
  peak 541
assign ( resid  54 and name   HA ) ( resid  57 and name HD21 ) 4.37 4.37 0.00 
  peak 542
assign ( resid  37 and name   HN ) ( resid  37 and name  HB1 ) 3.77 3.77 0.00 
  peak 544
assign ( resid  40 and name   HN ) ( resid  41 and name   HN ) 2.95 2.95 0.00 
  peak 545
assign ( resid  30 and name  HB1 ) ( resid  31 and name   HN ) 4.00 4.00 0.00 
  peak 549
assign ( resid  90 and name  HG+ ) ( resid  91 and name   HN ) 3.23 3.23 0.00 
  peak 552
assign ( resid  54 and name   HN ) ( resid  55 and name   HN ) 3.28 3.28 0.00 
  peak 554
assign ( resid  54 and name   HN ) ( resid  54 and name HG2+ ) 2.97 2.97 0.00 
  peak 561
assign ( resid  17 and name  HA1 ) ( resid  18 and name   HN ) 3.24 3.24 0.00 
  peak 563
assign ( resid  73 and name   HN ) ( resid  75 and name  HD1 ) 4.30 4.30 0.00 
  peak 566
assign ( resid  27 and name  HG1 ) ( resid  28 and name   HN ) 3.28 3.28 0.00 
  peak 567
assign ( resid  64 and name   HA ) ( resid  68 and name   HN ) 3.81 3.81 0.00 
  peak 568
assign ( resid  58 and name   HA ) ( resid  59 and name   HN ) 2.50 2.50 0.00 
  peak 569
assign ( resid  84 and name  HG+ ) ( resid  85 and name   HN ) 4.71 4.71 0.00 
  peak 571
assign ( resid  39 and name   HA ) ( resid  40 and name   HN ) 3.51 3.51 0.00 
  peak 572
assign ( resid  74 and name   HN ) ( resid  75 and name  HD1 ) 3.56 3.56 0.00 
  peak 573
assign ( resid  73 and name   HN ) ( resid  73 and name  HB2 ) 3.13 3.13 0.00 
  peak 574
assign ( resid  69 and name   HA ) ( resid  72 and name   HN ) 3.74 3.74 0.00 
  peak 576
assign ( resid  39 and name  HB1 ) ( resid  40 and name   HN ) 4.23 4.23 0.00 
  peak 577
assign ( resid  81 and name   HN ) ( resid  81 and name  HG1 ) 3.91 3.91 0.00 
  peak 578
assign ( resid  36 and name  HB1 ) ( resid  37 and name   HN ) 4.04 4.04 0.00 
  peak 580
assign ( resid  32 and name   HA ) ( resid  32 and name HD21 ) 4.53 4.53 0.00 
  peak 582
assign ( resid  31 and name   HN ) ( resid  33 and name   HN ) 4.59 4.59 0.00 
  peak 583
assign ( resid  73 and name  HB2 ) ( resid  74 and name   HN ) 3.40 3.40 0.00 
  peak 585
assign ( resid  97 and name   HN ) ( resid  97 and name HG11 ) 3.33 3.33 0.00 
  peak 586
assign ( resid  75 and name  HD1 ) ( resid  76 and name   HN ) 5.50 5.50 0.00 
  peak 587
assign ( resid  90 and name   HN ) ( resid  90 and name   HA ) 2.92 2.92 0.00 
  peak 593
assign ( resid  73 and name   HN ) ( resid  73 and name  HB1 ) 3.65 3.65 0.00 
  peak 595
assign ( resid  98 and name   HN ) ( resid  98 and name HD21 ) 3.79 3.79 0.00 
  peak 596
assign ( resid  69 and name   HA ) ( resid  71 and name   HN ) 4.02 4.02 0.00 
  peak 597
assign ( resid  89 and name  HB2 ) ( resid  89 and name HD22 ) 3.82 3.82 0.00 
  peak 600
assign ( resid  73 and name  HB1 ) ( resid  74 and name   HN ) 3.35 3.35 0.00 
  peak 602
assign ( resid  73 and name   HN ) ( resid  74 and name   HN ) 2.84 2.84 0.00 
  peak 603
assign ( resid  69 and name  HB2 ) ( resid  70 and name   HN ) 3.70 3.70 0.00 
  peak 604
assign ( resid  36 and name   HA ) ( resid  39 and name   HN ) 3.87 3.87 0.00 
  peak 606
assign ( resid  40 and name   HN ) ( resid  40 and name  HB2 ) 2.98 2.98 0.00 
  peak 611
assign ( resid  64 and name   HA ) ( resid  67 and name   HN ) 3.26 3.26 0.00 
  peak 612
assign ( resid  31 and name HD2+ ) ( resid  34 and name   HN ) 4.92 4.92 0.00 
  peak 614
assign ( resid  31 and name   HN ) ( resid  31 and name   HG ) 4.51 4.51 0.00 
  peak 617
assign ( resid 101 and name   HN ) ( resid 102 and name   HN ) 3.01 3.01 0.00 
  peak 619
assign ( resid  99 and name   HN ) ( resid  99 and name  HB2 ) 3.10 3.10 0.00 
  peak 625
assign ( resid 100 and name   HN ) ( resid 100 and name HD1+ ) 3.34 3.34 0.00 
  peak 630
assign ( resid 100 and name   HN ) ( resid 101 and name   HA ) 4.81 4.81 0.00 
  peak 632
assign ( resid  98 and name   HN ) ( resid  99 and name  HB2 ) 4.03 4.03 0.00 
  peak 633
assign ( resid  98 and name   HN ) ( resid  99 and name   HN ) 3.60 3.60 0.00 
  peak 634
assign ( resid  97 and name HG2+ ) ( resid  98 and name HD21 ) 3.77 3.77 0.00 
  peak 635
assign ( resid  97 and name HG2+ ) ( resid  98 and name HD22 ) 3.67 3.67 0.00 
  peak 636
assign ( resid  98 and name HD21 ) ( resid  99 and name  HB2 ) 3.95 3.95 0.00 
  peak 639
assign ( resid  79 and name  HB1 ) ( resid  98 and name HD22 ) 4.22 4.22 0.00 
  peak 640
assign ( resid  95 and name   HN ) ( resid  96 and name HG2+ ) 5.02 5.02 0.00 
  peak 645
assign ( resid  95 and name   HN ) ( resid  96 and name   HA ) 4.99 4.99 0.00 
  peak 646
assign ( resid  94 and name   HN ) ( resid  95 and name  HB+ ) 5.50 5.50 0.00 
  peak 647
assign ( resid  93 and name   HN ) ( resid  93 and name  HB2 ) 3.88 3.88 0.00 
  peak 649
assign ( resid  92 and name HG11 ) ( resid  93 and name   HN ) 4.66 4.66 0.00 
  peak 650
assign ( resid  91 and name   HN ) ( resid  92 and name HG11 ) 4.85 4.85 0.00 
  peak 653
assign ( resid  90 and name  HB2 ) ( resid  91 and name   HN ) 3.15 3.15 0.00 
  peak 658
assign ( resid  59 and name HD1+ ) ( resid  90 and name HE21 ) 3.93 3.93 0.00 
  peak 661
assign ( resid  89 and name  HB1 ) ( resid  90 and name HE22 ) 4.07 4.07 0.00 
  peak 667
assign ( resid  89 and name  HB2 ) ( resid  90 and name HE21 ) 4.24 4.24 0.00 
  peak 668
assign ( resid  89 and name  HB1 ) ( resid  89 and name HD22 ) 4.07 4.07 0.00 
  peak 671
assign ( resid  86 and name   HN ) ( resid  87 and name  HG+ ) 4.09 4.09 0.00 
  peak 674
assign ( resid  86 and name   HN ) ( resid  91 and name   HA ) 3.91 3.91 0.00 
  peak 676
assign ( resid  85 and name   HN ) ( resid  93 and name   HA ) 4.05 4.05 0.00 
  peak 677
assign ( resid  92 and name   HN ) ( resid  92 and name HD1+ ) 2.95 2.95 0.00 
  peak 680
assign ( resid  81 and name  HG1 ) ( resid  82 and name   HN ) 3.69 3.69 0.00 
  peak 683
assign ( resid  82 and name   HN ) ( resid  82 and name   HG ) 2.87 2.87 0.00 
  peak 686
assign ( resid  81 and name  HE+ ) ( resid  82 and name   HN ) 4.07 4.07 0.00 
  peak 687
assign ( resid  80 and name   HN ) ( resid  80 and name  HB1 ) 3.45 3.45 0.00 
  peak 689
assign ( resid  80 and name   HN ) ( resid  80 and name  HB2 ) 2.90 2.90 0.00 
  peak 690
assign ( resid  81 and name   HN ) ( resid  82 and name   HA ) 5.18 5.18 0.00 
  peak 692
assign ( resid  77 and name  HB+ ) ( resid  79 and name HD22 ) 3.90 3.90 0.00 
  peak 693
assign ( resid  77 and name  HB+ ) ( resid  79 and name HD21 ) 3.71 3.71 0.00 
  peak 694
assign ( resid  77 and name  HB+ ) ( resid  79 and name   HN ) 4.73 4.73 0.00 
  peak 695
assign ( resid  78 and name  HB2 ) ( resid  79 and name   HN ) 5.18 5.18 0.00 
  peak 695
assign ( resid  78 and name  HG+ ) ( resid  79 and name HD22 ) 5.37 5.37 0.00 
  peak 698
assign ( resid  78 and name  HG+ ) ( resid  79 and name   HN ) 4.10 4.10 0.00 
  peak 700
assign ( resid  78 and name   HN ) ( resid  78 and name  HG+ ) 4.18 4.18 0.00 
  peak 701
assign ( resid  78 and name   HN ) ( resid  79 and name  HB2 ) 4.88 4.88 0.00 
  peak 703
assign ( resid  77 and name   HN ) ( resid  78 and name   HA ) 4.79 4.79 0.00 
  peak 705
assign ( resid  76 and name   HN ) ( resid  77 and name   HA ) 4.69 4.69 0.00 
  peak 706
assign ( resid  69 and name  HB1 ) ( resid  74 and name   HN ) 4.50 4.50 0.00 
  peak 709
assign ( resid  70 and name  HB+ ) ( resid  74 and name   HN ) 4.16 4.16 0.00 
  peak 710
assign ( resid  74 and name   HN ) ( resid  74 and name  HB2 ) 3.23 3.23 0.00 
  peak 711
assign ( resid  72 and name   HN ) ( resid  72 and name  HG2 ) 3.19 3.19 0.00 
  peak 714
assign ( resid  70 and name   HN ) ( resid  71 and name  HB1 ) 4.68 4.68 0.00 
  peak 715
assign ( resid  71 and name   HN ) ( resid  72 and name  HG1 ) 4.52 4.52 0.00 
  peak 716
assign ( resid  67 and name  HB1 ) ( resid  68 and name   HN ) 3.03 3.03 0.00 
  peak 721
assign ( resid  60 and name HG2+ ) ( resid  66 and name   HN ) 3.34 3.34 0.00 
  peak 723
assign ( resid  66 and name   HN ) ( resid  69 and name  HB2 ) 4.48 4.48 0.00 
  peak 725
assign ( resid  66 and name   HN ) ( resid  67 and name  HB2 ) 4.26 4.26 0.00 
  peak 726
assign ( resid  65 and name   HN ) ( resid  66 and name HD2+ ) 4.66 4.66 0.00 
  peak 730
assign ( resid  65 and name   HN ) ( resid  66 and name HD1+ ) 4.66 4.66 0.00 
  peak 731
assign ( resid  15 and name   HB ) ( resid  65 and name   HN ) 4.94 4.94 0.00 
  peak 733
assign ( resid  14 and name  HE+ ) ( resid  65 and name   HN ) 4.47 4.47 0.00 
  peak 737
assign ( resid  60 and name   HN ) ( resid  60 and name HG2+ ) 3.07 3.07 0.00 
  peak 738
assign ( resid  59 and name   HA ) ( resid  60 and name   HN ) 2.81 2.81 0.00 
  peak 739
assign ( resid  22 and name  HB2 ) ( resid  60 and name   HN ) 3.26 3.26 0.00 
  peak 741
assign ( resid  59 and name  HB1 ) ( resid  60 and name   HN ) 3.35 3.35 0.00 
  peak 742
assign ( resid  59 and name HD1+ ) ( resid  60 and name   HN ) 4.72 4.72 0.00 
  peak 744
assign ( resid  59 and name HD2+ ) ( resid  60 and name   HN ) 3.26 3.26 0.00 
  peak 745
assign ( resid  59 and name   HN ) ( resid  59 and name   HG ) 3.60 3.60 0.00 
  peak 748
assign ( resid  53 and name  HB1 ) ( resid  58 and name   HN ) 3.41 3.41 0.00 
  peak 752
assign ( resid  54 and name   HA ) ( resid  58 and name   HN ) 4.97 4.97 0.00 
  peak 753
assign ( resid  58 and name   HN ) ( resid  59 and name   HA ) 4.91 4.91 0.00 
  peak 755
assign ( resid  57 and name   HA ) ( resid  57 and name HD21 ) 4.03 4.03 0.00 
  peak 762
assign ( resid  57 and name   HA ) ( resid  57 and name HD22 ) 3.89 3.89 0.00 
  peak 763
assign ( resid  55 and name  HB2 ) ( resid  56 and name   HN ) 3.03 3.03 0.00 
  peak 766
assign ( resid  52 and name   HN ) ( resid  92 and name HD1+ ) 3.34 3.34 0.00 
  peak 772
assign ( resid  52 and name   HN ) ( resid  52 and name HG1+ ) 2.87 2.87 0.00 
  peak 773
assign ( resid  54 and name HG2+ ) ( resid  55 and name   HN ) 3.39 3.39 0.00 
  peak 775
assign ( resid  55 and name   HN ) ( resid  55 and name  HB2 ) 2.78 2.78 0.00 
  peak 776
assign ( resid  55 and name   HN ) ( resid  56 and name  HB2 ) 5.17 5.17 0.00 
  peak 778
assign ( resid  54 and name   HN ) ( resid  54 and name HG1+ ) 3.22 3.22 0.00 
  peak 780
assign ( resid  54 and name   HN ) ( resid  96 and name HG2+ ) 3.87 3.87 0.00 
  peak 781
assign ( resid  52 and name   HN ) ( resid  52 and name   HB ) 3.29 3.29 0.00 
  peak 792
assign ( resid  51 and name  HB+ ) ( resid  52 and name   HN ) 3.37 3.37 0.00 
  peak 794
assign ( resid  51 and name   HA ) ( resid  52 and name   HN ) 2.75 2.75 0.00 
  peak 795
assign ( resid  50 and name   HN ) ( resid  92 and name   HB ) 3.85 3.85 0.00 
  peak 797
assign ( resid  67 and name   HN ) ( resid  67 and name  HB2 ) 2.74 2.74 0.00 
  peak 799
assign ( resid  49 and name   HA ) ( resid  50 and name   HN ) 3.00 3.00 0.00 
  peak 802
assign ( resid  41 and name   HN ) ( resid  43 and name  HD1 ) 3.96 3.96 0.00 
  peak 807
assign ( resid  41 and name   HN ) ( resid  42 and name   HA ) 5.06 5.06 0.00 
  peak 808
assign ( resid  39 and name   HN ) ( resid  40 and name  HB1 ) 5.18 5.18 0.00 
  peak 811
assign ( resid  39 and name   HN ) ( resid  40 and name  HB2 ) 5.18 5.18 0.00 
  peak 812
assign ( resid  39 and name   HN ) ( resid  40 and name   HA ) 5.31 5.31 0.00 
  peak 813
assign ( resid  38 and name HG2+ ) ( resid  39 and name   HN ) 4.11 4.11 0.00 
  peak 814
assign ( resid  37 and name   HN ) ( resid  37 and name  HB2 ) 3.81 3.81 0.00 
  peak 815
assign ( resid  36 and name  HB2 ) ( resid  37 and name   HN ) 4.08 4.08 0.00 
  peak 816
assign ( resid  37 and name  HB1 ) ( resid  38 and name   HN ) 3.96 3.96 0.00 
  peak 819
assign ( resid  33 and name   HN ) ( resid  33 and name  HG1 ) 3.77 3.77 0.00 
  peak 824
assign ( resid  30 and name  HB2 ) ( resid  33 and name   HN ) 3.75 3.75 0.00 
  peak 826
assign ( resid  34 and name   HN ) ( resid  34 and name  HB+ ) 2.95 2.95 0.00 
  peak 828
assign ( resid  31 and name HD1+ ) ( resid  32 and name   HN ) 4.41 4.41 0.00 
  peak 832
assign ( resid  31 and name   HN ) ( resid  34 and name  HB+ ) 4.22 4.22 0.00 
  peak 833
assign ( resid  30 and name   HN ) ( resid  30 and name  HB2 ) 3.01 3.01 0.00 
  peak 834
assign ( resid  29 and name  HD2 ) ( resid  30 and name   HN ) 3.52 3.52 0.00 
  peak 837
assign ( resid  28 and name   HN ) ( resid  29 and name  HD1 ) 4.48 4.48 0.00 
  peak 841
assign ( resid  27 and name  HG2 ) ( resid  28 and name   HN ) 3.41 3.41 0.00 
  peak 843
assign ( resid  21 and name  HB2 ) ( resid  24 and name   HN ) 3.06 3.06 0.00 
  peak 846
assign ( resid  23 and name   HA ) ( resid  24 and name   HN ) 3.19 3.19 0.00 
  peak 847
assign ( resid  23 and name   HN ) ( resid  23 and name  HB+ ) 3.46 3.46 0.00 
  peak 850
assign ( resid  21 and name  HB2 ) ( resid  23 and name   HN ) 4.08 4.08 0.00 
  peak 853
assign ( resid  21 and name  HB1 ) ( resid  23 and name   HN ) 4.21 4.21 0.00 
  peak 855
assign ( resid  20 and name   HA ) ( resid  21 and name   HN ) 3.37 3.37 0.00 
  peak 856
assign ( resid  15 and name   HA ) ( resid  16 and name   HN ) 3.13 3.13 0.00 
  peak 858
assign ( resid  16 and name   HN ) ( resid  16 and name  HB1 ) 3.93 3.93 0.00 
  peak 861
assign ( resid  15 and name HG2+ ) ( resid  16 and name   HN ) 3.75 3.75 0.00 
  peak 862
assign ( resid  15 and name   HN ) ( resid  15 and name HG1+ ) 4.33 4.33 0.00 
  peak 864
assign ( resid 100 and name   HN ) ( resid 100 and name   HG ) 2.64 2.64 0.00 
  peak 865
assign ( resid  52 and name HG1+ ) ( resid  95 and name   HN ) 3.57 3.57 0.00 
  peak 866
assign ( resid  54 and name HG1+ ) ( resid  95 and name   HN ) 4.19 4.19 0.00 
  peak 868
assign ( resid  54 and name HG2+ ) ( resid  95 and name   HN ) 3.46 3.46 0.00 
  peak 869
assign ( resid  53 and name   HA ) ( resid  95 and name   HN ) 3.81 3.81 0.00 
  peak 871
assign ( resid  54 and name   HN ) ( resid  96 and name   HA ) 4.26 4.26 0.00 
  peak 873
assign ( resid  54 and name   HN ) ( resid  94 and name   HA ) 4.01 4.01 0.00 
  peak 874
assign ( resid  19 and name  HE+ ) ( resid  31 and name   HN ) 3.48 3.48 0.00 
  peak 876
assign ( resid  53 and name   HN ) ( resid  58 and name  HE+ ) 4.11 4.11 0.00 
  peak 881
assign ( resid  53 and name   HN ) ( resid  58 and name  HD+ ) 3.43 3.43 0.00 
  peak 882
assign ( resid  53 and name   HN ) ( resid  57 and name   HA ) 4.58 4.58 0.00 
  peak 885
assign ( resid  53 and name   HN ) ( resid  56 and name  HB2 ) 4.93 4.93 0.00 
  peak 886
assign ( resid  53 and name   HN ) ( resid  58 and name  HB+ ) 4.40 4.40 0.00 
  peak 890
assign ( resid  54 and name   HN ) ( resid  95 and name   HN ) 4.10 4.10 0.00 
  peak 895
assign ( resid  92 and name HD1+ ) ( resid  95 and name   HN ) 5.35 5.35 0.00 
  peak 896
assign ( resid 100 and name   HA ) ( resid 102 and name   HN ) 3.48 3.48 0.00 
  peak 900
assign ( resid  51 and name   HA ) ( resid  93 and name   HN ) 3.87 3.87 0.00 
  peak 913
assign ( resid  59 and name HD2+ ) ( resid  93 and name   HN ) 4.35 4.35 0.00 
  peak 914
assign ( resid  98 and name   HN ) ( resid  99 and name   HA ) 5.10 5.10 0.00 
  peak 924
assign ( resid  51 and name  HD+ ) ( resid  66 and name   HN ) 5.13 5.13 0.00 
  peak 942
assign ( resid  51 and name  HB+ ) ( resid  66 and name   HN ) 4.69 4.69 0.00 
  peak 948
assign ( resid  64 and name  HB+ ) ( resid  66 and name   HN ) 4.71 4.71 0.00 
  peak 950
assign ( resid  78 and name   HN ) ( resid  79 and name HD22 ) 4.11 4.11 0.00 
  peak 953
assign ( resid  78 and name   HN ) ( resid  79 and name   HA ) 5.20 5.20 0.00 
  peak 954
assign ( resid  98 and name HD21 ) ( resid 100 and name   HN ) 4.46 4.46 0.00 
  peak 956
assign ( resid  74 and name  HB1 ) ( resid 100 and name   HN ) 5.35 5.35 0.00 
  peak 961
assign ( resid  70 and name  HB+ ) ( resid 100 and name   HN ) 5.23 5.23 0.00 
  peak 962
assign ( resid  97 and name HG2+ ) ( resid 100 and name   HN ) 3.99 3.99 0.00 
  peak 971
assign ( resid  85 and name   HN ) ( resid  94 and name   HN ) 4.23 4.23 0.00 
  peak 972
assign ( resid  82 and name   HA ) ( resid  94 and name   HN ) 4.95 4.95 0.00 
  peak 975
assign ( resid  83 and name   HA ) ( resid  94 and name   HN ) 4.77 4.77 0.00 
  peak 977
assign ( resid  84 and name   HA ) ( resid  94 and name   HN ) 3.72 3.72 0.00 
  peak 978
assign ( resid  83 and name HG2+ ) ( resid  94 and name   HN ) 3.90 3.90 0.00 
  peak 983
assign ( resid  52 and name HG1+ ) ( resid  94 and name   HN ) 4.25 4.25 0.00 
  peak 986
assign ( resid  30 and name   HN ) ( resid  34 and name   HN ) 4.57 4.57 0.00 
  peak 988
assign ( resid  34 and name   HN ) ( resid  34 and name  HD+ ) 4.16 4.16 0.00 
  peak 992
assign ( resid  19 and name  HD+ ) ( resid  34 and name   HN ) 4.19 4.19 0.00 
  peak 994
assign ( resid  28 and name HG2+ ) ( resid  34 and name   HN ) 3.05 3.05 0.00 
  peak 997
assign ( resid  65 and name   HN ) ( resid  68 and name   HN ) 5.04 5.04 0.00 
  peak 999
assign ( resid  62 and name  HD2 ) ( resid  65 and name   HN ) 4.07 4.07 0.00 
  peak 1005
assign ( resid  62 and name  HD1 ) ( resid  65 and name   HN ) 4.07 4.07 0.00 
  peak 1006
assign ( resid  65 and name   HN ) ( resid  68 and name  HG1 ) 4.41 4.41 0.00 
  peak 1009
assign ( resid  97 and name   HA ) ( resid  99 and name   HN ) 4.11 4.11 0.00 
  peak 1011
assign ( resid  97 and name   HB ) ( resid  99 and name   HN ) 3.92 3.92 0.00 
  peak 1013
assign ( resid  79 and name   HN ) ( resid  80 and name  HD+ ) 4.40 4.40 0.00 
  peak 1015
assign ( resid  79 and name   HN ) ( resid  97 and name HG2+ ) 4.16 4.16 0.00 
  peak 1021
assign ( resid  28 and name   HB ) ( resid  30 and name   HN ) 4.38 4.38 0.00 
  peak 1027
assign ( resid  18 and name  HA1 ) ( resid  30 and name   HN ) 5.09 5.09 0.00 
  peak 1029
assign ( resid  30 and name   HN ) ( resid  33 and name  HG1 ) 4.91 4.91 0.00 
  peak 1030
assign ( resid  28 and name HG2+ ) ( resid  30 and name   HN ) 3.10 3.10 0.00 
  peak 1034
assign ( resid  55 and name   HN ) ( resid  97 and name   HN ) 4.96 4.96 0.00 
  peak 1035
assign ( resid  55 and name  HG+ ) ( resid  97 and name   HN ) 3.47 3.47 0.00 
  peak 1043
assign ( resid  81 and name  HG2 ) ( resid  97 and name   HN ) 4.89 4.89 0.00 
  peak 1048
assign ( resid  97 and name   HN ) ( resid 101 and name HG2+ ) 4.24 4.24 0.00 
  peak 1049
assign ( resid  54 and name HG2+ ) ( resid  97 and name   HN ) 4.25 4.25 0.00 
  peak 1051
assign ( resid  51 and name   HN ) ( resid  51 and name  HD+ ) 3.54 3.54 0.00 
  peak 1053
assign ( resid  51 and name   HN ) ( resid  60 and name HG2+ ) 3.93 3.93 0.00 
  peak 1057
assign ( resid  51 and name   HN ) ( resid  92 and name HG2+ ) 4.64 4.64 0.00 
  peak 1059
assign ( resid  64 and name  HB+ ) ( resid  68 and name   HN ) 4.54 4.54 0.00 
  peak 1072
assign ( resid  68 and name   HN ) ( resid  71 and name  HB1 ) 4.72 4.72 0.00 
  peak 1074
assign ( resid  75 and name   HA ) ( resid  77 and name   HN ) 3.83 3.83 0.00 
  peak 1088
assign ( resid  75 and name  HB2 ) ( resid  77 and name   HN ) 5.33 5.33 0.00 
  peak 1094
assign ( resid  70 and name   HN ) ( resid  73 and name   HN ) 4.72 4.72 0.00 
  peak 1100
assign ( resid  70 and name   HN ) ( resid  70 and name HD22 ) 4.39 4.39 0.00 
  peak 1102
assign ( resid  70 and name   HN ) ( resid  80 and name  HD+ ) 4.17 4.17 0.00 
  peak 1105
assign ( resid  70 and name   HN ) ( resid  80 and name  HE+ ) 3.93 3.93 0.00 
  peak 1106
assign ( resid  70 and name   HN ) ( resid  70 and name HD21 ) 4.34 4.34 0.00 
  peak 1107
assign ( resid  70 and name   HN ) ( resid  74 and name  HB2 ) 4.15 4.15 0.00 
  peak 1110
assign ( resid  70 and name   HN ) ( resid  70 and name  HB+ ) 3.07 3.07 0.00 
  peak 1111
assign ( resid  34 and name   HN ) ( resid  36 and name   HN ) 4.15 4.15 0.00 
  peak 1116
assign ( resid  36 and name   HN ) ( resid  39 and name   HN ) 5.01 5.01 0.00 
  peak 1117
assign ( resid  32 and name   HA ) ( resid  36 and name   HN ) 4.51 4.51 0.00 
  peak 1122
assign ( resid  36 and name   HN ) ( resid  38 and name   HB ) 4.67 4.67 0.00 
  peak 1131
assign ( resid  28 and name HG2+ ) ( resid  36 and name   HN ) 5.25 5.25 0.00 
  peak 1132
assign ( resid  36 and name  HD+ ) ( resid  37 and name   HN ) 4.17 4.17 0.00 
  peak 1134
assign ( resid  33 and name   HA ) ( resid  37 and name   HN ) 4.24 4.24 0.00 
  peak 1135
assign ( resid  66 and name   HN ) ( resid  69 and name   HN ) 4.46 4.46 0.00 
  peak 1140
assign ( resid  69 and name   HN ) ( resid  80 and name  HE+ ) 4.50 4.50 0.00 
  peak 1145
assign ( resid  52 and name   HN ) ( resid  95 and name   HN ) 3.75 3.75 0.00 
  peak 1159
assign ( resid  52 and name   HN ) ( resid  94 and name   HN ) 4.78 4.78 0.00 
  peak 1160
assign ( resid  52 and name   HN ) ( resid  59 and name   HA ) 4.89 4.89 0.00 
  peak 1164
assign ( resid  52 and name   HN ) ( resid  94 and name   HA ) 3.41 3.41 0.00 
  peak 1166
assign ( resid  52 and name   HN ) ( resid  93 and name  HB2 ) 4.46 4.46 0.00 
  peak 1168
assign ( resid  52 and name   HN ) ( resid  92 and name   HB ) 4.75 4.75 0.00 
  peak 1172
assign ( resid  71 and name   HN ) ( resid  80 and name  HE+ ) 4.43 4.43 0.00 
  peak 1179
assign ( resid  70 and name  HB+ ) ( resid  71 and name   HN ) 3.94 3.94 0.00 
  peak 1183
assign ( resid  69 and name  HB1 ) ( resid  71 and name   HN ) 4.35 4.35 0.00 
  peak 1184
assign ( resid  68 and name  HB2 ) ( resid  71 and name   HN ) 5.15 5.15 0.00 
  peak 1186
assign ( resid  68 and name  HB1 ) ( resid  71 and name   HN ) 5.48 5.48 0.00 
  peak 1186
assign ( resid  33 and name   HN ) ( resid  34 and name   HN ) 3.23 3.23 0.00 
  peak 1188
assign ( resid  31 and name   HA ) ( resid  33 and name   HN ) 4.44 4.44 0.00 
  peak 1194
assign ( resid  28 and name HG2+ ) ( resid  33 and name   HN ) 4.02 4.02 0.00 
  peak 1198
assign ( resid  55 and name   HN ) ( resid  96 and name   HA ) 3.85 3.85 0.00 
  peak 1205
assign ( resid  55 and name   HN ) ( resid  96 and name HG2+ ) 3.58 3.58 0.00 
  peak 1209
assign ( resid  55 and name   HN ) ( resid  97 and name HD1+ ) 5.00 5.00 0.00 
  peak 1211
assign ( resid  91 and name   HN ) ( resid  92 and name   HA ) 5.22 5.22 0.00 
  peak 1217
assign ( resid  80 and name  HD+ ) ( resid  96 and name   HN ) 3.96 3.96 0.00 
  peak 1220
assign ( resid  81 and name  HE+ ) ( resid  96 and name   HN ) 4.16 4.16 0.00 
  peak 1224
assign ( resid  81 and name  HB1 ) ( resid  96 and name   HN ) 4.26 4.26 0.00 
  peak 1227
assign ( resid  81 and name  HG2 ) ( resid  96 and name   HN ) 4.28 4.28 0.00 
  peak 1228
assign ( resid  81 and name  HG1 ) ( resid  96 and name   HN ) 4.18 4.18 0.00 
  peak 1229
assign ( resid  57 and name   HN ) ( resid  57 and name HD22 ) 4.96 4.96 0.00 
  peak 1233
assign ( resid  53 and name   HA ) ( resid  57 and name   HN ) 4.97 4.97 0.00 
  peak 1235
assign ( resid  53 and name  HB1 ) ( resid  57 and name   HN ) 4.01 4.01 0.00 
  peak 1241
assign ( resid  52 and name HG2+ ) ( resid  57 and name   HN ) 3.98 3.98 0.00 
  peak 1244
assign ( resid  86 and name  HB1 ) ( resid  90 and name   HN ) 4.02 4.02 0.00 
  peak 1255
assign ( resid  86 and name  HG+ ) ( resid  90 and name   HN ) 3.69 3.69 0.00 
  peak 1257
assign ( resid  78 and name  HG+ ) ( resid  80 and name   HN ) 4.46 4.46 0.00 
  peak 1272
assign ( resid  80 and name   HN ) ( resid  97 and name HG2+ ) 4.46 4.46 0.00 
  peak 1284
assign ( resid  37 and name   HA ) ( resid  41 and name   HN ) 3.96 3.96 0.00 
  peak 1290
assign ( resid  36 and name   HN ) ( resid  38 and name   HN ) 3.88 3.88 0.00 
  peak 1294
assign ( resid  36 and name  HD+ ) ( resid  38 and name   HN ) 5.28 5.28 0.00 
  peak 1295
assign ( resid  36 and name  HB1 ) ( resid  38 and name   HN ) 4.77 4.77 0.00 
  peak 1302
assign ( resid  53 and name   HN ) ( resid  58 and name   HN ) 3.47 3.47 0.00 
  peak 1303
assign ( resid  56 and name   HN ) ( resid  58 and name   HN ) 4.02 4.02 0.00 
  peak 1305
assign ( resid  58 and name   HN ) ( resid  58 and name  HD+ ) 3.15 3.15 0.00 
  peak 1307
assign ( resid  52 and name   HA ) ( resid  58 and name   HN ) 4.31 4.31 0.00 
  peak 1308
assign ( resid  53 and name   HA ) ( resid  58 and name   HN ) 4.80 4.80 0.00 
  peak 1309
assign ( resid  70 and name   HN ) ( resid  74 and name   HN ) 4.21 4.21 0.00 
  peak 1316
assign ( resid  73 and name  HD+ ) ( resid  74 and name   HN ) 4.07 4.07 0.00 
  peak 1320
assign ( resid  74 and name   HN ) ( resid  97 and name HD1+ ) 4.66 4.66 0.00 
  peak 1329
assign ( resid  35 and name HG2+ ) ( resid  39 and name   HN ) 5.30 5.30 0.00 
  peak 1333
assign ( resid  27 and name HE21 ) ( resid  28 and name   HN ) 4.26 4.26 0.00 
  peak 1341
assign ( resid  28 and name   HN ) ( resid  34 and name   HA ) 5.00 5.00 0.00 
  peak 1346
assign ( resid  18 and name  HA1 ) ( resid  28 and name   HN ) 4.27 4.27 0.00 
  peak 1348
assign ( resid  28 and name   HN ) ( resid  34 and name  HB+ ) 4.13 4.13 0.00 
  peak 1350
assign ( resid  19 and name  HB2 ) ( resid  28 and name   HN ) 3.46 3.46 0.00 
  peak 1352
assign ( resid  72 and name   HN ) ( resid  73 and name  HD+ ) 3.35 3.35 0.00 
  peak 1363
assign ( resid  72 and name   HN ) ( resid  75 and name  HD1 ) 4.92 4.92 0.00 
  peak 1368
assign ( resid  72 and name   HN ) ( resid  73 and name  HB2 ) 4.15 4.15 0.00 
  peak 1371
assign ( resid  68 and name  HB2 ) ( resid  72 and name   HN ) 4.67 4.67 0.00 
  peak 1372
assign ( resid  44 and name   HN ) ( resid  44 and name  HB+ ) 3.68 3.68 0.00 
  peak 1380
assign ( resid  43 and name  HG2 ) ( resid  44 and name   HN ) 4.25 4.25 0.00 
  peak 1381
assign ( resid  39 and name   HN ) ( resid  42 and name   HN ) 4.87 4.87 0.00 
  peak 1382
assign ( resid  42 and name   HN ) ( resid  43 and name   HA ) 4.87 4.87 0.00 
  peak 1390
assign ( resid  42 and name   HN ) ( resid  43 and name  HD1 ) 3.35 3.35 0.00 
  peak 1394
assign ( resid  99 and name   HA ) ( resid 101 and name   HN ) 3.69 3.69 0.00 
  peak 1404
assign ( resid  50 and name   HN ) ( resid  93 and name   HN ) 3.39 3.39 0.00 
  peak 1409
assign ( resid  50 and name   HN ) ( resid  51 and name  HD+ ) 4.67 4.67 0.00 
  peak 1413
assign ( resid  50 and name   HN ) ( resid  93 and name  HD+ ) 3.46 3.46 0.00 
  peak 1414
assign ( resid  50 and name   HN ) ( resid  51 and name   HA ) 4.82 4.82 0.00 
  peak 1417
assign ( resid  50 and name   HN ) ( resid  92 and name   HA ) 3.02 3.02 0.00 
  peak 1423
assign ( resid  67 and name   HN ) ( resid  68 and name  HG1 ) 4.57 4.57 0.00 
  peak 1430
assign ( resid  50 and name   HN ) ( resid  92 and name HG2+ ) 3.09 3.09 0.00 
  peak 1436
assign ( resid  35 and name   HN ) ( resid  38 and name   HN ) 5.05 5.05 0.00 
  peak 1437
assign ( resid  34 and name  HD+ ) ( resid  35 and name   HN ) 3.57 3.57 0.00 
  peak 1439
assign ( resid  28 and name HG2+ ) ( resid  35 and name   HN ) 4.42 4.42 0.00 
  peak 1443
assign ( resid  31 and name HD1+ ) ( resid  35 and name   HN ) 3.84 3.84 0.00 
  peak 1445
assign ( resid  73 and name   HN ) ( resid  73 and name  HD+ ) 3.01 3.01 0.00 
  peak 1446
assign ( resid  73 and name   HN ) ( resid  73 and name  HE+ ) 4.18 4.18 0.00 
  peak 1447
assign ( resid  69 and name  HB1 ) ( resid  73 and name   HN ) 5.33 5.33 0.00 
  peak 1450
assign ( resid  71 and name   HG ) ( resid  73 and name   HN ) 4.91 4.91 0.00 
  peak 1453
assign ( resid  86 and name   HA ) ( resid  89 and name HD21 ) 4.75 4.75 0.00 
  peak 1464
assign ( resid  86 and name  HD+ ) ( resid  89 and name HD21 ) 4.13 4.13 0.00 
  peak 1470
assign ( resid  59 and name HD1+ ) ( resid  89 and name HD21 ) 5.50 5.50 0.00 
  peak 1472
assign ( resid  89 and name HD21 ) ( resid  92 and name HD1+ ) 5.50 5.50 0.00 
  peak 1472
assign ( resid  79 and name HD22 ) ( resid  98 and name HD22 ) 5.19 5.19 0.00 
  peak 1487
assign ( resid  79 and name   HA ) ( resid  98 and name HD22 ) 4.72 4.72 0.00 
  peak 1493
assign ( resid  97 and name   HA ) ( resid  98 and name HD22 ) 4.81 4.81 0.00 
  peak 1495
assign ( resid  98 and name HD22 ) ( resid 100 and name HD1+ ) 5.05 5.05 0.00 
  peak 1501
assign ( resid  98 and name   HA ) ( resid  98 and name HD21 ) 3.66 3.66 0.00 
  peak 1517
assign ( resid  98 and name HD21 ) ( resid  99 and name   HA ) 4.38 4.38 0.00 
  peak 1518
assign ( resid  80 and name  HD+ ) ( resid  95 and name HE21 ) 4.00 4.00 0.00 
  peak 1553
assign ( resid  89 and name HD21 ) ( resid  90 and name HE22 ) 4.99 4.99 0.00 
  peak 1558
assign ( resid  90 and name HE22 ) ( resid  92 and name HG11 ) 5.18 5.18 0.00 
  peak 1566
assign ( resid  59 and name HD2+ ) ( resid  90 and name HE22 ) 4.82 4.82 0.00 
  peak 1567
assign ( resid  36 and name  HD+ ) ( resid  40 and name   HN ) 4.70 4.70 0.00 
  peak 1570
assign ( resid  40 and name   HN ) ( resid  43 and name  HD1 ) 4.92 4.92 0.00 
  peak 1571
assign ( resid  40 and name   HN ) ( resid  41 and name  HG+ ) 4.21 4.21 0.00 
  peak 1573
assign ( resid  38 and name HG1+ ) ( resid  40 and name   HN ) 4.63 4.63 0.00 
  peak 1575
assign ( resid  20 and name   HN ) ( resid  21 and name   HN ) 4.35 4.35 0.00 
  peak 1576
assign ( resid  21 and name   HN ) ( resid  27 and name   HA ) 3.91 3.91 0.00 
  peak 1580
assign ( resid  21 and name   HN ) ( resid  27 and name  HB2 ) 4.52 4.52 0.00 
  peak 1582
assign ( resid  19 and name   HN ) ( resid  34 and name  HD+ ) 4.71 4.71 0.00 
  peak 1586
assign ( resid  19 and name   HN ) ( resid  19 and name  HD+ ) 3.52 3.52 0.00 
  peak 1587
assign ( resid  19 and name   HN ) ( resid  28 and name   HA ) 4.23 4.23 0.00 
  peak 1589
assign ( resid  19 and name   HN ) ( resid  29 and name   HA ) 3.07 3.07 0.00 
  peak 1590
assign ( resid  19 and name   HN ) ( resid  29 and name  HB1 ) 4.39 4.39 0.00 
  peak 1594
assign ( resid  19 and name   HN ) ( resid  27 and name  HB2 ) 4.91 4.91 0.00 
  peak 1596
assign ( resid  23 and name   HN ) ( resid  23 and name  HD+ ) 3.18 3.18 0.00 
  peak 1601
assign ( resid  23 and name   HN ) ( resid  23 and name  HE+ ) 4.10 4.10 0.00 
  peak 1602
assign ( resid  21 and name   HA ) ( resid  23 and name   HN ) 3.84 3.84 0.00 
  peak 1603
assign ( resid  22 and name  HB1 ) ( resid  23 and name   HN ) 3.87 3.87 0.00 
  peak 1605
assign ( resid  23 and name   HN ) ( resid  24 and name   HN ) 2.65 2.65 0.00 
  peak 1606
assign ( resid  21 and name  HB1 ) ( resid  24 and name   HN ) 4.01 4.01 0.00 
  peak 1621
assign ( resid  18 and name   HN ) ( resid  73 and name  HE+ ) 4.71 4.71 0.00 
  peak 1628
assign ( resid  15 and name HG2+ ) ( resid  18 and name   HN ) 5.00 5.00 0.00 
  peak 1631
assign ( resid  83 and name   HN ) ( resid  96 and name   HN ) 4.41 4.41 0.00 
  peak 1640
assign ( resid  83 and name   HN ) ( resid  94 and name   HN ) 3.55 3.55 0.00 
  peak 1641
assign ( resid  83 and name   HN ) ( resid  95 and name   HA ) 3.85 3.85 0.00 
  peak 1644
assign ( resid  83 and name   HN ) ( resid  85 and name HG2+ ) 4.95 4.95 0.00 
  peak 1650
assign ( resid  91 and name   HN ) ( resid  92 and name   HN ) 4.32 4.32 0.00 
  peak 1651
assign ( resid  86 and name  HE+ ) ( resid  92 and name   HN ) 5.28 5.28 0.00 
  peak 1656
assign ( resid  90 and name  HG+ ) ( resid  92 and name   HN ) 4.16 4.16 0.00 
  peak 1657
assign ( resid  85 and name   HN ) ( resid  86 and name  HB2 ) 3.97 3.97 0.00 
  peak 1663
assign ( resid  86 and name   HN ) ( resid  92 and name   HN ) 4.01 4.01 0.00 
  peak 1666
assign ( resid  86 and name   HN ) ( resid  92 and name HG11 ) 5.29 5.29 0.00 
  peak 1674
assign ( resid  86 and name   HN ) ( resid  91 and name HG2+ ) 3.76 3.76 0.00 
  peak 1675
assign ( resid  53 and name   HN ) ( resid  59 and name   HN ) 5.16 5.16 0.00 
  peak 1686
assign ( resid  52 and name   HA ) ( resid  59 and name   HN ) 4.64 4.64 0.00 
  peak 1690
assign ( resid  80 and name  HD+ ) ( resid  81 and name   HN ) 3.01 3.01 0.00 
  peak 1699
assign ( resid  81 and name   HN ) ( resid  97 and name   HA ) 3.30 3.30 0.00 
  peak 1701
assign ( resid  81 and name   HN ) ( resid  95 and name  HG2 ) 3.96 3.96 0.00 
  peak 1706
assign ( resid  81 and name   HN ) ( resid  95 and name  HG1 ) 4.26 4.26 0.00 
  peak 1707
assign ( resid  81 and name   HN ) ( resid  97 and name HG12 ) 4.99 4.99 0.00 
  peak 1708
assign ( resid  81 and name   HN ) ( resid  97 and name HG11 ) 4.83 4.83 0.00 
  peak 1709
assign ( resid  81 and name   HN ) ( resid  97 and name HG2+ ) 4.69 4.69 0.00 
  peak 1710
assign ( resid  51 and name   HN ) ( resid  60 and name   HN ) 3.79 3.79 0.00 
  peak 1712
assign ( resid  60 and name   HN ) ( resid  65 and name  HB+ ) 5.08 5.08 0.00 
  peak 1721
assign ( resid  70 and name  HB+ ) ( resid  70 and name HD22 ) 3.98 3.98 0.00 
  peak 1727
assign ( resid  70 and name HD22 ) ( resid  80 and name  HB2 ) 3.83 3.83 0.00 
  peak 1728
assign ( resid  70 and name HD21 ) ( resid  97 and name HG12 ) 4.22 4.22 0.00 
  peak 1737
assign ( resid  70 and name HD21 ) ( resid 100 and name HD1+ ) 4.29 4.29 0.00 
  peak 1739
assign ( resid  20 and name   HN ) ( resid  27 and name HE22 ) 3.77 3.77 0.00 
  peak 1742
assign ( resid  27 and name HE22 ) ( resid  73 and name  HE+ ) 3.87 3.87 0.00 
  peak 1753
assign ( resid  16 and name   HA ) ( resid  27 and name HE22 ) 5.06 5.06 0.00 
  peak 1766
assign ( resid  15 and name   HA ) ( resid  27 and name HE22 ) 4.10 4.10 0.00 
  peak 1767
assign ( resid  17 and name  HA2 ) ( resid  27 and name HE22 ) 4.82 4.82 0.00 
  peak 1770
assign ( resid  18 and name  HA1 ) ( resid  27 and name HE22 ) 4.41 4.41 0.00 
  peak 1773
assign ( resid  27 and name  HG1 ) ( resid  27 and name HE22 ) 3.58 3.58 0.00 
  peak 1779
assign ( resid  15 and name HG2+ ) ( resid  27 and name HE22 ) 4.28 4.28 0.00 
  peak 1788
assign ( resid  20 and name   HN ) ( resid  27 and name HE21 ) 4.15 4.15 0.00 
  peak 1791
assign ( resid  27 and name HE21 ) ( resid  73 and name  HE+ ) 4.09 4.09 0.00 
  peak 1800
assign ( resid  27 and name   HA ) ( resid  27 and name HE21 ) 4.68 4.68 0.00 
  peak 1811
assign ( resid  19 and name   HA ) ( resid  27 and name HE21 ) 4.29 4.29 0.00 
  peak 1818
assign ( resid  15 and name   HA ) ( resid  27 and name HE21 ) 4.74 4.74 0.00 
  peak 1819
assign ( resid  18 and name  HA1 ) ( resid  27 and name HE21 ) 4.05 4.05 0.00 
  peak 1824
assign ( resid  27 and name  HG2 ) ( resid  27 and name HE21 ) 3.34 3.34 0.00 
  peak 1828
assign ( resid  20 and name  HB2 ) ( resid  27 and name HE21 ) 4.11 4.11 0.00 
  peak 1829
assign ( resid  27 and name  HB2 ) ( resid  27 and name HE21 ) 3.94 3.94 0.00 
  peak 1830
assign ( resid  20 and name  HB1 ) ( resid  27 and name HE21 ) 4.11 4.11 0.00 
  peak 1831
assign ( resid  15 and name HG2+ ) ( resid  27 and name HE21 ) 3.98 3.98 0.00 
  peak 1833
assign ( resid  52 and name HG1+ ) ( resid  57 and name HD21 ) 4.20 4.20 0.00 
  peak 1843
assign ( resid  89 and name  HB1 ) ( resid  90 and name HE21 ) 4.38 4.38 0.00 
  peak 1855
assign ( resid  44 and name  HB+ ) ( resid  44 and name HD22 ) 3.78 3.78 0.00 
  peak 1861
assign ( resid  44 and name  HB+ ) ( resid  44 and name HD21 ) 3.78 3.78 0.00 
  peak 1864
assign ( resid  78 and name   HN ) ( resid  79 and name HD21 ) 4.05 4.05 0.00 
  peak 1869
assign ( resid  79 and name HD21 ) ( resid  98 and name HD22 ) 4.05 4.05 0.00 
  peak 1870
assign ( resid  78 and name   HA ) ( resid  79 and name HD21 ) 4.12 4.12 0.00 
  peak 1880
assign ( resid  77 and name   HA ) ( resid  79 and name HD21 ) 4.44 4.44 0.00 
  peak 1883
assign ( resid  32 and name HD21 ) ( resid  33 and name   HA ) 4.55 4.55 0.00 
  peak 1890
assign ( resid  79 and name   HN ) ( resid  79 and name HD22 ) 4.60 4.60 0.00 
  peak 1891
assign ( resid  78 and name   HA ) ( resid  79 and name HD22 ) 4.82 4.82 0.00 
  peak 1897
assign ( resid  54 and name   HN ) ( resid  96 and name   HN ) 5.27 5.27 0.00 
  peak 1906
assign ( resid  82 and name   HN ) ( resid  96 and name   HN ) 5.50 5.50 0.00 
  peak 1906
assign ( resid  80 and name  HE+ ) ( resid  96 and name   HN ) 4.42 4.42 0.00 
  peak 1909
assign ( resid  15 and name HG2+ ) ( resid  19 and name   HN ) 5.50 5.50 0.00 
  peak 1934
assign ( resid  51 and name  HD+ ) ( resid  52 and name   HN ) 4.34 4.34 0.00 
  peak 1943
assign ( resid  53 and name   HN ) ( resid  57 and name   HN ) 4.81 4.81 0.00 
  peak 1944
assign ( resid  53 and name   HN ) ( resid  59 and name   HA ) 4.07 4.07 0.00 
  peak 1946
assign ( resid  81 and name   HA ) ( resid  82 and name   HN ) 2.74 2.74 0.00 
  peak 1950
assign ( resid  81 and name  HB2 ) ( resid  82 and name   HN ) 3.62 3.62 0.00 
  peak 1951
assign ( resid  51 and name   HA ) ( resid  95 and name   HN ) 5.50 5.50 0.00 
  peak 1952
assign ( resid  82 and name   HA ) ( resid  95 and name   HN ) 5.50 5.50 0.00 
  peak 1952
assign ( resid  81 and name  HD+ ) ( resid  96 and name   HN ) 4.12 4.12 0.00 
  peak 1954
assign ( resid  97 and name   HN ) ( resid  99 and name   HN ) 5.15 5.15 0.00 
  peak 1955
assign ( resid  30 and name   HA ) ( resid  33 and name   HN ) 4.41 4.41 0.00 
  peak 1956
assign ( resid  34 and name   HN ) ( resid  35 and name   HN ) 3.33 3.33 0.00 
  peak 1957
assign ( resid  34 and name   HA ) ( resid  37 and name   HN ) 4.33 4.33 0.00 
  peak 1959
assign ( resid  34 and name   HA ) ( resid  38 and name   HN ) 4.43 4.43 0.00 
  peak 1960
assign ( resid  22 and name   HN ) ( resid  24 and name   HN ) 4.26 4.26 0.00 
  peak 1961
assign ( resid  45 and name   HN ) ( resid  45 and name   HB ) 3.95 3.95 0.00 
  peak 1963
assign ( resid  53 and name   HN ) ( resid  55 and name   HN ) 5.46 5.46 0.00 
  peak 1965
assign ( resid  21 and name   HN ) ( resid  24 and name   HN ) 5.04 5.04 0.00 
  peak 1974
assign ( resid  22 and name   HN ) ( resid  23 and name   HN ) 4.56 4.56 0.00 
  peak 1976
assign ( resid  22 and name   HN ) ( resid  22 and name  HG+ ) 4.57 4.57 0.00 
  peak 1978
assign ( resid  19 and name  HE+ ) ( resid  32 and name   HN ) 4.96 4.96 0.00 
  peak 1988
assign ( resid  31 and name HD2+ ) ( resid  32 and name   HN ) 4.97 4.97 0.00 
  peak 1989
assign ( resid  31 and name  HB1 ) ( resid  33 and name   HN ) 5.11 5.11 0.00 
  peak 1991
assign ( resid  31 and name HD1+ ) ( resid  33 and name   HN ) 5.03 5.03 0.00 
  peak 1992
assign ( resid  31 and name   HN ) ( resid  34 and name   HN ) 4.74 4.74 0.00 
  peak 1993
assign ( resid  31 and name  HB1 ) ( resid  34 and name   HN ) 5.38 5.38 0.00 
  peak 1996
assign ( resid  33 and name   HN ) ( resid  36 and name   HN ) 4.68 4.68 0.00 
  peak 1998
assign ( resid  31 and name HD1+ ) ( resid  36 and name   HN ) 4.91 4.91 0.00 
  peak 1999
assign ( resid  39 and name   HN ) ( resid  40 and name   HN ) 3.26 3.26 0.00 
  peak 2003
assign ( resid  41 and name  HB+ ) ( resid  42 and name   HN ) 3.50 3.50 0.00 
  peak 2007
assign ( resid  67 and name   HN ) ( resid  68 and name  HG2 ) 4.42 4.42 0.00 
  peak 2010
assign ( resid  51 and name   HN ) ( resid  93 and name  HD+ ) 5.50 5.50 0.00 
  peak 2012
assign ( resid  51 and name   HN ) ( resid  66 and name   HG ) 5.50 5.50 0.00 
  peak 2014
assign ( resid  52 and name   HN ) ( resid  95 and name  HB+ ) 4.55 4.55 0.00 
  peak 2019
assign ( resid  52 and name   HN ) ( resid  94 and name  HB+ ) 4.56 4.56 0.00 
  peak 2020
assign ( resid  53 and name   HN ) ( resid  95 and name  HB+ ) 4.96 4.96 0.00 
  peak 2022
assign ( resid  54 and name   HN ) ( resid  95 and name   HA ) 4.76 4.76 0.00 
  peak 2024
assign ( resid  54 and name   HN ) ( resid  94 and name  HB+ ) 4.45 4.45 0.00 
  peak 2025
assign ( resid  56 and name   HN ) ( resid  96 and name HG2+ ) 5.24 5.24 0.00 
  peak 2036
assign ( resid  54 and name   HN ) ( resid  57 and name   HN ) 4.61 4.61 0.00 
  peak 2038
assign ( resid  54 and name   HN ) ( resid  58 and name   HN ) 5.22 5.22 0.00 
  peak 2043
assign ( resid  62 and name  HG1 ) ( resid  65 and name   HN ) 3.86 3.86 0.00 
  peak 2049
assign ( resid  71 and name   HN ) ( resid  74 and name  HB2 ) 5.16 5.16 0.00 
  peak 2059
assign ( resid  70 and name  HB+ ) ( resid  77 and name   HN ) 4.39 4.39 0.00 
  peak 2067
assign ( resid  81 and name  HD+ ) ( resid  82 and name   HN ) 4.45 4.45 0.00 
  peak 2072
assign ( resid  81 and name  HE+ ) ( resid  83 and name   HN ) 4.50 4.50 0.00 
  peak 2074
assign ( resid  50 and name   HN ) ( resid  92 and name   HN ) 5.50 5.50 0.00 
  peak 2076
assign ( resid  90 and name HE21 ) ( resid  91 and name   HN ) 5.50 5.50 0.00 
  peak 2084
assign ( resid  86 and name  HB1 ) ( resid  91 and name   HN ) 4.77 4.77 0.00 
  peak 2088
assign ( resid  84 and name   HA ) ( resid  93 and name   HN ) 5.18 5.18 0.00 
  peak 2090
assign ( resid  51 and name  HB+ ) ( resid  93 and name   HN ) 5.50 5.50 0.00 
  peak 2093
assign ( resid  84 and name  HG+ ) ( resid  93 and name   HN ) 5.50 5.50 0.00 
  peak 2094
assign ( resid  54 and name   HA ) ( resid  95 and name   HN ) 4.77 4.77 0.00 
  peak 2096
assign ( resid  53 and name  HB2 ) ( resid  95 and name   HN ) 5.22 5.22 0.00 
  peak 2097
assign ( resid  54 and name   HB ) ( resid  96 and name   HN ) 5.48 5.48 0.00 
  peak 2099
assign ( resid  16 and name   HN ) ( resid  16 and name  HG+ ) 3.77 3.77 0.00 
  peak 2106
assign ( resid  99 and name  HB1 ) ( resid 101 and name   HN ) 4.75 4.75 0.00 
  peak 2110
assign ( resid  20 and name   HN ) ( resid  27 and name   HA ) 5.04 5.04 0.00 
  peak 2133
assign ( resid  20 and name   HN ) ( resid  21 and name   HA ) 5.35 5.35 0.00 
  peak 2134
assign ( resid  18 and name  HA1 ) ( resid  20 and name   HN ) 5.50 5.50 0.00 
  peak 2136
assign ( resid  19 and name  HB2 ) ( resid  20 and name   HN ) 4.34 4.34 0.00 
  peak 2137
assign ( resid  20 and name   HN ) ( resid  58 and name  HB+ ) 5.20 5.20 0.00 
  peak 2138
assign ( resid  15 and name HG2+ ) ( resid  20 and name   HN ) 4.10 4.10 0.00 
  peak 2142
assign ( resid  43 and name  HD2 ) ( resid  44 and name   HN ) 4.50 4.50 0.00 
  peak 2143
assign ( resid  27 and name  HG1 ) ( resid  27 and name HE21 ) 3.20 3.20 0.00 
  peak 2160
assign ( resid  70 and name HD21 ) ( resid  78 and name  HB2 ) 5.00 5.00 0.00 
  peak 2163
assign ( resid  70 and name HD22 ) ( resid  78 and name  HB2 ) 4.71 4.71 0.00 
  peak 2165
assign ( resid  70 and name HD21 ) ( resid  78 and name  HB1 ) 5.44 5.44 0.00 
  peak 2166
assign ( resid  70 and name HD22 ) ( resid  78 and name  HB1 ) 4.96 4.96 0.00 
  peak 2168
assign ( resid  70 and name   HA ) ( resid  70 and name HD21 ) 4.71 4.71 0.00 
  peak 2171
assign ( resid  70 and name HD21 ) ( resid  80 and name  HE+ ) 4.32 4.32 0.00 
  peak 2174
assign ( resid  70 and name HD22 ) ( resid  80 and name  HE+ ) 4.33 4.33 0.00 
  peak 2175
assign ( resid  53 and name   HA ) ( resid  95 and name HE21 ) 5.24 5.24 0.00 
  peak 2181
assign ( resid  44 and name   HN ) ( resid  45 and name   HN ) 4.53 4.53 0.00 
  peak 2198
assign ( resid 102 and name   HN ) ( resid 102 and name  HD+ ) 3.59 3.59 0.00 
  peak 2202
assign ( resid  52 and name   HB ) ( resid  58 and name   HN ) 5.10 5.10 0.00 
  peak 2214
assign ( resid  31 and name   HA ) ( resid  35 and name   HN ) 4.02 4.02 0.00 
  peak 2225
assign ( resid  35 and name   HA ) ( resid  38 and name   HN ) 3.72 3.72 0.00 
  peak 2226
assign ( resid  57 and name   HN ) ( resid  57 and name HD21 ) 4.42 4.42 0.00 
  peak 2228
assign ( resid  95 and name   HN ) ( resid  95 and name  HG2 ) 4.77 4.77 0.00 
  peak 2230
assign ( resid  97 and name HG12 ) ( resid  98 and name   HN ) 4.76 4.76 0.00 
  peak 2233
assign ( resid  16 and name  HG+ ) ( resid  18 and name   HN ) 4.75 4.75 0.00 
  peak 2234
assign ( resid  18 and name   HN ) ( resid  27 and name  HG2 ) 5.28 5.28 0.00 
  peak 2234
assign ( resid  19 and name   HN ) ( resid  27 and name  HG2 ) 4.31 4.31 0.00 
  peak 2237
assign ( resid  19 and name  HD+ ) ( resid  30 and name   HN ) 4.59 4.59 0.00 
  peak 2253
assign ( resid  30 and name   HN ) ( resid  31 and name   HA ) 5.33 5.33 0.00 
  peak 2256
assign ( resid  30 and name   HN ) ( resid  33 and name  HG2 ) 4.91 4.91 0.00 
  peak 2257
assign ( resid  32 and name  HB1 ) ( resid  34 and name   HN ) 5.08 5.08 0.00 
  peak 2265
assign ( resid  31 and name  HB2 ) ( resid  34 and name   HN ) 5.50 5.50 0.00 
  peak 2266
assign ( resid  34 and name  HB+ ) ( resid  36 and name   HN ) 4.46 4.46 0.00 
  peak 2271
assign ( resid  37 and name   HN ) ( resid  40 and name   HN ) 4.90 4.90 0.00 
  peak 2281
assign ( resid  40 and name   HN ) ( resid  43 and name   HA ) 5.15 5.15 0.00 
  peak 2283
assign ( resid  39 and name   HA ) ( resid  41 and name   HN ) 4.70 4.70 0.00 
  peak 2284
assign ( resid  38 and name   HN ) ( resid  41 and name   HN ) 4.52 4.52 0.00 
  peak 2285
assign ( resid  45 and name   HN ) ( resid  45 and name HG2+ ) 3.97 3.97 0.00 
  peak 2300
assign ( resid  50 and name   HN ) ( resid  90 and name  HG+ ) 5.25 5.25 0.00 
  peak 2304
assign ( resid  51 and name   HN ) ( resid  59 and name   HA ) 4.96 4.96 0.00 
  peak 2305
assign ( resid  52 and name   HN ) ( resid  54 and name   HN ) 5.31 5.31 0.00 
  peak 2307
assign ( resid  52 and name   HN ) ( resid  94 and name  HG2 ) 4.19 4.19 0.00 
  peak 2311
assign ( resid  55 and name  HB2 ) ( resid  57 and name   HN ) 4.60 4.60 0.00 
  peak 2320
assign ( resid  52 and name   HB ) ( resid  59 and name   HN ) 4.68 4.68 0.00 
  peak 2325
assign ( resid  52 and name HG2+ ) ( resid  59 and name   HN ) 3.80 3.80 0.00 
  peak 2326
assign ( resid  51 and name  HB+ ) ( resid  60 and name   HN ) 4.26 4.26 0.00 
  peak 2328
assign ( resid  66 and name   HN ) ( resid  66 and name HD1+ ) 3.28 3.28 0.00 
  peak 2332
assign ( resid  69 and name   HN ) ( resid  73 and name   HN ) 5.30 5.30 0.00 
  peak 2340
assign ( resid  69 and name   HN ) ( resid  71 and name   HN ) 3.91 3.91 0.00 
  peak 2343
assign ( resid  71 and name   HN ) ( resid  75 and name   HA ) 5.50 5.50 0.00 
  peak 2345
assign ( resid  69 and name   HA ) ( resid  73 and name   HN ) 3.71 3.71 0.00 
  peak 2354
assign ( resid  71 and name   HN ) ( resid  74 and name   HN ) 4.06 4.06 0.00 
  peak 2356
assign ( resid  70 and name HD22 ) ( resid  80 and name   HN ) 4.41 4.41 0.00 
  peak 2364
assign ( resid  81 and name   HN ) ( resid  96 and name   HN ) 3.48 3.48 0.00 
  peak 2367
assign ( resid  83 and name   HN ) ( resid  95 and name  HG1 ) 4.89 4.89 0.00 
  peak 2369
assign ( resid  92 and name   HN ) ( resid  93 and name   HN ) 4.45 4.45 0.00 
  peak 2372
assign ( resid  84 and name  HB1 ) ( resid  85 and name   HN ) 4.66 4.66 0.00 
  peak 2374
assign ( resid  85 and name   HN ) ( resid  94 and name  HB+ ) 4.86 4.86 0.00 
  peak 2374
assign ( resid  93 and name  HB2 ) ( resid  94 and name   HN ) 4.37 4.37 0.00 
  peak 2388
assign ( resid  99 and name   HN ) ( resid 100 and name   HG ) 4.41 4.41 0.00 
  peak 2392
assign ( resid  98 and name   HN ) ( resid 100 and name   HN ) 4.21 4.21 0.00 
  peak 2393
assign ( resid  20 and name   HN ) ( resid  27 and name  HB2 ) 4.21 4.21 0.00 
  peak 2401
assign ( resid  20 and name  HB1 ) ( resid  21 and name   HN ) 4.68 4.68 0.00 
  peak 2405
assign ( resid  19 and name  HE+ ) ( resid  34 and name   HN ) 5.29 5.29 0.00 
  peak 2413
assign ( resid  38 and name   HN ) ( resid  40 and name   HN ) 3.76 3.76 0.00 
  peak 2419
assign ( resid  38 and name   HA ) ( resid  40 and name   HN ) 4.07 4.07 0.00 
  peak 2420
assign ( resid  38 and name HG1+ ) ( resid  41 and name   HN ) 4.85 4.85 0.00 
  peak 2425
assign ( resid  54 and name HG1+ ) ( resid  57 and name   HN ) 4.84 4.84 0.00 
  peak 2438
assign ( resid  21 and name   HA ) ( resid  59 and name   HN ) 4.56 4.56 0.00 
  peak 2442
assign ( resid  60 and name   HN ) ( resid  66 and name HD2+ ) 4.06 4.06 0.00 
  peak 2445
assign ( resid  69 and name   HN ) ( resid  72 and name   HN ) 4.87 4.87 0.00 
  peak 2449
assign ( resid  71 and name   HN ) ( resid  72 and name  HG2 ) 3.90 3.90 0.00 
  peak 2458
assign ( resid  69 and name  HB2 ) ( resid  74 and name   HN ) 5.45 5.45 0.00 
  peak 2464
assign ( resid  81 and name   HN ) ( resid  95 and name HE21 ) 5.18 5.18 0.00 
  peak 2471
assign ( resid  80 and name  HE+ ) ( resid  81 and name   HN ) 4.78 4.78 0.00 
  peak 2472
assign ( resid  90 and name   HN ) ( resid  92 and name   HN ) 5.38 5.38 0.00 
  peak 2485
assign ( resid  90 and name   HN ) ( resid  90 and name HE21 ) 4.47 4.47 0.00 
  peak 2487
assign ( resid  89 and name   HN ) ( resid  90 and name   HN ) 4.53 4.53 0.00 
  peak 2488
assign ( resid  84 and name   HN ) ( resid  84 and name  HB2 ) 3.83 3.83 0.00 
  peak 2492
assign ( resid  92 and name HG12 ) ( resid  93 and name   HN ) 4.98 4.98 0.00 
  peak 2495
assign ( resid  98 and name HD22 ) ( resid  99 and name   HN ) 4.63 4.63 0.00 
  peak 2497
assign ( resid  97 and name HG12 ) ( resid  99 and name   HN ) 5.50 5.50 0.00 
  peak 2498
assign ( resid  99 and name   HN ) ( resid 100 and name HD1+ ) 4.44 4.44 0.00 
  peak 2499
assign ( resid  83 and name HG2+ ) ( resid  94 and name   HA ) 4.48 4.48 0.00 
  peak 5
assign ( resid  51 and name   HA ) ( resid  60 and name HG2+ ) 5.04 5.04 0.00 
  peak 7
assign ( resid  30 and name  HB2 ) ( resid  31 and name   HN ) 4.94 4.94 0.00 
  peak 12
assign ( resid  81 and name  HD+ ) ( resid  83 and name   HB ) 4.48 4.48 0.00 
  peak 15
assign ( resid  21 and name  HB2 ) ( resid  24 and name   HA ) 4.76 4.76 0.00 
  peak 25
assign ( resid  28 and name HG2+ ) ( resid  31 and name   HN ) 5.04 5.04 0.00 
  peak 35
assign ( resid  70 and name   HA ) ( resid  71 and name   HA ) 4.75 4.75 0.00 
  peak 38
assign ( resid  80 and name  HB1 ) ( resid  96 and name   HN ) 5.03 5.03 0.00 
  peak 40
assign ( resid  54 and name HG2+ ) ( resid  83 and name   HB ) 5.03 5.03 0.00 
  peak 42
assign ( resid  40 and name   HA ) ( resid  42 and name   HN ) 5.31 5.31 0.00 
  peak 47
assign ( resid  15 and name HG2+ ) ( resid  69 and name   HA ) 5.50 5.50 0.00 
  peak 58
assign ( resid  19 and name  HD+ ) ( resid  34 and name   HA ) 4.75 4.75 0.00 
  peak 61
assign ( resid  19 and name  HD+ ) ( resid  31 and name  HB2 ) 4.75 4.75 0.00 
  peak 62
assign ( resid  52 and name   HA ) ( resid  58 and name  HB+ ) 5.50 5.50 0.00 
  peak 67
assign ( resid  90 and name  HB2 ) ( resid  92 and name HG12 ) 5.50 5.50 0.00 
  peak 74
assign ( resid  65 and name  HB+ ) ( resid  69 and name  HB2 ) 4.75 4.75 0.00 
  peak 80
assign ( resid  16 and name  HG+ ) ( resid  17 and name   HN ) 4.47 4.47 0.00 
  peak 82
assign ( resid  73 and name   HN ) ( resid  74 and name   HA ) 5.30 5.30 0.00 
  peak 89
assign ( resid  81 and name   HN ) ( resid  82 and name   HN ) 4.52 4.52 0.00 
  peak 97
assign ( resid  76 and name  HA2 ) ( resid  77 and name  HB+ ) 4.74 4.74 0.00 
  peak 100
assign ( resid  59 and name   HA ) ( resid  86 and name  HE+ ) 5.02 5.02 0.00 
  peak 108
assign ( resid  52 and name   HA ) ( resid  53 and name  HB1 ) 4.74 4.74 0.00 
  peak 110
assign ( resid  53 and name   HA ) ( resid  66 and name  HB1 ) 4.74 4.74 0.00 
  peak 120
assign ( resid  75 and name  HG2 ) ( resid  76 and name  HA2 ) 5.30 5.30 0.00 
  peak 121
assign ( resid  99 and name  HB1 ) ( resid 100 and name HD1+ ) 4.46 4.46 0.00 
  peak 125
assign ( resid  60 and name HG2+ ) ( resid  67 and name   HN ) 5.30 5.30 0.00 
  peak 129
assign ( resid  81 and name   HN ) ( resid  97 and name   HN ) 4.73 4.73 0.00 
  peak 141
assign ( resid  94 and name  HG1 ) ( resid  95 and name   HN ) 5.29 5.29 0.00 
  peak 147
assign ( resid  98 and name   HA ) ( resid 100 and name   HN ) 5.29 5.29 0.00 
  peak 148
assign ( resid  84 and name   HN ) ( resid  85 and name   HA ) 5.50 5.50 0.00 
  peak 167
assign ( resid  85 and name   HA ) ( resid  92 and name   HN ) 5.50 5.50 0.00 
  peak 167
assign ( resid  55 and name  HB2 ) ( resid  56 and name  HB2 ) 4.45 4.45 0.00 
  peak 168
assign ( resid  53 and name   HN ) ( resid  59 and name   HG ) 5.28 5.28 0.00 
  peak 175
assign ( resid  71 and name   HG ) ( resid  73 and name  HD+ ) 5.28 5.28 0.00 
  peak 183
assign ( resid  21 and name   HA ) ( resid  23 and name  HE+ ) 5.00 5.00 0.00 
  peak 187
assign ( resid  52 and name HG1+ ) ( resid  58 and name   HN ) 4.45 4.45 0.00 
  peak 192
assign ( resid  23 and name  HB+ ) ( resid  45 and name HG2+ ) 4.44 4.44 0.00 
  peak 193
assign ( resid  78 and name  HG+ ) ( resid  80 and name  HD+ ) 4.72 4.72 0.00 
  peak 204
assign ( resid  52 and name   HA ) ( resid  58 and name  HD+ ) 5.00 5.00 0.00 
  peak 206
assign ( resid  18 and name  HA1 ) ( resid  27 and name  HG1 ) 4.44 4.44 0.00 
  peak 213
assign ( resid  51 and name  HD+ ) ( resid  66 and name   HA ) 5.50 5.50 0.00 
  peak 232
assign ( resid  65 and name   HN ) ( resid  67 and name   HN ) 4.44 4.44 0.00 
  peak 233
assign ( resid  86 and name  HB2 ) ( resid  92 and name   HA ) 5.27 5.27 0.00 
  peak 237
assign ( resid  52 and name HG2+ ) ( resid  55 and name   HN ) 5.50 5.50 0.00 
  peak 247
assign ( resid  52 and name   HA ) ( resid  53 and name  HB2 ) 4.71 4.71 0.00 
  peak 251
assign ( resid  19 and name  HE+ ) ( resid  31 and name   HG ) 4.71 4.71 0.00 
  peak 253
assign ( resid  15 and name HG1+ ) ( resid  69 and name   HA ) 4.98 4.98 0.00 
  peak 279
assign ( resid  58 and name  HE+ ) ( resid  60 and name   HA ) 4.42 4.42 0.00 
  peak 287
assign ( resid  81 and name  HB1 ) ( resid  96 and name   HB ) 4.92 4.92 0.00 
  peak 289
assign ( resid  86 and name  HB1 ) ( resid  90 and name  HG+ ) 4.42 4.42 0.00 
  peak 290
assign ( resid  90 and name  HB1 ) ( resid  92 and name HG12 ) 5.50 5.50 0.00 
  peak 294
assign ( resid  74 and name  HB2 ) ( resid  97 and name HD1+ ) 4.42 4.42 0.00 
  peak 297
assign ( resid  22 and name  HB1 ) ( resid  23 and name  HE+ ) 4.42 4.42 0.00 
  peak 304
assign ( resid  36 and name   HN ) ( resid  37 and name  HB1 ) 4.97 4.97 0.00 
  peak 314
assign ( resid  70 and name   HA ) ( resid  74 and name  HB1 ) 4.41 4.41 0.00 
  peak 328
assign ( resid  77 and name   HA ) ( resid 100 and name HD1+ ) 4.41 4.41 0.00 
  peak 330
assign ( resid  82 and name  HB+ ) ( resid  83 and name   HB ) 5.50 5.50 0.00 
  peak 343
assign ( resid  82 and name   HG ) ( resid  83 and name   HB ) 5.50 5.50 0.00 
  peak 343
assign ( resid  55 and name  HG+ ) ( resid  96 and name HG2+ ) 4.41 4.41 0.00 
  peak 345
assign ( resid  85 and name   HB ) ( resid  86 and name   HA ) 4.41 4.41 0.00 
  peak 348
assign ( resid  54 and name   HN ) ( resid  95 and name  HB+ ) 4.41 4.41 0.00 
  peak 355
assign ( resid  20 and name  HG2 ) ( resid  27 and name   HA ) 5.24 5.24 0.00 
  peak 361
assign ( resid  66 and name  HB1 ) ( resid  69 and name   HN ) 5.23 5.23 0.00 
  peak 371
assign ( resid  80 and name  HB1 ) ( resid  97 and name HG12 ) 5.23 5.23 0.00 
  peak 375
assign ( resid  54 and name HG1+ ) ( resid  81 and name  HE+ ) 4.95 4.95 0.00 
  peak 388
assign ( resid  54 and name   HN ) ( resid  94 and name  HG2 ) 5.22 5.22 0.00 
  peak 392
assign ( resid  19 and name   HA ) ( resid  58 and name  HE+ ) 4.40 4.40 0.00 
  peak 395
assign ( resid  74 and name  HB1 ) ( resid  97 and name HD1+ ) 4.40 4.40 0.00 
  peak 396
assign ( resid  19 and name  HB2 ) ( resid  29 and name   HA ) 4.67 4.67 0.00 
  peak 397
assign ( resid  58 and name  HD+ ) ( resid  60 and name   HA ) 4.85 4.85 0.00 
  peak 400
assign ( resid  84 and name   HA ) ( resid  93 and name  HD+ ) 5.09 5.09 0.00 
  peak 400
assign ( resid  74 and name   HA ) ( resid  75 and name  HG1 ) 4.67 4.67 0.00 
  peak 406
assign ( resid  81 and name  HG1 ) ( resid  82 and name   HA ) 4.39 4.39 0.00 
  peak 407
assign ( resid  52 and name   HA ) ( resid  66 and name HD2+ ) 4.39 4.39 0.00 
  peak 412
assign ( resid  18 and name  HA1 ) ( resid  29 and name  HG+ ) 4.39 4.39 0.00 
  peak 414
assign ( resid  55 and name  HG+ ) ( resid  57 and name   HN ) 5.21 5.21 0.00 
  peak 415
assign ( resid  55 and name   HN ) ( resid  58 and name   HN ) 5.50 5.50 0.00 
  peak 416
assign ( resid  56 and name  HB2 ) ( resid  58 and name   HA ) 5.50 5.50 0.00 
  peak 423
assign ( resid  57 and name  HB2 ) ( resid  58 and name   HA ) 5.50 5.50 0.00 
  peak 423
assign ( resid  53 and name   HN ) ( resid  54 and name   HA ) 5.21 5.21 0.00 
  peak 433
assign ( resid  21 and name  HB1 ) ( resid  38 and name HG2+ ) 4.39 4.39 0.00 
  peak 438
assign ( resid  66 and name  HB2 ) ( resid  95 and name HE22 ) 4.40 4.40 0.00 
  peak 440
assign ( resid  42 and name   HA ) ( resid  43 and name  HB1 ) 5.48 5.48 0.00 
  peak 445
assign ( resid  23 and name   HN ) ( resid  59 and name  HB1 ) 5.48 5.48 0.00 
  peak 451
assign ( resid  80 and name  HE+ ) ( resid  97 and name   HA ) 5.00 5.00 0.00 
  peak 458
assign ( resid  97 and name   HA ) ( resid  98 and name HD21 ) 5.36 5.36 0.00 
  peak 458
assign ( resid  68 and name   HA ) ( resid  72 and name  HG1 ) 4.92 4.92 0.00 
  peak 459
assign ( resid  27 and name  HG2 ) ( resid  29 and name  HD2 ) 4.92 4.92 0.00 
  peak 460
assign ( resid  74 and name   HN ) ( resid  75 and name   HA ) 4.92 4.92 0.00 
  peak 461
assign ( resid  80 and name  HB1 ) ( resid  81 and name  HB1 ) 5.47 5.47 0.00 
  peak 465
assign ( resid  36 and name  HD+ ) ( resid  39 and name   HN ) 5.20 5.20 0.00 
  peak 467
assign ( resid  56 and name   HA ) ( resid  58 and name  HD+ ) 5.19 5.19 0.00 
  peak 471
assign ( resid  97 and name HD1+ ) ( resid 100 and name   HA ) 4.37 4.37 0.00 
  peak 475
assign ( resid  51 and name  HD+ ) ( resid  66 and name   HG ) 4.37 4.37 0.00 
  peak 477
assign ( resid  39 and name   HA ) ( resid  43 and name  HB2 ) 4.92 4.92 0.00 
  peak 486
assign ( resid  56 and name  HB1 ) ( resid  57 and name   HN ) 4.37 4.37 0.00 
  peak 488
assign ( resid  57 and name   HA ) ( resid  58 and name  HB+ ) 4.64 4.64 0.00 
  peak 496
assign ( resid  92 and name   HN ) ( resid  94 and name  HG2 ) 5.19 5.19 0.00 
  peak 497
assign ( resid  67 and name  HB1 ) ( resid  68 and name  HB1 ) 5.46 5.46 0.00 
  peak 518
assign ( resid  83 and name   HB ) ( resid  85 and name HG1+ ) 5.46 5.46 0.00 
  peak 520
assign ( resid  54 and name HG1+ ) ( resid  55 and name  HG+ ) 5.17 5.17 0.00 
  peak 542
assign ( resid  33 and name   HN ) ( resid  36 and name  HB1 ) 4.63 4.63 0.00 
  peak 545
assign ( resid  69 and name   HN ) ( resid  72 and name  HG2 ) 5.44 5.44 0.00 
  peak 557
assign ( resid  38 and name HG2+ ) ( resid  40 and name   HN ) 5.18 5.18 0.00 
  peak 559
assign ( resid  52 and name   HA ) ( resid  59 and name HD1+ ) 5.17 5.17 0.00 
  peak 561
assign ( resid  38 and name   HB ) ( resid  40 and name   HN ) 4.89 4.89 0.00 
  peak 562
assign ( resid  14 and name  HE+ ) ( resid  15 and name   HB ) 4.35 4.35 0.00 
  peak 564
assign ( resid  70 and name HD21 ) ( resid  71 and name   HN ) 5.43 5.43 0.00 
  peak 570
assign ( resid  66 and name  HB2 ) ( resid  67 and name  HB2 ) 4.35 4.35 0.00 
  peak 575
assign ( resid  82 and name  HB+ ) ( resid  94 and name   HN ) 5.43 5.43 0.00 
  peak 577
assign ( resid  68 and name   HA ) ( resid  72 and name   HN ) 4.36 4.36 0.00 
  peak 579
assign ( resid  56 and name  HB2 ) ( resid  58 and name  HB+ ) 4.34 4.34 0.00 
  peak 585
assign ( resid  21 and name   HA ) ( resid  34 and name  HD+ ) 5.15 5.15 0.00 
  peak 593
assign ( resid  15 and name HG1+ ) ( resid  27 and name HE21 ) 5.42 5.42 0.00 
  peak 600
assign ( resid  72 and name   HN ) ( resid  73 and name   HA ) 4.88 4.88 0.00 
  peak 602
assign ( resid  71 and name   HN ) ( resid  73 and name  HD+ ) 4.88 4.88 0.00 
  peak 605
assign ( resid  35 and name   HN ) ( resid  36 and name  HB1 ) 4.61 4.61 0.00 
  peak 606
assign ( resid  80 and name  HD+ ) ( resid  81 and name   HA ) 5.15 5.15 0.00 
  peak 608
assign ( resid  54 and name   HA ) ( resid  57 and name  HB1 ) 5.42 5.42 0.00 
  peak 610
assign ( resid 101 and name   HB ) ( resid 102 and name  HD+ ) 4.33 4.33 0.00 
  peak 614
assign ( resid  98 and name   HA ) ( resid  99 and name  HB2 ) 5.14 5.14 0.00 
  peak 616
assign ( resid  86 and name   HN ) ( resid  87 and name   HA ) 4.87 4.87 0.00 
  peak 617
assign ( resid  93 and name  HD+ ) ( resid  94 and name   HN ) 4.33 4.33 0.00 
  peak 618
assign ( resid  74 and name   HA ) ( resid  75 and name  HB1 ) 5.41 5.41 0.00 
  peak 620
assign ( resid  78 and name  HB1 ) ( resid  79 and name HD22 ) 4.33 4.33 0.00 
  peak 621
assign ( resid  40 and name   HN ) ( resid  41 and name   HA ) 5.14 5.14 0.00 
  peak 637
assign ( resid  50 and name   HN ) ( resid  92 and name HG12 ) 4.86 4.86 0.00 
  peak 650
assign ( resid  75 and name  HD1 ) ( resid 100 and name HD2+ ) 5.13 5.13 0.00 
  peak 669
assign ( resid  86 and name  HB1 ) ( resid  89 and name  HB2 ) 5.40 5.40 0.00 
  peak 672
assign ( resid  38 and name HG2+ ) ( resid  41 and name   HN ) 5.40 5.40 0.00 
  peak 673
assign ( resid  38 and name   HB ) ( resid  42 and name   HN ) 5.50 5.50 0.00 
  peak 686
assign ( resid  42 and name   HN ) ( resid  43 and name  HB1 ) 5.50 5.50 0.00 
  peak 686
assign ( resid  93 and name   HN ) ( resid  94 and name   HA ) 5.39 5.39 0.00 
  peak 693
assign ( resid  74 and name   HA ) ( resid  75 and name  HG2 ) 4.31 4.31 0.00 
  peak 699
assign ( resid  70 and name   HA ) ( resid  74 and name  HB2 ) 4.31 4.31 0.00 
  peak 700
assign ( resid  70 and name  HB+ ) ( resid  72 and name   HN ) 5.39 5.39 0.00 
  peak 702
assign ( resid  15 and name HG2+ ) ( resid  16 and name  HG+ ) 4.58 4.58 0.00 
  peak 706
assign ( resid  15 and name HG2+ ) ( resid  17 and name  HA2 ) 4.85 4.85 0.00 
  peak 711
assign ( resid  70 and name   HA ) ( resid  75 and name  HD2 ) 5.11 5.11 0.00 
  peak 722
assign ( resid  54 and name HG2+ ) ( resid  55 and name  HB2 ) 5.11 5.11 0.00 
  peak 738
assign ( resid  19 and name   HA ) ( resid  73 and name  HE+ ) 4.30 4.30 0.00 
  peak 740
assign ( resid  65 and name  HB+ ) ( resid  66 and name   HA ) 4.30 4.30 0.00 
  peak 741
assign ( resid  66 and name   HN ) ( resid  67 and name   HA ) 5.11 5.11 0.00 
  peak 751
assign ( resid  90 and name  HB2 ) ( resid  90 and name HE21 ) 4.55 4.55 0.00 
  peak 772
assign ( resid  57 and name   HN ) ( resid  58 and name  HD+ ) 4.82 4.82 0.00 
  peak 779
assign ( resid  23 and name  HB+ ) ( resid  45 and name HG1+ ) 4.44 4.44 0.00 
  peak 781
assign ( resid  84 and name   HN ) ( resid  93 and name  HD+ ) 4.82 4.82 0.00 
  peak 792
assign ( resid  70 and name  HB+ ) ( resid  97 and name HG12 ) 4.28 4.28 0.00 
  peak 813
assign ( resid  23 and name  HE+ ) ( resid  59 and name HD2+ ) 4.81 4.81 0.00 
  peak 823
assign ( resid  21 and name   HN ) ( resid  34 and name  HD+ ) 4.74 4.74 0.00 
  peak 826
assign ( resid  56 and name  HB1 ) ( resid  58 and name   HN ) 4.54 4.54 0.00 
  peak 828
assign ( resid  54 and name HG2+ ) ( resid  94 and name   HN ) 4.81 4.81 0.00 
  peak 840
assign ( resid  15 and name HG1+ ) ( resid  16 and name  HG+ ) 4.72 4.72 0.00 
  peak 846
assign ( resid  15 and name HG1+ ) ( resid  68 and name  HG1 ) 4.95 4.95 0.00 
  peak 846
assign ( resid  53 and name  HB1 ) ( resid  58 and name  HB+ ) 4.26 4.26 0.00 
  peak 856
assign ( resid  52 and name   HA ) ( resid  59 and name  HB1 ) 5.06 5.06 0.00 
  peak 858
assign ( resid  80 and name  HE+ ) ( resid  97 and name HG12 ) 4.26 4.26 0.00 
  peak 864
assign ( resid  56 and name   HA ) ( resid  58 and name   HN ) 5.32 5.32 0.00 
  peak 870
assign ( resid  84 and name   HN ) ( resid  94 and name   HN ) 4.52 4.52 0.00 
  peak 871
assign ( resid  50 and name   HA ) ( resid  93 and name  HD+ ) 4.52 4.52 0.00 
  peak 881
assign ( resid  79 and name HD21 ) ( resid  97 and name HG2+ ) 4.25 4.25 0.00 
  peak 883
assign ( resid  69 and name  HB2 ) ( resid  73 and name  HD+ ) 4.79 4.79 0.00 
  peak 884
assign ( resid  56 and name   HN ) ( resid  58 and name  HB+ ) 5.05 5.05 0.00 
  peak 889
assign ( resid  15 and name HG1+ ) ( resid  72 and name  HE+ ) 4.25 4.25 0.00 
  peak 893
assign ( resid  52 and name   HN ) ( resid  54 and name HG2+ ) 5.50 5.50 0.00 
  peak 894
assign ( resid  15 and name HG1+ ) ( resid  68 and name  HB2 ) 4.25 4.25 0.00 
  peak 904
assign ( resid  23 and name  HD+ ) ( resid  42 and name  HB2 ) 4.25 4.25 0.00 
  peak 905
assign ( resid  72 and name  HB2 ) ( resid  72 and name  HE+ ) 4.25 4.25 0.00 
  peak 908
assign ( resid  54 and name HG1+ ) ( resid  94 and name   HN ) 4.91 4.91 0.00 
  peak 911
assign ( resid  14 and name   HA ) ( resid  15 and name HG1+ ) 5.04 5.04 0.00 
  peak 915
assign ( resid  58 and name  HD+ ) ( resid  60 and name   HB ) 4.47 4.47 0.00 
  peak 921
assign ( resid  70 and name   HN ) ( resid 100 and name HD1+ ) 4.77 4.77 0.00 
  peak 922
assign ( resid  66 and name  HB2 ) ( resid  69 and name  HB2 ) 5.04 5.04 0.00 
  peak 924
assign ( resid  59 and name HD2+ ) ( resid  86 and name  HE+ ) 4.24 4.24 0.00 
  peak 927
assign ( resid  52 and name   HN ) ( resid  53 and name   HN ) 4.50 4.50 0.00 
  peak 928
assign ( resid  28 and name HG2+ ) ( resid  33 and name   HA ) 4.51 4.51 0.00 
  peak 937
assign ( resid  58 and name   HZ ) ( resid  69 and name  HB2 ) 4.77 4.77 0.00 
  peak 939
assign ( resid  65 and name   HA ) ( resid  69 and name   HN ) 4.50 4.50 0.00 
  peak 945
assign ( resid  69 and name   HA ) ( resid  73 and name  HB2 ) 4.23 4.23 0.00 
  peak 948
assign ( resid  90 and name HE21 ) ( resid  92 and name HG11 ) 4.23 4.23 0.00 
  peak 949
assign ( resid  53 and name   HA ) ( resid  58 and name  HD+ ) 5.02 5.02 0.00 
  peak 965
assign ( resid  52 and name   HA ) ( resid  92 and name HD1+ ) 4.92 4.92 0.00 
  peak 966
assign ( resid  30 and name   HA ) ( resid  31 and name  HB2 ) 4.23 4.23 0.00 
  peak 971
assign ( resid  80 and name  HD+ ) ( resid  95 and name   HA ) 4.23 4.23 0.00 
  peak 974
assign ( resid  60 and name HG2+ ) ( resid  66 and name   HA ) 4.22 4.22 0.00 
  peak 984
assign ( resid  18 and name  HA2 ) ( resid  19 and name  HD+ ) 4.22 4.22 0.00 
  peak 985
assign ( resid  86 and name  HD+ ) ( resid  92 and name   HN ) 4.49 4.49 0.00 
  peak 989
assign ( resid  15 and name HG1+ ) ( resid  69 and name   HN ) 5.50 5.50 0.00 
  peak 991
assign ( resid  54 and name HG2+ ) ( resid  95 and name  HB+ ) 4.22 4.22 0.00 
  peak 992
assign ( resid  81 and name   HN ) ( resid  95 and name   HA ) 4.22 4.22 0.00 
  peak 995
assign ( resid  86 and name  HG+ ) ( resid  94 and name  HG2 ) 4.75 4.75 0.00 
  peak 1010
assign ( resid  52 and name   HN ) ( resid  53 and name   HA ) 5.00 5.00 0.00 
  peak 1016
assign ( resid  78 and name   HA ) ( resid  80 and name   HN ) 5.50 5.50 0.00 
  peak 1022
assign ( resid  19 and name   HA ) ( resid  34 and name  HD+ ) 5.00 5.00 0.00 
  peak 1026
assign ( resid  59 and name HD1+ ) ( resid  86 and name  HE+ ) 4.21 4.21 0.00 
  peak 1027
assign ( resid  52 and name   HA ) ( resid  86 and name  HE+ ) 5.26 5.26 0.00 
  peak 1036
assign ( resid  22 and name  HG+ ) ( resid  23 and name  HD+ ) 4.47 4.47 0.00 
  peak 1046
assign ( resid  67 and name   HA ) ( resid  70 and name HD22 ) 4.73 4.73 0.00 
  peak 1047
assign ( resid  50 and name   HA ) ( resid  93 and name   HN ) 4.99 4.99 0.00 
  peak 1051
assign ( resid  27 and name  HB2 ) ( resid  27 and name HE22 ) 4.20 4.20 0.00 
  peak 1056
assign ( resid  36 and name  HD+ ) ( resid  37 and name  HB1 ) 4.20 4.20 0.00 
  peak 1071
assign ( resid  53 and name  HB2 ) ( resid  66 and name  HB1 ) 4.46 4.46 0.00 
  peak 1073
assign ( resid  51 and name   HN ) ( resid  52 and name   HN ) 4.45 4.45 0.00 
  peak 1080
assign ( resid  20 and name  HG1 ) ( resid  27 and name   HA ) 5.24 5.24 0.00 
  peak 1083
assign ( resid  51 and name  HD+ ) ( resid  59 and name HD2+ ) 4.97 4.97 0.00 
  peak 1092
assign ( resid  14 and name  HG+ ) ( resid  15 and name   HB ) 5.50 5.50 0.00 
  peak 1094
assign ( resid  60 and name HG2+ ) ( resid  65 and name   HA ) 4.45 4.45 0.00 
  peak 1100
assign ( resid  36 and name  HD+ ) ( resid  37 and name   HA ) 4.18 4.18 0.00 
  peak 1116
assign ( resid  84 and name   HA ) ( resid  94 and name  HB+ ) 4.44 4.44 0.00 
  peak 1117
assign ( resid  56 and name  HB1 ) ( resid  58 and name  HB+ ) 4.18 4.18 0.00 
  peak 1118
assign ( resid  68 and name  HB2 ) ( resid  69 and name   HA ) 4.17 4.17 0.00 
  peak 1129
assign ( resid  66 and name  HB1 ) ( resid  95 and name  HB+ ) 4.17 4.17 0.00 
  peak 1134
assign ( resid  81 and name  HB1 ) ( resid  97 and name   HA ) 4.17 4.17 0.00 
  peak 1137
assign ( resid  38 and name HG2+ ) ( resid  42 and name   HN ) 4.69 4.69 0.00 
  peak 1140
assign ( resid  54 and name HG2+ ) ( resid  55 and name  HG+ ) 4.17 4.17 0.00 
  peak 1144
assign ( resid  80 and name  HD+ ) ( resid  81 and name  HB1 ) 4.95 4.95 0.00 
  peak 1151
assign ( resid  52 and name HG2+ ) ( resid  53 and name  HB1 ) 4.16 4.16 0.00 
  peak 1153
assign ( resid  20 and name  HB2 ) ( resid  21 and name   HN ) 4.68 4.68 0.00 
  peak 1155
assign ( resid  42 and name  HB1 ) ( resid  45 and name HG2+ ) 4.16 4.16 0.00 
  peak 1174
assign ( resid  50 and name   HN ) ( resid  92 and name HG11 ) 5.20 5.20 0.00 
  peak 1176
assign ( resid  71 and name  HB1 ) ( resid  73 and name   HN ) 4.93 4.93 0.00 
  peak 1187
assign ( resid  53 and name   HA ) ( resid  58 and name  HE+ ) 5.50 5.50 0.00 
  peak 1197
assign ( resid  19 and name  HE+ ) ( resid  31 and name  HB1 ) 4.40 4.40 0.00 
  peak 1212
assign ( resid  64 and name   HA ) ( resid  68 and name  HG1 ) 4.14 4.14 0.00 
  peak 1214
assign ( resid  54 and name HG2+ ) ( resid  96 and name   HB ) 4.14 4.14 0.00 
  peak 1222
assign ( resid  58 and name   HZ ) ( resid  66 and name   HN ) 4.92 4.92 0.00 
  peak 1224
assign ( resid  15 and name HG1+ ) ( resid  73 and name  HE+ ) 4.14 4.14 0.00 
  peak 1228
assign ( resid  80 and name  HE+ ) ( resid 100 and name HD1+ ) 4.14 4.14 0.00 
  peak 1229
assign ( resid  97 and name HD1+ ) ( resid 100 and name HD2+ ) 4.14 4.14 0.00 
  peak 1231
assign ( resid  86 and name  HB1 ) ( resid  89 and name HD21 ) 4.65 4.65 0.00 
  peak 1232
assign ( resid  42 and name  HB2 ) ( resid  45 and name HG1+ ) 4.43 4.43 0.00 
  peak 1235
assign ( resid  74 and name   HN ) ( resid 100 and name HD1+ ) 5.48 5.48 0.00 
  peak 1236
assign ( resid  79 and name HD22 ) ( resid 100 and name HD1+ ) 5.50 5.50 0.00 
  peak 1236
assign ( resid  18 and name  HA2 ) ( resid  19 and name  HE+ ) 4.45 4.45 0.00 
  peak 1239
assign ( resid  82 and name   HA ) ( resid  96 and name   HN ) 4.13 4.13 0.00 
  peak 1245
assign ( resid  18 and name  HA1 ) ( resid  19 and name  HD+ ) 4.65 4.65 0.00 
  peak 1246
assign ( resid  82 and name  HB+ ) ( resid  83 and name   HA ) 4.39 4.39 0.00 
  peak 1252
assign ( resid  94 and name   HA ) ( resid  94 and name  HG1 ) 4.13 4.13 0.00 
  peak 1256
assign ( resid  53 and name  HB1 ) ( resid  58 and name  HE+ ) 4.13 4.13 0.00 
  peak 1267
assign ( resid  85 and name   HN ) ( resid  92 and name HD1+ ) 4.12 4.12 0.00 
  peak 1279
assign ( resid  86 and name  HB1 ) ( resid  91 and name   HA ) 4.12 4.12 0.00 
  peak 1287
assign ( resid  58 and name  HB+ ) ( resid  60 and name HG2+ ) 5.15 5.15 0.00 
  peak 1288
assign ( resid  52 and name   HN ) ( resid  60 and name HG2+ ) 4.89 4.89 0.00 
  peak 1289
assign ( resid  52 and name   HA ) ( resid  59 and name  HB2 ) 5.14 5.14 0.00 
  peak 1297
assign ( resid  83 and name   HB ) ( resid  85 and name HG2+ ) 4.11 4.11 0.00 
  peak 1305
assign ( resid  42 and name   HN ) ( resid  43 and name  HD2 ) 4.11 4.11 0.00 
  peak 1307
assign ( resid  98 and name  HB2 ) ( resid  99 and name   HN ) 4.37 4.37 0.00 
  peak 1310
assign ( resid  81 and name  HE+ ) ( resid  83 and name   HA ) 4.11 4.11 0.00 
  peak 1311
assign ( resid  18 and name   HN ) ( resid  29 and name  HB1 ) 4.11 4.11 0.00 
  peak 1312
assign ( resid  80 and name  HE+ ) ( resid  96 and name   HA ) 4.11 4.11 0.00 
  peak 1314
assign ( resid  83 and name HG2+ ) ( resid  96 and name   HB ) 4.36 4.36 0.00 
  peak 1315
assign ( resid  30 and name   HA ) ( resid  32 and name   HN ) 4.11 4.11 0.00 
  peak 1320
assign ( resid  66 and name  HB1 ) ( resid  67 and name   HN ) 4.53 4.53 0.00 
  peak 1323
assign ( resid  55 and name  HB2 ) ( resid  97 and name HD1+ ) 4.10 4.10 0.00 
  peak 1336
assign ( resid  95 and name  HB+ ) ( resid  95 and name HE21 ) 4.09 4.09 0.00 
  peak 1349
assign ( resid  58 and name   HN ) ( resid  86 and name  HE+ ) 5.11 5.11 0.00 
  peak 1353
assign ( resid  42 and name   HA ) ( resid  43 and name  HG2 ) 4.34 4.34 0.00 
  peak 1355
assign ( resid  55 and name  HG+ ) ( resid  80 and name  HD+ ) 4.60 4.60 0.00 
  peak 1359
assign ( resid  70 and name   HA ) ( resid  80 and name  HE+ ) 4.08 4.08 0.00 
  peak 1381
assign ( resid  22 and name  HE+ ) ( resid  23 and name  HD+ ) 4.08 4.08 0.00 
  peak 1384
assign ( resid  82 and name  HB+ ) ( resid  95 and name   HA ) 4.59 4.59 0.00 
  peak 1388
assign ( resid  97 and name HG2+ ) ( resid  99 and name  HB1 ) 4.08 4.08 0.00 
  peak 1392
assign ( resid  19 and name  HE+ ) ( resid  30 and name   HA ) 4.07 4.07 0.00 
  peak 1393
assign ( resid  70 and name  HB+ ) ( resid  97 and name HG11 ) 4.58 4.58 0.00 
  peak 1394
assign ( resid  65 and name  HB+ ) ( resid  67 and name   HN ) 4.83 4.83 0.00 
  peak 1398
assign ( resid  77 and name   HA ) ( resid 100 and name HD2+ ) 5.00 5.00 0.00 
  peak 1401
assign ( resid  58 and name  HE+ ) ( resid  69 and name   HA ) 5.09 5.09 0.00 
  peak 1402
assign ( resid  60 and name   HB ) ( resid  65 and name  HB+ ) 4.07 4.07 0.00 
  peak 1406
assign ( resid  52 and name   HA ) ( resid  59 and name   HG ) 4.07 4.07 0.00 
  peak 1412
assign ( resid  15 and name HG1+ ) ( resid  73 and name  HD+ ) 4.59 4.59 0.00 
  peak 1417
assign ( resid  83 and name   HN ) ( resid  94 and name  HB+ ) 4.06 4.06 0.00 
  peak 1418
assign ( resid  55 and name  HG+ ) ( resid  97 and name HG12 ) 4.06 4.06 0.00 
  peak 1420
assign ( resid  82 and name   HA ) ( resid  95 and name   HA ) 4.06 4.06 0.00 
  peak 1423
assign ( resid  55 and name  HG+ ) ( resid  97 and name   HB ) 4.06 4.06 0.00 
  peak 1432
assign ( resid  53 and name  HB2 ) ( resid  58 and name  HE+ ) 4.05 4.05 0.00 
  peak 1448
assign ( resid  66 and name  HB1 ) ( resid  95 and name HE21 ) 4.05 4.05 0.00 
  peak 1455
assign ( resid  23 and name  HD+ ) ( resid  38 and name   HA ) 5.06 5.06 0.00 
  peak 1462
assign ( resid  14 and name  HE+ ) ( resid  65 and name   HA ) 4.30 4.30 0.00 
  peak 1463
assign ( resid  66 and name HD1+ ) ( resid  67 and name   HN ) 4.55 4.55 0.00 
  peak 1468
assign ( resid  71 and name   HN ) ( resid  72 and name   HA ) 5.05 5.05 0.00 
  peak 1471
assign ( resid  70 and name   HN ) ( resid  72 and name   HN ) 4.54 4.54 0.00 
  peak 1486
assign ( resid  66 and name  HB1 ) ( resid  69 and name  HB2 ) 4.29 4.29 0.00 
  peak 1489
assign ( resid  19 and name  HB2 ) ( resid  34 and name  HB+ ) 4.03 4.03 0.00 
  peak 1491
assign ( resid  81 and name  HG1 ) ( resid  83 and name   HA ) 5.04 5.04 0.00 
  peak 1498
assign ( resid  92 and name   HA ) ( resid  93 and name  HD+ ) 4.03 4.03 0.00 
  peak 1502
assign ( resid  55 and name  HG+ ) ( resid  96 and name   HA ) 4.03 4.03 0.00 
  peak 1505
assign ( resid  54 and name HG2+ ) ( resid  95 and name   HA ) 4.03 4.03 0.00 
  peak 1507
assign ( resid  85 and name HG1+ ) ( resid  87 and name  HD1 ) 4.53 4.53 0.00 
  peak 1508
assign ( resid  27 and name   HA ) ( resid  28 and name HG2+ ) 4.02 4.02 0.00 
  peak 1510
assign ( resid  80 and name  HD+ ) ( resid  97 and name   HN ) 4.27 4.27 0.00 
  peak 1522
assign ( resid  29 and name  HD1 ) ( resid  30 and name   HN ) 4.01 4.01 0.00 
  peak 1528
assign ( resid  52 and name HG2+ ) ( resid  94 and name  HG2 ) 4.26 4.26 0.00 
  peak 1535
assign ( resid  87 and name  HD2 ) ( resid  91 and name HG2+ ) 5.01 5.01 0.00 
  peak 1538
assign ( resid  85 and name HG1+ ) ( resid  87 and name  HD2 ) 4.53 4.53 0.00 
  peak 1552
assign ( resid  51 and name  HD+ ) ( resid  66 and name  HB2 ) 4.05 4.05 0.00 
  peak 1561
assign ( resid  23 and name  HD+ ) ( resid  42 and name  HB1 ) 4.00 4.00 0.00 
  peak 1568
assign ( resid  54 and name   HA ) ( resid  56 and name   HN ) 4.50 4.50 0.00 
  peak 1569
assign ( resid  28 and name HG2+ ) ( resid  29 and name   HA ) 4.74 4.74 0.00 
  peak 1570
assign ( resid  92 and name HD1+ ) ( resid  94 and name   HN ) 4.25 4.25 0.00 
  peak 1575
assign ( resid  23 and name  HB+ ) ( resid  24 and name   HN ) 3.99 3.99 0.00 
  peak 1577
assign ( resid  22 and name  HB1 ) ( resid  23 and name  HD+ ) 3.99 3.99 0.00 
  peak 1580
assign ( resid  84 and name   HN ) ( resid  85 and name   HN ) 4.24 4.24 0.00 
  peak 1581
assign ( resid  58 and name   HZ ) ( resid  65 and name   HA ) 4.49 4.49 0.00 
  peak 1586
assign ( resid  70 and name  HB+ ) ( resid 100 and name HD1+ ) 3.99 3.99 0.00 
  peak 1588
assign ( resid  15 and name   HA ) ( resid  65 and name  HB+ ) 4.48 4.48 0.00 
  peak 1590
assign ( resid  53 and name  HB2 ) ( resid  60 and name HG2+ ) 4.73 4.73 0.00 
  peak 1600
assign ( resid  87 and name  HD1 ) ( resid  91 and name HG2+ ) 5.01 5.01 0.00 
  peak 1601
assign ( resid  72 and name  HB1 ) ( resid  73 and name   HN ) 4.23 4.23 0.00 
  peak 1605
assign ( resid  58 and name  HD+ ) ( resid  59 and name   HA ) 4.47 4.47 0.00 
  peak 1616
assign ( resid  74 and name  HB2 ) ( resid  80 and name  HE+ ) 3.97 3.97 0.00 
  peak 1620
assign ( resid  59 and name HD2+ ) ( resid  94 and name   HA ) 4.97 4.97 0.00 
  peak 1622
assign ( resid  97 and name   HB ) ( resid  98 and name   HA ) 4.71 4.71 0.00 
  peak 1633
assign ( resid  54 and name HG2+ ) ( resid  55 and name   HA ) 4.71 4.71 0.00 
  peak 1638
assign ( resid  55 and name   HA ) ( resid  57 and name   HN ) 4.21 4.21 0.00 
  peak 1639
assign ( resid  50 and name   HA ) ( resid  92 and name HG2+ ) 3.96 3.96 0.00 
  peak 1649
assign ( resid  23 and name  HD+ ) ( resid  38 and name HG2+ ) 3.96 3.96 0.00 
  peak 1650
assign ( resid  80 and name  HB2 ) ( resid  95 and name HE21 ) 3.95 3.95 0.00 
  peak 1659
assign ( resid  23 and name  HE+ ) ( resid  38 and name HG2+ ) 3.95 3.95 0.00 
  peak 1660
assign ( resid  79 and name  HB2 ) ( resid 100 and name HD1+ ) 4.19 4.19 0.00 
  peak 1675
assign ( resid  56 and name  HB1 ) ( resid  58 and name  HD+ ) 3.94 3.94 0.00 
  peak 1678
assign ( resid  79 and name  HB1 ) ( resid  97 and name HG2+ ) 4.44 4.44 0.00 
  peak 1683
assign ( resid  19 and name   HA ) ( resid  19 and name  HE+ ) 4.68 4.68 0.00 
  peak 1687
assign ( resid  19 and name  HE+ ) ( resid  31 and name   HA ) 3.94 3.94 0.00 
  peak 1690
assign ( resid  16 and name   HN ) ( resid  16 and name  HB2 ) 3.93 3.93 0.00 
  peak 1702
assign ( resid  92 and name HG2+ ) ( resid  93 and name  HD+ ) 4.18 4.18 0.00 
  peak 1707
assign ( resid  31 and name HD2+ ) ( resid  34 and name  HB+ ) 3.93 3.93 0.00 
  peak 1711
assign ( resid  79 and name  HB2 ) ( resid  98 and name HD21 ) 3.93 3.93 0.00 
  peak 1712
assign ( resid  22 and name   HN ) ( resid  59 and name  HB2 ) 3.93 3.93 0.00 
  peak 1714
assign ( resid  90 and name   HN ) ( resid  90 and name  HB2 ) 4.17 4.17 0.00 
  peak 1724
assign ( resid  67 and name   HA ) ( resid  70 and name   HN ) 5.05 5.05 0.00 
  peak 1733
assign ( resid  68 and name   HA ) ( resid  70 and name   HN ) 5.37 5.37 0.00 
  peak 1733
assign ( resid  30 and name  HB1 ) ( resid  32 and name  HB1 ) 3.91 3.91 0.00 
  peak 1738
assign ( resid  28 and name   HN ) ( resid  34 and name  HD+ ) 3.91 3.91 0.00 
  peak 1740
assign ( resid  52 and name HG2+ ) ( resid  59 and name  HB1 ) 4.40 4.40 0.00 
  peak 1742
assign ( resid  55 and name  HB1 ) ( resid  97 and name HD1+ ) 3.91 3.91 0.00 
  peak 1747
assign ( resid  93 and name   HA ) ( resid  93 and name  HD+ ) 3.92 3.92 0.00 
  peak 1748
assign ( resid  97 and name HG2+ ) ( resid  99 and name   HA ) 4.63 4.63 0.00 
  peak 1754
assign ( resid  69 and name  HB1 ) ( resid  95 and name HE21 ) 4.63 4.63 0.00 
  peak 1761
assign ( resid  60 and name HG2+ ) ( resid  65 and name   HN ) 3.89 3.89 0.00 
  peak 1766
assign ( resid  80 and name   HA ) ( resid  81 and name  HB1 ) 4.13 4.13 0.00 
  peak 1782
assign ( resid  51 and name   HA ) ( resid  59 and name HD2+ ) 3.88 3.88 0.00 
  peak 1784
assign ( resid  31 and name   HA ) ( resid  31 and name   HG ) 3.88 3.88 0.00 
  peak 1787
assign ( resid  19 and name  HE+ ) ( resid  29 and name   HA ) 3.88 3.88 0.00 
  peak 1808
assign ( resid  70 and name HD21 ) ( resid 100 and name HD2+ ) 4.84 4.84 0.00 
  peak 1809
assign ( resid  23 and name  HD+ ) ( resid  38 and name HG1+ ) 4.36 4.36 0.00 
  peak 1812
assign ( resid  19 and name  HB2 ) ( resid  34 and name  HD+ ) 3.87 3.87 0.00 
  peak 1813
assign ( resid  22 and name  HB1 ) ( resid  22 and name  HD+ ) 3.87 3.87 0.00 
  peak 1822
assign ( resid  32 and name  HB2 ) ( resid  33 and name   HN ) 3.87 3.87 0.00 
  peak 1825
assign ( resid 100 and name   HN ) ( resid 100 and name HD2+ ) 3.87 3.87 0.00 
  peak 1829
assign ( resid  83 and name HG2+ ) ( resid  94 and name  HG2 ) 4.59 4.59 0.00 
  peak 1834
assign ( resid  58 and name  HE+ ) ( resid  73 and name  HD+ ) 4.59 4.59 0.00 
  peak 1841
assign ( resid  52 and name HG2+ ) ( resid  60 and name   HN ) 4.58 4.58 0.00 
  peak 1843
assign ( resid  51 and name  HD+ ) ( resid  93 and name   HN ) 3.86 3.86 0.00 
  peak 1848
assign ( resid  70 and name HD22 ) ( resid 100 and name HD1+ ) 4.34 4.34 0.00 
  peak 1859
assign ( resid  31 and name HD2+ ) ( resid  35 and name   HB ) 4.82 4.82 0.00 
  peak 1865
assign ( resid  31 and name   HA ) ( resid  34 and name  HD+ ) 3.85 3.85 0.00 
  peak 1866
assign ( resid  80 and name  HD+ ) ( resid  95 and name HE22 ) 3.85 3.85 0.00 
  peak 1869
assign ( resid  73 and name   HA ) ( resid  73 and name  HE+ ) 4.81 4.81 0.00 
  peak 1881
assign ( resid  58 and name   HZ ) ( resid  60 and name   HB ) 3.85 3.85 0.00 
  peak 1882
assign ( resid  52 and name   HA ) ( resid  60 and name HG2+ ) 3.84 3.84 0.00 
  peak 1890
assign ( resid  87 and name   HA ) ( resid  91 and name HG2+ ) 4.55 4.55 0.00 
  peak 1909
assign ( resid  58 and name   HZ ) ( resid  66 and name   HA ) 4.63 4.63 0.00 
  peak 1910
assign ( resid  66 and name   HA ) ( resid  95 and name HE21 ) 4.97 4.97 0.00 
  peak 1910
assign ( resid  70 and name  HB+ ) ( resid 100 and name HD2+ ) 3.83 3.83 0.00 
  peak 1912
assign ( resid  58 and name  HE+ ) ( resid  69 and name  HB2 ) 3.83 3.83 0.00 
  peak 1926
assign ( resid  83 and name HG2+ ) ( resid  94 and name  HB+ ) 3.82 3.82 0.00 
  peak 1941
assign ( resid  51 and name   HA ) ( resid  92 and name HD1+ ) 4.06 4.06 0.00 
  peak 1945
assign ( resid  23 and name  HD+ ) ( resid  45 and name HG2+ ) 3.93 3.93 0.00 
  peak 1949
assign ( resid  80 and name  HB2 ) ( resid  81 and name   HN ) 4.29 4.29 0.00 
  peak 1956
assign ( resid  28 and name HG2+ ) ( resid  30 and name  HB1 ) 4.76 4.76 0.00 
  peak 1961
assign ( resid  52 and name HG2+ ) ( resid  86 and name  HG+ ) 4.76 4.76 0.00 
  peak 1968
assign ( resid  56 and name  HB2 ) ( resid  58 and name  HD+ ) 3.80 3.80 0.00 
  peak 1975
assign ( resid  52 and name   HB ) ( resid  59 and name HD1+ ) 3.80 3.80 0.00 
  peak 1977
assign ( resid  86 and name  HB2 ) ( resid  92 and name   HN ) 3.80 3.80 0.00 
  peak 1985
assign ( resid  52 and name HG1+ ) ( resid  86 and name  HB2 ) 3.80 3.80 0.00 
  peak 1987
assign ( resid  52 and name HG1+ ) ( resid  57 and name   HA ) 4.03 4.03 0.00 
  peak 1991
assign ( resid  79 and name  HB2 ) ( resid  97 and name HG2+ ) 3.79 3.79 0.00 
  peak 1992
assign ( resid  90 and name   HN ) ( resid  92 and name HG11 ) 4.74 4.74 0.00 
  peak 1995
assign ( resid  51 and name  HD+ ) ( resid  93 and name  HB1 ) 4.03 4.03 0.00 
  peak 2000
assign ( resid  74 and name   HN ) ( resid  75 and name  HD2 ) 4.26 4.26 0.00 
  peak 2006
assign ( resid  52 and name HG1+ ) ( resid  86 and name  HG+ ) 3.78 3.78 0.00 
  peak 2016
assign ( resid  87 and name   HA ) ( resid  87 and name  HG+ ) 3.79 3.79 0.00 
  peak 2020
assign ( resid  52 and name   HN ) ( resid  59 and name HD2+ ) 3.78 3.78 0.00 
  peak 2023
assign ( resid  14 and name  HD+ ) ( resid  15 and name   HB ) 4.01 4.01 0.00 
  peak 2024
assign ( resid  77 and name  HG2 ) ( resid 100 and name HD2+ ) 3.78 3.78 0.00 
  peak 2025
assign ( resid  52 and name HG2+ ) ( resid  95 and name   HN ) 4.72 4.72 0.00 
  peak 2026
assign ( resid  80 and name  HD+ ) ( resid 100 and name HD1+ ) 4.48 4.48 0.00 
  peak 2027
assign ( resid  54 and name HG2+ ) ( resid  96 and name   HA ) 3.78 3.78 0.00 
  peak 2028
assign ( resid  28 and name   HA ) ( resid  29 and name  HD2 ) 3.77 3.77 0.00 
  peak 2030
assign ( resid  34 and name  HD+ ) ( resid  35 and name HG2+ ) 3.77 3.77 0.00 
  peak 2032
assign ( resid  14 and name  HE+ ) ( resid  15 and name HG1+ ) 3.77 3.77 0.00 
  peak 2033
assign ( resid  72 and name   HA ) ( resid  73 and name  HD+ ) 4.47 4.47 0.00 
  peak 2043
assign ( resid  81 and name  HG2 ) ( resid  82 and name   HN ) 4.00 4.00 0.00 
  peak 2053
assign ( resid  21 and name  HB1 ) ( resid  23 and name  HD+ ) 3.76 3.76 0.00 
  peak 2056
assign ( resid  54 and name HG2+ ) ( resid  94 and name   HA ) 3.76 3.76 0.00 
  peak 2057
assign ( resid  68 and name  HB2 ) ( resid  71 and name   HG ) 4.70 4.70 0.00 
  peak 2059
assign ( resid  52 and name   HB ) ( resid  94 and name   HA ) 4.46 4.46 0.00 
  peak 2064
assign ( resid  19 and name  HD+ ) ( resid  29 and name   HA ) 3.76 3.76 0.00 
  peak 2066
assign ( resid  59 and name HD2+ ) ( resid  86 and name  HD+ ) 5.15 5.15 0.00 
  peak 2078
assign ( resid  85 and name HG2+ ) ( resid  86 and name  HD+ ) 5.42 5.42 0.00 
  peak 2078
assign ( resid  86 and name  HE+ ) ( resid  89 and name HD21 ) 3.98 3.98 0.00 
  peak 2081
assign ( resid  62 and name  HD1 ) ( resid  65 and name  HB+ ) 3.74 3.74 0.00 
  peak 2087
assign ( resid  19 and name  HE+ ) ( resid  28 and name HG2+ ) 5.39 5.39 0.00 
  peak 2089
assign ( resid  72 and name  HG1 ) ( resid  73 and name  HD+ ) 3.74 3.74 0.00 
  peak 2094
assign ( resid  22 and name   HN ) ( resid  59 and name  HB1 ) 4.09 4.09 0.00 
  peak 2099
assign ( resid  52 and name   HB ) ( resid  92 and name   HB ) 4.43 4.43 0.00 
  peak 2104
assign ( resid  54 and name HG2+ ) ( resid  96 and name   HN ) 3.80 3.80 0.00 
  peak 2114
assign ( resid  52 and name HG2+ ) ( resid  59 and name   HG ) 3.73 3.73 0.00 
  peak 2119
assign ( resid  72 and name  HB1 ) ( resid  73 and name  HD+ ) 4.19 4.19 0.00 
  peak 2126
assign ( resid  97 and name HG2+ ) ( resid  98 and name   HA ) 4.19 4.19 0.00 
  peak 2129
assign ( resid  15 and name HG2+ ) ( resid  16 and name   HA ) 4.65 4.65 0.00 
  peak 2130
assign ( resid  70 and name   HA ) ( resid 100 and name  HB2 ) 4.65 4.65 0.00 
  peak 2133
assign ( resid  56 and name   HN ) ( resid  58 and name  HD+ ) 4.18 4.18 0.00 
  peak 2138
assign ( resid  32 and name HD21 ) ( resid  36 and name  HB2 ) 3.71 3.71 0.00 
  peak 2148
assign ( resid  54 and name HG2+ ) ( resid  94 and name  HG1 ) 4.40 4.40 0.00 
  peak 2160
assign ( resid  59 and name HD1+ ) ( resid  86 and name  HD+ ) 4.40 4.40 0.00 
  peak 2163
assign ( resid  52 and name   HA ) ( resid  60 and name   HN ) 3.70 3.70 0.00 
  peak 2174
assign ( resid  23 and name  HD+ ) ( resid  45 and name HG1+ ) 3.93 3.93 0.00 
  peak 2176
assign ( resid 102 and name   HA ) ( resid 102 and name  HD+ ) 3.76 3.76 0.00 
  peak 2179
assign ( resid  58 and name  HE+ ) ( resid  60 and name   HB ) 3.69 3.69 0.00 
  peak 2182
assign ( resid  30 and name  HB2 ) ( resid  34 and name   HN ) 4.38 4.38 0.00 
  peak 2184
assign ( resid  84 and name   HN ) ( resid  85 and name HG1+ ) 4.15 4.15 0.00 
  peak 2187
assign ( resid  52 and name HG1+ ) ( resid  94 and name   HA ) 3.69 3.69 0.00 
  peak 2188
assign ( resid  69 and name   HA ) ( resid  72 and name  HG2 ) 4.61 4.61 0.00 
  peak 2189
assign ( resid  72 and name  HE+ ) ( resid  73 and name  HE+ ) 3.69 3.69 0.00 
  peak 2191
assign ( resid  69 and name  HB1 ) ( resid  70 and name  HB+ ) 3.91 3.91 0.00 
  peak 2193
assign ( resid  62 and name  HD2 ) ( resid  65 and name  HB+ ) 3.74 3.74 0.00 
  peak 2197
assign ( resid  59 and name HD1+ ) ( resid  92 and name HG12 ) 3.68 3.68 0.00 
  peak 2198
assign ( resid  22 and name   HN ) ( resid  22 and name  HB2 ) 3.86 3.86 0.00 
  peak 2207
assign ( resid  89 and name  HB2 ) ( resid  90 and name HE22 ) 3.67 3.67 0.00 
  peak 2209
assign ( resid  72 and name  HG2 ) ( resid  73 and name  HE+ ) 4.36 4.36 0.00 
  peak 2217
assign ( resid  16 and name   HA ) ( resid  72 and name  HE+ ) 3.90 3.90 0.00 
  peak 2218
assign ( resid  70 and name   HA ) ( resid 100 and name HD2+ ) 4.13 4.13 0.00 
  peak 2222
assign ( resid  80 and name   HA ) ( resid  98 and name   HN ) 4.34 4.34 0.00 
  peak 2244
assign ( resid  50 and name   HA ) ( resid  59 and name HD2+ ) 4.12 4.12 0.00 
  peak 2245
assign ( resid  99 and name  HB1 ) ( resid 100 and name HD2+ ) 3.88 3.88 0.00 
  peak 2247
assign ( resid  70 and name  HB+ ) ( resid  80 and name  HE+ ) 3.65 3.65 0.00 
  peak 2256
assign ( resid  23 and name  HD+ ) ( resid  24 and name   HN ) 4.33 4.33 0.00 
  peak 2263
assign ( resid  86 and name  HE+ ) ( resid  92 and name HD1+ ) 3.64 3.64 0.00 
  peak 2269
assign ( resid  58 and name  HE+ ) ( resid  73 and name  HE+ ) 4.54 4.54 0.00 
  peak 2284
assign ( resid  38 and name   HA ) ( resid  42 and name  HB2 ) 4.54 4.54 0.00 
  peak 2286
assign ( resid  80 and name  HD+ ) ( resid  95 and name  HG2 ) 3.63 3.63 0.00 
  peak 2292
assign ( resid  66 and name  HB1 ) ( resid  95 and name  HG2 ) 4.53 4.53 0.00 
  peak 2294
assign ( resid  27 and name  HG2 ) ( resid  28 and name   HA ) 3.61 3.61 0.00 
  peak 2310
assign ( resid  19 and name  HD+ ) ( resid  34 and name  HB+ ) 3.64 3.64 0.00 
  peak 2312
assign ( resid  68 and name   HA ) ( resid  72 and name  HG2 ) 4.07 4.07 0.00 
  peak 2315
assign ( resid  77 and name   HN ) ( resid 100 and name HD1+ ) 3.61 3.61 0.00 
  peak 2316
assign ( resid  59 and name   HG ) ( resid  92 and name HG12 ) 3.61 3.61 0.00 
  peak 2323
assign ( resid  42 and name  HB1 ) ( resid  43 and name  HD2 ) 4.50 4.50 0.00 
  peak 2337
assign ( resid  86 and name   HA ) ( resid  86 and name  HD+ ) 3.60 3.60 0.00 
  peak 2338
assign ( resid  97 and name   HB ) ( resid 101 and name HG2+ ) 5.21 5.21 0.00 
  peak 2342
assign ( resid  86 and name  HB1 ) ( resid  92 and name HG11 ) 3.68 3.68 0.00 
  peak 2352
assign ( resid  33 and name   HA ) ( resid  36 and name  HD+ ) 3.58 3.58 0.00 
  peak 2361
assign ( resid  53 and name   HA ) ( resid  54 and name HG2+ ) 3.57 3.57 0.00 
  peak 2371
assign ( resid  80 and name  HB1 ) ( resid  95 and name  HB+ ) 4.24 4.24 0.00 
  peak 2376
assign ( resid  19 and name  HD+ ) ( resid  31 and name HD1+ ) 4.24 4.24 0.00 
  peak 2383
assign ( resid  50 and name  HB2 ) ( resid  92 and name HG2+ ) 3.56 3.56 0.00 
  peak 2388
assign ( resid  97 and name HG2+ ) ( resid  99 and name  HB2 ) 3.56 3.56 0.00 
  peak 2390
assign ( resid  51 and name   HA ) ( resid  51 and name  HD+ ) 3.56 3.56 0.00 
  peak 2391
assign ( resid  15 and name   HN ) ( resid  15 and name HG2+ ) 3.78 3.78 0.00 
  peak 2393
assign ( resid  51 and name   HN ) ( resid  59 and name HD2+ ) 3.55 3.55 0.00 
  peak 2398
assign ( resid  38 and name HG1+ ) ( resid  39 and name   HA ) 4.11 4.11 0.00 
  peak 2400
assign ( resid  52 and name HG2+ ) ( resid  57 and name   HA ) 4.23 4.23 0.00 
  peak 2400
assign ( resid  75 and name   HA ) ( resid 100 and name HD1+ ) 4.71 4.71 0.00 
  peak 2403
assign ( resid  97 and name   HA ) ( resid 100 and name HD1+ ) 5.11 5.11 0.00 
  peak 2403
assign ( resid  93 and name   HN ) ( resid  93 and name  HD+ ) 3.53 3.53 0.00 
  peak 2420
assign ( resid  72 and name  HB2 ) ( resid  73 and name  HE+ ) 3.53 3.53 0.00 
  peak 2421
assign ( resid  86 and name  HG+ ) ( resid  91 and name   HA ) 4.41 4.41 0.00 
  peak 2426
assign ( resid  86 and name  HE+ ) ( resid  94 and name  HG2 ) 3.97 3.97 0.00 
  peak 2427
assign ( resid  14 and name   HA ) ( resid  14 and name  HD+ ) 3.74 3.74 0.00 
  peak 2437
assign ( resid  85 and name HG2+ ) ( resid  94 and name  HG2 ) 4.18 4.18 0.00 
  peak 2438
assign ( resid  52 and name HG1+ ) ( resid  86 and name  HD+ ) 3.51 3.51 0.00 
  peak 2447
assign ( resid  70 and name   HA ) ( resid 100 and name HD1+ ) 3.51 3.51 0.00 
  peak 2457
assign ( resid  19 and name   HA ) ( resid  19 and name  HD+ ) 3.51 3.51 0.00 
  peak 2458
assign ( resid  52 and name HG1+ ) ( resid  86 and name  HE+ ) 3.51 3.51 0.00 
  peak 2459
assign ( resid  68 and name   HA ) ( resid  69 and name   HN ) 3.51 3.51 0.00 
  peak 2463
assign ( resid  74 and name  HB1 ) ( resid 100 and name  HB2 ) 4.04 4.04 0.00 
  peak 2466
assign ( resid  86 and name  HG+ ) ( resid  92 and name HG11 ) 4.09 4.09 0.00 
  peak 2472
assign ( resid  28 and name HG2+ ) ( resid  34 and name   HA ) 3.50 3.50 0.00 
  peak 2476
assign ( resid  52 and name HG2+ ) ( resid  59 and name   HA ) 3.49 3.49 0.00 
  peak 2481
assign ( resid  72 and name  HB2 ) ( resid  73 and name  HD+ ) 3.49 3.49 0.00 
  peak 2482
assign ( resid  31 and name  HB1 ) ( resid  35 and name HG2+ ) 4.15 4.15 0.00 
  peak 2483
assign ( resid  72 and name  HG1 ) ( resid  72 and name  HE+ ) 3.49 3.49 0.00 
  peak 2485
assign ( resid  85 and name HG2+ ) ( resid  94 and name  HB+ ) 3.49 3.49 0.00 
  peak 2489
assign ( resid  52 and name   HA ) ( resid  59 and name HD2+ ) 3.49 3.49 0.00 
  peak 2491
assign ( resid  52 and name HG2+ ) ( resid  94 and name   HA ) 4.36 4.36 0.00 
  peak 2493
assign ( resid  16 and name  HG+ ) ( resid  27 and name HE22 ) 4.33 4.33 0.00 
  peak 2499
assign ( resid  31 and name  HB1 ) ( resid  32 and name   HN ) 3.47 3.47 0.00 
  peak 2520
assign ( resid  80 and name  HD+ ) ( resid  95 and name  HG1 ) 3.74 3.74 0.00 
  peak 2522
assign ( resid  90 and name  HB2 ) ( resid  92 and name HG2+ ) 3.90 3.90 0.00 
  peak 2525
assign ( resid  51 and name  HB+ ) ( resid  60 and name HG2+ ) 3.46 3.46 0.00 
  peak 2527
assign ( resid  72 and name  HG2 ) ( resid  72 and name  HE+ ) 3.45 3.45 0.00 
  peak 2549
assign ( resid  86 and name  HB2 ) ( resid  94 and name  HG1 ) 3.66 3.66 0.00 
  peak 2553
assign ( resid  58 and name  HE+ ) ( resid  66 and name   HA ) 3.87 3.87 0.00 
  peak 2557
assign ( resid  58 and name  HD+ ) ( resid  59 and name   HN ) 3.44 3.44 0.00 
  peak 2561
assign ( resid  86 and name  HD+ ) ( resid  92 and name HG11 ) 4.05 4.05 0.00 
  peak 2562
assign ( resid  72 and name  HG1 ) ( resid  73 and name  HE+ ) 3.44 3.44 0.00 
  peak 2566
assign ( resid  18 and name  HA1 ) ( resid  29 and name   HA ) 3.44 3.44 0.00 
  peak 2567
assign ( resid  69 and name   HA ) ( resid  73 and name  HE+ ) 3.87 3.87 0.00 
  peak 2569
assign ( resid  81 and name  HE+ ) ( resid  83 and name HG2+ ) 3.43 3.43 0.00 
  peak 2572
assign ( resid  52 and name   HB ) ( resid  92 and name HD1+ ) 3.43 3.43 0.00 
  peak 2581
assign ( resid  92 and name HD1+ ) ( resid  94 and name  HG1 ) 3.42 3.42 0.00 
  peak 2583
assign ( resid  51 and name  HD+ ) ( resid  93 and name  HD+ ) 3.41 3.41 0.00 
  peak 2595
assign ( resid  36 and name   HN ) ( resid  36 and name  HD+ ) 4.25 4.25 0.00 
  peak 2608
assign ( resid  22 and name  HD+ ) ( resid  59 and name  HB1 ) 4.04 4.04 0.00 
  peak 2610
assign ( resid  75 and name   HA ) ( resid 100 and name HD2+ ) 3.39 3.39 0.00 
  peak 2622
assign ( resid  65 and name  HB+ ) ( resid  66 and name HD1+ ) 4.26 4.26 0.00 
  peak 2625
assign ( resid  82 and name  HB+ ) ( resid  93 and name  HD+ ) 4.23 4.23 0.00 
  peak 2627
assign ( resid  19 and name  HD+ ) ( resid  28 and name HG2+ ) 3.99 3.99 0.00 
  peak 2632
assign ( resid  70 and name  HB+ ) ( resid  70 and name HD21 ) 3.39 3.39 0.00 
  peak 2633
assign ( resid  92 and name HD1+ ) ( resid  94 and name  HG2 ) 3.38 3.38 0.00 
  peak 2634
assign ( resid  52 and name   HB ) ( resid  59 and name HD2+ ) 3.38 3.38 0.00 
  peak 2641
assign ( resid  90 and name  HG+ ) ( resid  92 and name HG2+ ) 3.37 3.37 0.00 
  peak 2646
assign ( resid  97 and name HG12 ) ( resid 100 and name HD1+ ) 3.37 3.37 0.00 
  peak 2647
assign ( resid  31 and name HD1+ ) ( resid  35 and name HG2+ ) 3.37 3.37 0.00 
  peak 2649
assign ( resid  50 and name  HB1 ) ( resid  92 and name HG2+ ) 3.56 3.56 0.00 
  peak 2656
assign ( resid  81 and name  HG2 ) ( resid  96 and name HG2+ ) 4.20 4.20 0.00 
  peak 2658
assign ( resid  31 and name HD1+ ) ( resid  34 and name  HD+ ) 3.36 3.36 0.00 
  peak 2664
assign ( resid  51 and name  HD+ ) ( resid  93 and name  HB2 ) 3.36 3.36 0.00 
  peak 2669
assign ( resid  81 and name  HE+ ) ( resid  96 and name HG2+ ) 3.77 3.77 0.00 
  peak 2673
assign ( resid  68 and name   HA ) ( resid  71 and name   HN ) 3.35 3.35 0.00 
  peak 2675
assign ( resid  62 and name  HG2 ) ( resid  65 and name   HN ) 3.86 3.86 0.00 
  peak 2681
assign ( resid  54 and name HG1+ ) ( resid  85 and name HG2+ ) 3.91 3.91 0.00 
  peak 2686
assign ( resid  34 and name   HA ) ( resid  34 and name  HD+ ) 3.35 3.35 0.00 
  peak 2687
assign ( resid  23 and name  HE+ ) ( resid  59 and name  HB1 ) 3.96 3.96 0.00 
  peak 2696
assign ( resid  72 and name  HG2 ) ( resid  73 and name  HD+ ) 3.54 3.54 0.00 
  peak 2697
assign ( resid  91 and name   HA ) ( resid  91 and name HG2+ ) 3.39 3.39 0.00 
  peak 2698
assign ( resid  19 and name  HE+ ) ( resid  31 and name HD1+ ) 4.16 4.16 0.00 
  peak 2704
assign ( resid  59 and name   HA ) ( resid  66 and name HD1+ ) 5.02 5.02 0.00 
  peak 2708
assign ( resid  31 and name HD2+ ) ( resid  34 and name  HD+ ) 3.32 3.32 0.00 
  peak 2709
assign ( resid  59 and name HD1+ ) ( resid  92 and name HG11 ) 3.74 3.74 0.00 
  peak 2711
assign ( resid  80 and name  HD+ ) ( resid  97 and name   HA ) 3.93 3.93 0.00 
  peak 2721
assign ( resid  58 and name  HD+ ) ( resid  60 and name HG2+ ) 3.92 3.92 0.00 
  peak 2722
assign ( resid  15 and name HG1+ ) ( resid  65 and name  HB+ ) 3.30 3.30 0.00 
  peak 2725
assign ( resid  19 and name  HD+ ) ( resid  31 and name HD2+ ) 3.75 3.75 0.00 
  peak 2727
assign ( resid  23 and name  HE+ ) ( resid  38 and name HG1+ ) 4.06 4.06 0.00 
  peak 2727
assign ( resid  54 and name HG1+ ) ( resid  83 and name HG2+ ) 3.28 3.28 0.00 
  peak 2746
assign ( resid  92 and name   HA ) ( resid  92 and name HG11 ) 3.69 3.69 0.00 
  peak 2747
assign ( resid  15 and name   HN ) ( resid  15 and name   HB ) 3.41 3.41 0.00 
  peak 2749
assign ( resid  69 and name   HA ) ( resid  73 and name  HD+ ) 3.27 3.27 0.00 
  peak 2751
assign ( resid  14 and name   HA ) ( resid  15 and name   HN ) 3.26 3.26 0.00 
  peak 2757
assign ( resid  82 and name  HB+ ) ( resid  95 and name  HG1 ) 3.86 3.86 0.00 
  peak 2765
assign ( resid  54 and name HG2+ ) ( resid  83 and name HG2+ ) 3.25 3.25 0.00 
  peak 2769
assign ( resid  81 and name  HG2 ) ( resid  81 and name  HE+ ) 3.24 3.24 0.00 
  peak 2770
assign ( resid  72 and name  HE+ ) ( resid  73 and name  HD+ ) 3.24 3.24 0.00 
  peak 2771
assign ( resid  14 and name  HG+ ) ( resid  14 and name  HE+ ) 3.24 3.24 0.00 
  peak 2773
assign ( resid  86 and name  HG+ ) ( resid  89 and name HD21 ) 3.24 3.24 0.00 
  peak 2777
assign ( resid  52 and name HG1+ ) ( resid  94 and name  HB+ ) 3.30 3.30 0.00 
  peak 2779
assign ( resid  15 and name   HB ) ( resid  65 and name  HB+ ) 3.70 3.70 0.00 
  peak 2784
assign ( resid  80 and name  HD+ ) ( resid  97 and name HG12 ) 3.43 3.43 0.00 
  peak 2788
assign ( resid  55 and name   HA ) ( resid  96 and name HG2+ ) 3.63 3.63 0.00 
  peak 2789
assign ( resid  86 and name  HB1 ) ( resid  92 and name HD1+ ) 3.28 3.28 0.00 
  peak 2799
assign ( resid  70 and name HD21 ) ( resid  80 and name  HD+ ) 3.21 3.21 0.00 
  peak 2800
assign ( resid  86 and name  HD+ ) ( resid  92 and name HD1+ ) 3.21 3.21 0.00 
  peak 2802
assign ( resid  70 and name HD22 ) ( resid  80 and name  HD+ ) 3.20 3.20 0.00 
  peak 2803
assign ( resid  58 and name   HZ ) ( resid  65 and name  HB+ ) 3.20 3.20 0.00 
  peak 2806
assign ( resid  92 and name   HN ) ( resid  92 and name HG12 ) 3.78 3.78 0.00 
  peak 2814
assign ( resid  58 and name   HA ) ( resid  58 and name  HD+ ) 3.57 3.57 0.00 
  peak 2819
assign ( resid  58 and name  HE+ ) ( resid  65 and name  HB+ ) 3.16 3.16 0.00 
  peak 2827
assign ( resid  33 and name   HA ) ( resid  33 and name  HG2 ) 4.07 4.07 0.00 
  peak 2839
assign ( resid  54 and name HG2+ ) ( resid  94 and name  HB+ ) 3.67 3.67 0.00 
  peak 2840
assign ( resid  58 and name   HZ ) ( resid  60 and name HG2+ ) 3.14 3.14 0.00 
  peak 2843
assign ( resid  80 and name  HD+ ) ( resid  97 and name HG2+ ) 3.92 3.92 0.00 
  peak 2851
assign ( resid  55 and name  HG+ ) ( resid  97 and name HD1+ ) 3.12 3.12 0.00 
  peak 2855
assign ( resid  59 and name HD2+ ) ( resid  92 and name   HB ) 3.10 3.10 0.00 
  peak 2863
assign ( resid  52 and name HG2+ ) ( resid  58 and name   HN ) 3.07 3.07 0.00 
  peak 2877
assign ( resid  36 and name   HA ) ( resid  36 and name  HD+ ) 3.07 3.07 0.00 
  peak 2878
assign ( resid  80 and name  HD+ ) ( resid  97 and name HG11 ) 3.44 3.44 0.00 
  peak 2885
assign ( resid  80 and name   HN ) ( resid  80 and name  HD+ ) 3.81 3.81 0.00 
  peak 2888
assign ( resid  14 and name  HD+ ) ( resid  14 and name  HE+ ) 2.99 2.99 0.00 
  peak 2912
assign ( resid  28 and name HG2+ ) ( resid  34 and name  HD+ ) 2.99 2.99 0.00 
  peak 2913
assign ( resid  92 and name   HA ) ( resid  92 and name HG2+ ) 2.99 2.99 0.00 
  peak 2915
assign ( resid  73 and name   HA ) ( resid  73 and name  HD+ ) 3.17 3.17 0.00 
  peak 2917
assign ( resid  77 and name  HG1 ) ( resid 100 and name HD2+ ) 3.78 3.78 0.00 
  peak 2920
assign ( resid  65 and name  HB+ ) ( resid  66 and name   HN ) 2.98 2.98 0.00 
  peak 2921
assign ( resid  58 and name  HE+ ) ( resid  60 and name HG2+ ) 2.96 2.96 0.00 
  peak 2924
assign ( resid  23 and name   HA ) ( resid  23 and name  HD+ ) 3.63 3.63 0.00 
  peak 2939
assign ( resid  87 and name  HB1 ) ( resid  87 and name  HG+ ) 2.89 2.89 0.00 
  peak 2941
assign ( resid  60 and name HG2+ ) ( resid  65 and name  HB+ ) 2.85 2.85 0.00 
  peak 2953
assign ( resid  80 and name   HA ) ( resid  80 and name  HD+ ) 2.82 2.82 0.00 
  peak 2963
assign ( resid  71 and name   HG ) ( resid  72 and name  HG2 ) 2.81 2.81 0.00 
  peak 2965
assign ( resid  81 and name  HG1 ) ( resid  81 and name  HD+ ) 2.81 2.81 0.00 
  peak 2967
assign ( resid  90 and name  HB2 ) ( resid  90 and name  HG+ ) 2.74 2.74 0.00 
  peak 2983
assign ( resid  92 and name HG2+ ) ( resid  92 and name HG12 ) 2.99 2.99 0.00 
  peak 2984
assign ( resid  19 and name  HE+ ) ( resid  31 and name HD2+ ) 2.71 2.71 0.00 
  peak 2988
assign ( resid  86 and name  HB2 ) ( resid  92 and name HG11 ) 2.87 2.87 0.00 
  peak 2992
assign ( resid  96 and name HG2+ ) ( resid 101 and name HG2+ ) 3.03 3.03 0.00 
  peak 2994
assign ( resid  86 and name  HG+ ) ( resid  86 and name  HD+ ) 2.66 2.66 0.00 
  peak 2999
assign ( resid  14 and name  HG+ ) ( resid  14 and name  HD+ ) 2.76 2.76 0.00 
  peak 3009
assign ( resid  92 and name   HB ) ( resid  92 and name HD1+ ) 3.20 3.20 0.00 
  peak 3022
assign ( resid  27 and name  HB1 ) ( resid  27 and name  HG2 ) 2.86 2.86 0.00 
  peak 3023
assign ( resid  59 and name HD2+ ) ( resid  92 and name HG2+ ) 2.58 2.58 0.00 
  peak 3031
assign ( resid  59 and name HD2+ ) ( resid  92 and name HD1+ ) 2.83 2.83 0.00 
  peak 3031
assign ( resid  22 and name  HB2 ) ( resid  59 and name  HB1 ) 2.76 2.76 0.00 
  peak 3049
assign ( resid  83 and name   HN ) ( resid  94 and name  HG1 ) 5.19 5.19 0.00 
  peak 3058
assign ( resid  80 and name   HA ) ( resid  95 and name  HG2 ) 4.57 4.57 0.00 
  peak 3063
assign ( resid  91 and name   HA ) ( resid  92 and name HG11 ) 4.56 4.56 0.00 
  peak 3069
assign ( resid  38 and name   HB ) ( resid  39 and name  HB2 ) 5.50 5.50 0.00 
  peak 3072
assign ( resid  39 and name  HB2 ) ( resid  43 and name  HB1 ) 5.50 5.50 0.00 
  peak 3072
assign ( resid  30 and name   HA ) ( resid  31 and name   HA ) 4.57 4.57 0.00 
  peak 3077
assign ( resid  70 and name   HN ) ( resid  71 and name  HB2 ) 5.50 5.50 0.00 
  peak 3078
assign ( resid  52 and name   HB ) ( resid  53 and name   HN ) 4.26 4.26 0.00 
  peak 3086
assign ( resid  90 and name HE22 ) ( resid  92 and name HG2+ ) 4.75 4.75 0.00 
  peak 3090
assign ( resid  90 and name HE22 ) ( resid  92 and name HD1+ ) 5.24 5.24 0.00 
  peak 3090
assign ( resid  28 and name HG2+ ) ( resid  29 and name  HD2 ) 4.52 4.52 0.00 
  peak 3092
assign ( resid  66 and name   HG ) ( resid  67 and name   HN ) 5.07 5.07 0.00 
  peak 3096
assign ( resid  52 and name HG1+ ) ( resid  54 and name   HN ) 4.62 4.62 0.00 
  peak 3103
assign ( resid  39 and name   HA ) ( resid  43 and name  HB1 ) 4.47 4.47 0.00 
  peak 3109
assign ( resid  32 and name   HA ) ( resid  34 and name   HN ) 4.75 4.75 0.00 
  peak 3111
assign ( resid  58 and name   HA ) ( resid  59 and name   HG ) 4.83 4.83 0.00 
  peak 3113
assign ( resid  78 and name   HA ) ( resid  79 and name  HB2 ) 5.02 5.02 0.00 
  peak 3114
assign ( resid  35 and name   HA ) ( resid  38 and name HG2+ ) 4.46 4.46 0.00 
  peak 3115
assign ( resid  65 and name   HA ) ( resid  67 and name   HN ) 5.01 5.01 0.00 
  peak 3118
assign ( resid  72 and name   HA ) ( resid  74 and name   HN ) 5.50 5.50 0.00 
  peak 3119
assign ( resid  98 and name   HA ) ( resid  98 and name HD22 ) 4.99 4.99 0.00 
  peak 3123
assign ( resid  38 and name   HB ) ( resid  39 and name  HB1 ) 5.50 5.50 0.00 
  peak 3128
assign ( resid  39 and name  HB1 ) ( resid  43 and name  HB1 ) 5.50 5.50 0.00 
  peak 3128
assign ( resid  84 and name  HG+ ) ( resid  93 and name  HB2 ) 4.99 4.99 0.00 
  peak 3133
assign ( resid  73 and name   HA ) ( resid  75 and name  HD1 ) 4.40 4.40 0.00 
  peak 3143
assign ( resid  15 and name   HA ) ( resid  16 and name  HG+ ) 4.40 4.40 0.00 
  peak 3144
assign ( resid  22 and name   HA ) ( resid  22 and name  HE+ ) 4.67 4.67 0.00 
  peak 3145
assign ( resid  72 and name  HB1 ) ( resid  73 and name   HA ) 5.50 5.50 0.00 
  peak 3147
assign ( resid  37 and name  HB2 ) ( resid  38 and name   HN ) 4.39 4.39 0.00 
  peak 3149
assign ( resid  38 and name   HN ) ( resid  38 and name HG2+ ) 4.37 4.37 0.00 
  peak 3155
assign ( resid  45 and name HG2+ ) ( resid  46 and name   HA ) 5.13 5.13 0.00 
  peak 3156
assign ( resid  58 and name   HA ) ( resid  59 and name HD1+ ) 5.30 5.30 0.00 
  peak 3158
assign ( resid  91 and name   HA ) ( resid  92 and name HG12 ) 5.45 5.45 0.00 
  peak 3163
assign ( resid  28 and name HG2+ ) ( resid  29 and name  HD1 ) 4.89 4.89 0.00 
  peak 3165
assign ( resid  85 and name   HA ) ( resid  86 and name  HB1 ) 5.15 5.15 0.00 
  peak 3167
assign ( resid  35 and name HG2+ ) ( resid  36 and name  HB2 ) 4.34 4.34 0.00 
  peak 3169
assign ( resid  97 and name   HN ) ( resid  98 and name   HN ) 4.60 4.60 0.00 
  peak 3170
assign ( resid  42 and name   HA ) ( resid  43 and name  HG1 ) 4.87 4.87 0.00 
  peak 3174
assign ( resid  18 and name  HA2 ) ( resid  29 and name  HB1 ) 4.32 4.32 0.00 
  peak 3181
assign ( resid  54 and name   HN ) ( resid  55 and name  HG+ ) 4.31 4.31 0.00 
  peak 3185
assign ( resid  95 and name   HA ) ( resid  96 and name HG2+ ) 5.11 5.11 0.00 
  peak 3188
assign ( resid  72 and name   HA ) ( resid  72 and name  HE+ ) 4.89 4.89 0.00 
  peak 3193
assign ( resid  14 and name  HE+ ) ( resid  65 and name  HB+ ) 4.93 4.93 0.00 
  peak 3198
assign ( resid  32 and name   HA ) ( resid  35 and name HG2+ ) 4.27 4.27 0.00 
  peak 3199
assign ( resid  52 and name   HB ) ( resid  60 and name   HN ) 4.52 4.52 0.00 
  peak 3209
assign ( resid  90 and name   HA ) ( resid  91 and name HG2+ ) 4.48 4.48 0.00 
  peak 3222
assign ( resid  65 and name  HB+ ) ( resid  66 and name HD2+ ) 4.26 4.26 0.00 
  peak 3235
assign ( resid  22 and name  HB1 ) ( resid  22 and name  HE+ ) 4.20 4.20 0.00 
  peak 3242
assign ( resid  42 and name   HN ) ( resid  42 and name  HB1 ) 4.03 4.03 0.00 
  peak 3246
assign ( resid  18 and name  HA2 ) ( resid  29 and name  HB2 ) 4.19 4.19 0.00 
  peak 3251
assign ( resid  18 and name  HA1 ) ( resid  29 and name  HB1 ) 4.18 4.18 0.00 
  peak 3254
assign ( resid  28 and name   HA ) ( resid  29 and name  HB1 ) 4.96 4.96 0.00 
  peak 3255
assign ( resid  77 and name   HA ) ( resid  78 and name  HB1 ) 4.70 4.70 0.00 
  peak 3257
assign ( resid  80 and name   HA ) ( resid  97 and name   HA ) 4.16 4.16 0.00 
  peak 3266
assign ( resid  81 and name   HA ) ( resid  81 and name  HD+ ) 4.42 4.42 0.00 
  peak 3268
assign ( resid  72 and name  HD+ ) ( resid  73 and name   HN ) 4.67 4.67 0.00 
  peak 3276
assign ( resid  82 and name   HA ) ( resid  83 and name HG2+ ) 4.14 4.14 0.00 
  peak 3279
assign ( resid  52 and name HG2+ ) ( resid  53 and name   HA ) 4.14 4.14 0.00 
  peak 3280
assign ( resid  66 and name   HA ) ( resid  69 and name  HB1 ) 4.13 4.13 0.00 
  peak 3283
assign ( resid 101 and name HG2+ ) ( resid 102 and name   HN ) 4.12 4.12 0.00 
  peak 3299
assign ( resid  80 and name  HB1 ) ( resid  81 and name   HA ) 4.36 4.36 0.00 
  peak 3303
assign ( resid  80 and name   HN ) ( resid  81 and name   HN ) 4.57 4.57 0.00 
  peak 3336
assign ( resid  18 and name  HA1 ) ( resid  29 and name  HB2 ) 4.32 4.32 0.00 
  peak 3337
assign ( resid  53 and name  HB2 ) ( resid  56 and name   HN ) 4.31 4.31 0.00 
  peak 3339
assign ( resid  92 and name HD1+ ) ( resid  94 and name   HA ) 4.08 4.08 0.00 
  peak 3344
assign ( resid  83 and name HG2+ ) ( resid  84 and name   HA ) 4.28 4.28 0.00 
  peak 3355
assign ( resid  56 and name   HN ) ( resid  57 and name   HA ) 4.95 4.95 0.00 
  peak 3358
assign ( resid  65 and name   HA ) ( resid  68 and name  HG2 ) 5.02 5.02 0.00 
  peak 3360
assign ( resid  94 and name  HB+ ) ( resid  96 and name HG2+ ) 4.51 4.51 0.00 
  peak 3361
assign ( resid  75 and name  HB2 ) ( resid  76 and name  HA2 ) 4.25 4.25 0.00 
  peak 3371
assign ( resid  96 and name   HB ) ( resid  97 and name HG11 ) 4.99 4.99 0.00 
  peak 3375
assign ( resid  54 and name   HB ) ( resid  96 and name   HA ) 4.41 4.41 0.00 
  peak 3376
assign ( resid  78 and name  HG+ ) ( resid  79 and name   HA ) 4.63 4.63 0.00 
  peak 3376
assign ( resid  95 and name  HG1 ) ( resid  96 and name   HN ) 4.00 4.00 0.00 
  peak 3382
assign ( resid  39 and name  HB2 ) ( resid  40 and name   HN ) 4.23 4.23 0.00 
  peak 3385
assign ( resid  59 and name   HN ) ( resid  59 and name HD1+ ) 3.98 3.98 0.00 
  peak 3390
assign ( resid  86 and name   HN ) ( resid  86 and name  HD+ ) 4.46 4.46 0.00 
  peak 3400
assign ( resid  41 and name   HA ) ( resid  41 and name  HG+ ) 3.96 3.96 0.00 
  peak 3403
assign ( resid  72 and name   HN ) ( resid  72 and name  HD+ ) 3.96 3.96 0.00 
  peak 3404
assign ( resid  90 and name   HN ) ( resid  91 and name   HN ) 4.46 4.46 0.00 
  peak 3405
assign ( resid  80 and name   HA ) ( resid  97 and name HG12 ) 3.94 3.94 0.00 
  peak 3422
assign ( resid  71 and name   HA ) ( resid  75 and name   HA ) 3.94 3.94 0.00 
  peak 3423
assign ( resid  36 and name   HA ) ( resid  39 and name  HB1 ) 4.54 4.54 0.00 
  peak 3434
assign ( resid  18 and name  HA2 ) ( resid  29 and name  HG+ ) 4.26 4.26 0.00 
  peak 3439
assign ( resid  27 and name   HA ) ( resid  27 and name  HG2 ) 3.92 3.92 0.00 
  peak 3441
assign ( resid  81 and name  HB2 ) ( resid  81 and name  HE+ ) 3.92 3.92 0.00 
  peak 3444
assign ( resid  20 and name   HA ) ( resid  27 and name  HB2 ) 3.92 3.92 0.00 
  peak 3447
assign ( resid  84 and name   HA ) ( resid  85 and name HG1+ ) 4.65 4.65 0.00 
  peak 3448
assign ( resid  35 and name   HA ) ( resid  38 and name   HB ) 3.89 3.89 0.00 
  peak 3474
assign ( resid  78 and name   HN ) ( resid  78 and name  HB2 ) 3.87 3.87 0.00 
  peak 3486
assign ( resid  92 and name HD1+ ) ( resid  94 and name  HB+ ) 4.11 4.11 0.00 
  peak 3492
assign ( resid  72 and name  HB1 ) ( resid  72 and name  HE+ ) 3.87 3.87 0.00 
  peak 3493
assign ( resid  89 and name   HN ) ( resid  89 and name HD21 ) 3.86 3.86 0.00 
  peak 3499
assign ( resid  94 and name   HA ) ( resid  94 and name  HG2 ) 3.85 3.85 0.00 
  peak 3501
assign ( resid  65 and name   HA ) ( resid  68 and name  HG1 ) 3.85 3.85 0.00 
  peak 3503
assign ( resid  20 and name   HA ) ( resid  27 and name  HG1 ) 3.84 3.84 0.00 
  peak 3515
assign ( resid  95 and name   HA ) ( resid  95 and name  HG1 ) 3.84 3.84 0.00 
  peak 3519
assign ( resid  77 and name   HN ) ( resid 100 and name HD2+ ) 4.17 4.17 0.00 
  peak 3522
assign ( resid  97 and name   HA ) ( resid  97 and name HG12 ) 3.83 3.83 0.00 
  peak 3524
assign ( resid  86 and name  HB2 ) ( resid  86 and name  HE+ ) 3.83 3.83 0.00 
  peak 3529
assign ( resid  36 and name   HA ) ( resid  39 and name  HB2 ) 4.54 4.54 0.00 
  peak 3538
assign ( resid  38 and name   HA ) ( resid  38 and name HG2+ ) 3.82 3.82 0.00 
  peak 3543
assign ( resid  90 and name  HB1 ) ( resid  91 and name   HN ) 3.81 3.81 0.00 
  peak 3548
assign ( resid  75 and name  HB1 ) ( resid  76 and name   HN ) 3.81 3.81 0.00 
  peak 3554
assign ( resid  33 and name  HB1 ) ( resid  34 and name   HN ) 4.04 4.04 0.00 
  peak 3559
assign ( resid  19 and name   HN ) ( resid  27 and name  HG1 ) 4.05 4.05 0.00 
  peak 3562
assign ( resid  80 and name  HE+ ) ( resid  97 and name HD1+ ) 3.79 3.79 0.00 
  peak 3568
assign ( resid  98 and name HD21 ) ( resid  99 and name  HB1 ) 4.39 4.39 0.00 
  peak 3572
assign ( resid  59 and name   HN ) ( resid  59 and name HD2+ ) 4.25 4.25 0.00 
  peak 3574
assign ( resid  87 and name  HB2 ) ( resid  87 and name  HD2 ) 3.77 3.77 0.00 
  peak 3579
assign ( resid  55 and name  HG+ ) ( resid  56 and name   HN ) 3.77 3.77 0.00 
  peak 3582
assign ( resid  55 and name  HB1 ) ( resid 101 and name   HA ) 4.45 4.45 0.00 
  peak 3584
assign ( resid  60 and name   HA ) ( resid  60 and name HG2+ ) 3.77 3.77 0.00 
  peak 3588
assign ( resid  59 and name   HA ) ( resid  60 and name HG2+ ) 3.75 3.75 0.00 
  peak 3594
assign ( resid  14 and name   HA ) ( resid  14 and name  HE+ ) 4.46 4.46 0.00 
  peak 3595
assign ( resid  97 and name HG2+ ) ( resid 100 and name   HA ) 4.22 4.22 0.00 
  peak 3599
assign ( resid  23 and name  HE+ ) ( resid  45 and name HG2+ ) 3.98 3.98 0.00 
  peak 3603
assign ( resid  81 and name   HN ) ( resid  81 and name  HB2 ) 3.76 3.76 0.00 
  peak 3606
assign ( resid  96 and name   HA ) ( resid  97 and name HD1+ ) 4.44 4.44 0.00 
  peak 3614
assign ( resid  84 and name   HA ) ( resid  85 and name HG2+ ) 3.73 3.73 0.00 
  peak 3618
assign ( resid  33 and name   HA ) ( resid  36 and name  HB2 ) 3.73 3.73 0.00 
  peak 3619
assign ( resid  96 and name   HN ) ( resid  96 and name HG2+ ) 3.72 3.72 0.00 
  peak 3635
assign ( resid  27 and name   HA ) ( resid  27 and name  HG1 ) 3.71 3.71 0.00 
  peak 3636
assign ( resid  28 and name   HA ) ( resid  28 and name HG2+ ) 3.70 3.70 0.00 
  peak 3645
assign ( resid  85 and name HG2+ ) ( resid  86 and name   HA ) 4.63 4.63 0.00 
  peak 3647
assign ( resid  71 and name  HB2 ) ( resid  72 and name   HN ) 4.24 4.24 0.00 
  peak 3652
assign ( resid  52 and name HG2+ ) ( resid  94 and name  HB+ ) 4.37 4.37 0.00 
  peak 3665
assign ( resid  72 and name   HA ) ( resid  72 and name  HD+ ) 4.36 4.36 0.00 
  peak 3672
assign ( resid  27 and name  HB1 ) ( resid  28 and name   HN ) 4.13 4.13 0.00 
  peak 3673
assign ( resid  86 and name   HN ) ( resid  86 and name  HG+ ) 4.34 4.34 0.00 
  peak 3682
assign ( resid  31 and name   HA ) ( resid  31 and name HD2+ ) 3.64 3.64 0.00 
  peak 3698
assign ( resid  54 and name HG1+ ) ( resid  55 and name   HN ) 4.31 4.31 0.00 
  peak 3703
assign ( resid  30 and name   HN ) ( resid  30 and name  HB1 ) 3.62 3.62 0.00 
  peak 3711
assign ( resid  86 and name  HB1 ) ( resid  87 and name   HN ) 4.30 4.30 0.00 
  peak 3712
assign ( resid  52 and name HG1+ ) ( resid  94 and name  HG2 ) 3.62 3.62 0.00 
  peak 3713
assign ( resid  85 and name   HN ) ( resid  85 and name HG1+ ) 3.62 3.62 0.00 
  peak 3715
assign ( resid  58 and name  HB+ ) ( resid  59 and name   HN ) 3.62 3.62 0.00 
  peak 3717
assign ( resid 100 and name   HA ) ( resid 100 and name   HG ) 3.61 3.61 0.00 
  peak 3720
assign ( resid  98 and name   HN ) ( resid  98 and name  HB2 ) 3.61 3.61 0.00 
  peak 3724
assign ( resid  68 and name   HA ) ( resid  71 and name   HG ) 4.06 4.06 0.00 
  peak 3727
assign ( resid  42 and name   HA ) ( resid  43 and name  HD1 ) 3.89 3.89 0.00 
  peak 3733
assign ( resid  55 and name  HB1 ) ( resid  56 and name   HN ) 3.82 3.82 0.00 
  peak 3738
assign ( resid  50 and name   HA ) ( resid  51 and name  HB+ ) 4.26 4.26 0.00 
  peak 3739
assign ( resid  31 and name  HB2 ) ( resid  31 and name HD1+ ) 3.59 3.59 0.00 
  peak 3743
assign ( resid  33 and name   HA ) ( resid  36 and name  HB1 ) 3.58 3.58 0.00 
  peak 3750
assign ( resid  96 and name   HA ) ( resid  97 and name HG11 ) 3.58 3.58 0.00 
  peak 3754
assign ( resid  30 and name  HB1 ) ( resid  32 and name   HN ) 3.80 3.80 0.00 
  peak 3757
assign ( resid  35 and name   HA ) ( resid  38 and name HG1+ ) 3.79 3.79 0.00 
  peak 3760
assign ( resid  59 and name   HA ) ( resid  59 and name   HG ) 3.56 3.56 0.00 
  peak 3762
assign ( resid  87 and name  HB2 ) ( resid  87 and name  HD1 ) 3.77 3.77 0.00 
  peak 3765
assign ( resid  14 and name   HA ) ( resid  14 and name  HG+ ) 3.56 3.56 0.00 
  peak 3770
assign ( resid  71 and name   HA ) ( resid  72 and name   HN ) 3.56 3.56 0.00 
  peak 3771
assign ( resid  81 and name  HB1 ) ( resid  81 and name  HE+ ) 4.21 4.21 0.00 
  peak 3780
assign ( resid  85 and name   HB ) ( resid  86 and name   HN ) 3.99 3.99 0.00 
  peak 3781
assign ( resid  97 and name   HA ) ( resid  97 and name HD1+ ) 4.20 4.20 0.00 
  peak 3792
assign ( resid  16 and name   HA ) ( resid  16 and name  HG+ ) 3.52 3.52 0.00 
  peak 3805
assign ( resid  56 and name  HB2 ) ( resid  57 and name   HN ) 4.03 4.03 0.00 
  peak 3810
assign ( resid  65 and name   HA ) ( resid  68 and name   HN ) 4.17 4.17 0.00 
  peak 3812
assign ( resid  52 and name   HA ) ( resid  52 and name HG1+ ) 3.92 3.92 0.00 
  peak 3814
assign ( resid  79 and name  HB1 ) ( resid  79 and name HD21 ) 3.51 3.51 0.00 
  peak 3815
assign ( resid  18 and name  HA2 ) ( resid  29 and name   HA ) 3.50 3.50 0.00 
  peak 3826
assign ( resid  98 and name  HB2 ) ( resid  98 and name HD22 ) 3.72 3.72 0.00 
  peak 3829
assign ( resid  54 and name HG1+ ) ( resid  94 and name  HB+ ) 3.49 3.49 0.00 
  peak 3830
assign ( resid  59 and name   HN ) ( resid  59 and name  HB1 ) 3.50 3.50 0.00 
  peak 3833
assign ( resid  59 and name   HA ) ( resid  59 and name HD1+ ) 3.93 3.93 0.00 
  peak 3835
assign ( resid 100 and name   HA ) ( resid 100 and name HD1+ ) 4.14 4.14 0.00 
  peak 3842
assign ( resid  98 and name  HB2 ) ( resid  98 and name HD21 ) 3.49 3.49 0.00 
  peak 3845
assign ( resid  22 and name   HN ) ( resid  59 and name HD1+ ) 4.35 4.35 0.00 
  peak 3848
assign ( resid  52 and name HG2+ ) ( resid  86 and name  HD+ ) 4.05 4.05 0.00 
  peak 3852
assign ( resid  68 and name   HA ) ( resid  68 and name  HG1 ) 3.91 3.91 0.00 
  peak 3855
assign ( resid  54 and name   HA ) ( resid  96 and name HG2+ ) 4.34 4.34 0.00 
  peak 3856
assign ( resid  28 and name   HA ) ( resid  29 and name  HG+ ) 3.90 3.90 0.00 
  peak 3862
assign ( resid  52 and name   HN ) ( resid  52 and name HG2+ ) 4.12 4.12 0.00 
  peak 3864
assign ( resid  74 and name   HA ) ( resid  75 and name  HD2 ) 3.46 3.46 0.00 
  peak 3867
assign ( resid  27 and name  HB2 ) ( resid  28 and name   HN ) 4.49 4.49 0.00 
  peak 3870
assign ( resid  81 and name   HA ) ( resid  81 and name  HG2 ) 3.88 3.88 0.00 
  peak 3875
assign ( resid  60 and name   HN ) ( resid  66 and name HD1+ ) 4.06 4.06 0.00 
  peak 3876
assign ( resid  97 and name HG2+ ) ( resid  99 and name   HN ) 3.48 3.48 0.00 
  peak 3877
assign ( resid  68 and name   HA ) ( resid  71 and name  HB1 ) 3.45 3.45 0.00 
  peak 3880
assign ( resid  57 and name  HB1 ) ( resid  57 and name HD22 ) 3.66 3.66 0.00 
  peak 3888
assign ( resid  52 and name HG1+ ) ( resid  54 and name   HA ) 3.65 3.65 0.00 
  peak 3896
assign ( resid  72 and name   HN ) ( resid  74 and name   HN ) 3.85 3.85 0.00 
  peak 3903
assign ( resid  33 and name   HA ) ( resid  33 and name  HG1 ) 4.07 4.07 0.00 
  peak 3905
assign ( resid 100 and name   HA ) ( resid 100 and name HD2+ ) 3.96 3.96 0.00 
  peak 3908
assign ( resid  57 and name   HN ) ( resid  57 and name  HB1 ) 4.05 4.05 0.00 
  peak 3916
assign ( resid  23 and name  HE+ ) ( resid  45 and name HG1+ ) 3.98 3.98 0.00 
  peak 3918
assign ( resid  72 and name   HA ) ( resid  72 and name  HG2 ) 3.39 3.39 0.00 
  peak 3930
assign ( resid  81 and name   HA ) ( resid  81 and name  HG1 ) 3.60 3.60 0.00 
  peak 3931
assign ( resid  65 and name   HA ) ( resid  68 and name  HB2 ) 4.01 4.01 0.00 
  peak 3940
assign ( resid  72 and name   HA ) ( resid  72 and name  HG1 ) 4.01 4.01 0.00 
  peak 3943
assign ( resid  97 and name   HA ) ( resid  97 and name HG11 ) 3.37 3.37 0.00 
  peak 3946
assign ( resid  45 and name   HA ) ( resid  45 and name HG1+ ) 3.37 3.37 0.00 
  peak 3947
assign ( resid  72 and name   HN ) ( resid  72 and name  HB1 ) 3.58 3.58 0.00 
  peak 3949
assign ( resid  68 and name   HA ) ( resid  71 and name  HB2 ) 3.36 3.36 0.00 
  peak 3955
assign ( resid  31 and name   HA ) ( resid  31 and name HD1+ ) 3.36 3.36 0.00 
  peak 3957
assign ( resid  68 and name   HA ) ( resid  68 and name  HG2 ) 3.35 3.35 0.00 
  peak 3967
assign ( resid  50 and name  HB1 ) ( resid  59 and name HD2+ ) 3.35 3.35 0.00 
  peak 3968
assign ( resid  97 and name   HN ) ( resid  97 and name HG2+ ) 3.97 3.97 0.00 
  peak 3970
assign ( resid  50 and name   HN ) ( resid  50 and name  HB2 ) 3.67 3.67 0.00 
  peak 3976
assign ( resid  67 and name   HN ) ( resid  67 and name  HB1 ) 3.90 3.90 0.00 
  peak 3976
assign ( resid  72 and name   HN ) ( resid  72 and name  HB2 ) 3.53 3.53 0.00 
  peak 3982
assign ( resid  52 and name HG2+ ) ( resid  53 and name   HN ) 3.31 3.31 0.00 
  peak 3998
assign ( resid  38 and name   HN ) ( resid  38 and name HG1+ ) 3.72 3.72 0.00 
  peak 4007
assign ( resid 100 and name   HN ) ( resid 100 and name  HB1 ) 3.71 3.71 0.00 
  peak 4010
assign ( resid  53 and name  HB1 ) ( resid  58 and name  HD+ ) 3.38 3.38 0.00 
  peak 4020
assign ( resid  83 and name   HN ) ( resid  83 and name HG2+ ) 3.26 3.26 0.00 
  peak 4028
assign ( resid  71 and name   HN ) ( resid  71 and name   HG ) 4.06 4.06 0.00 
  peak 4036
assign ( resid  85 and name HG1+ ) ( resid  86 and name   HN ) 4.05 4.05 0.00 
  peak 4040
assign ( resid 100 and name  HB2 ) ( resid 100 and name HD1+ ) 3.29 3.29 0.00 
  peak 4043
assign ( resid  68 and name   HN ) ( resid  68 and name  HB1 ) 3.64 3.64 0.00 
  peak 4046
assign ( resid  52 and name HG1+ ) ( resid  59 and name   HG ) 3.43 3.43 0.00 
  peak 4047
assign ( resid  31 and name  HB1 ) ( resid  31 and name HD2+ ) 3.22 3.22 0.00 
  peak 4051
assign ( resid  90 and name   HN ) ( resid  90 and name  HG+ ) 3.22 3.22 0.00 
  peak 4055
assign ( resid  59 and name   HA ) ( resid  59 and name HD2+ ) 3.21 3.21 0.00 
  peak 4060
assign ( resid  31 and name  HB2 ) ( resid  31 and name HD2+ ) 3.20 3.20 0.00 
  peak 4063
assign ( resid  78 and name   HA ) ( resid  78 and name  HG+ ) 3.20 3.20 0.00 
  peak 4069
assign ( resid  80 and name   HA ) ( resid  97 and name HG2+ ) 3.18 3.18 0.00 
  peak 4078
assign ( resid  45 and name   HA ) ( resid  45 and name HG2+ ) 3.37 3.37 0.00 
  peak 4081
assign ( resid  71 and name   HA ) ( resid  71 and name   HG ) 3.57 3.57 0.00 
  peak 4082
assign ( resid  52 and name   HA ) ( resid  52 and name HG2+ ) 3.15 3.15 0.00 
  peak 4094
assign ( resid  90 and name   HA ) ( resid  90 and name  HG+ ) 3.54 3.54 0.00 
  peak 4095
assign ( resid  81 and name  HG1 ) ( resid  81 and name  HE+ ) 3.14 3.14 0.00 
  peak 4098
assign ( resid  81 and name  HD+ ) ( resid  96 and name   HB ) 3.17 3.17 0.00 
  peak 4109
assign ( resid  31 and name  HB1 ) ( resid  31 and name HD1+ ) 3.35 3.35 0.00 
  peak 4118
assign ( resid  86 and name  HG+ ) ( resid  86 and name  HE+ ) 3.09 3.09 0.00 
  peak 4125
assign ( resid  52 and name   HA ) ( resid  66 and name HD1+ ) 4.39 4.39 0.00 
  peak 4146
assign ( resid  97 and name HG2+ ) ( resid  97 and name HG12 ) 3.05 3.05 0.00 
  peak 4147
assign ( resid  83 and name   HA ) ( resid  83 and name HG2+ ) 3.24 3.24 0.00 
  peak 4149
assign ( resid  22 and name  HB1 ) ( resid  59 and name  HB1 ) 3.05 3.05 0.00 
  peak 4152
assign ( resid  15 and name   HA ) ( resid  15 and name HG2+ ) 3.03 3.03 0.00 
  peak 4160
assign ( resid  59 and name  HB1 ) ( resid  59 and name HD1+ ) 3.03 3.03 0.00 
  peak 4162
assign ( resid  52 and name HG1+ ) ( resid  54 and name HG1+ ) 3.58 3.58 0.00 
  peak 4165
assign ( resid  97 and name   HA ) ( resid  97 and name HG2+ ) 3.02 3.02 0.00 
  peak 4166
assign ( resid  59 and name  HB2 ) ( resid  59 and name HD2+ ) 3.21 3.21 0.00 
  peak 4169
assign ( resid  55 and name   HA ) ( resid  55 and name  HB1 ) 3.01 3.01 0.00 
  peak 4173
assign ( resid  38 and name   HA ) ( resid  38 and name HG1+ ) 3.00 3.00 0.00 
  peak 4175
assign ( resid  15 and name   HA ) ( resid  15 and name HG1+ ) 3.18 3.18 0.00 
  peak 4178
assign ( resid 100 and name  HB1 ) ( resid 100 and name HD1+ ) 2.98 2.98 0.00 
  peak 4180
assign ( resid  54 and name   HB ) ( resid  96 and name HG2+ ) 2.98 2.98 0.00 
  peak 4182
assign ( resid  85 and name   HA ) ( resid  85 and name HG2+ ) 3.16 3.16 0.00 
  peak 4183
assign ( resid  87 and name  HB2 ) ( resid  87 and name  HG+ ) 2.97 2.97 0.00 
  peak 4185
assign ( resid  59 and name  HB2 ) ( resid  59 and name HD1+ ) 2.96 2.96 0.00 
  peak 4188
assign ( resid  97 and name   HB ) ( resid  97 and name HD1+ ) 3.32 3.32 0.00 
  peak 4190
assign ( resid  97 and name HD1+ ) ( resid 100 and name  HB2 ) 3.45 3.45 0.00 
  peak 4190
assign ( resid 101 and name   HA ) ( resid 101 and name HG2+ ) 2.95 2.95 0.00 
  peak 4194
assign ( resid 100 and name  HB1 ) ( resid 100 and name HD2+ ) 2.94 2.94 0.00 
  peak 4201
assign ( resid  55 and name   HA ) ( resid  55 and name  HG+ ) 3.12 3.12 0.00 
  peak 4202
assign ( resid  85 and name   HA ) ( resid  85 and name HG1+ ) 2.93 2.93 0.00 
  peak 4206
assign ( resid  86 and name  HD+ ) ( resid  86 and name  HE+ ) 2.93 2.93 0.00 
  peak 4209
assign ( resid  59 and name  HB1 ) ( resid  59 and name HD2+ ) 2.92 2.92 0.00 
  peak 4210
assign ( resid  54 and name   HA ) ( resid  54 and name HG2+ ) 3.03 3.03 0.00 
  peak 4224
assign ( resid  81 and name  HD+ ) ( resid  81 and name  HE+ ) 2.85 2.85 0.00 
  peak 4225
assign ( resid  55 and name  HB2 ) ( resid  55 and name  HG+ ) 2.83 2.83 0.00 
  peak 4230
assign ( resid  55 and name  HB1 ) ( resid  55 and name  HG+ ) 2.82 2.82 0.00 
  peak 4233
assign ( resid  52 and name HG2+ ) ( resid  92 and name HD1+ ) 3.14 3.14 0.00 
  peak 4242
assign ( resid  96 and name   HA ) ( resid  96 and name HG2+ ) 2.85 2.85 0.00 
  peak 4243
assign ( resid  54 and name   HA ) ( resid  54 and name HG1+ ) 2.77 2.77 0.00 
  peak 4251
assign ( resid 100 and name  HB2 ) ( resid 100 and name HD2+ ) 3.06 3.06 0.00 
  peak 4263
assign ( resid  83 and name HG2+ ) ( resid  85 and name HG2+ ) 2.84 2.84 0.00 
  peak 4277
assign ( resid  59 and name HD2+ ) ( resid  92 and name HG12 ) 3.08 3.08 0.00 
  peak 4277
assign ( resid  71 and name  HB1 ) ( resid  71 and name   HG ) 2.63 2.63 0.00 
  peak 4289
assign ( resid  86 and name  HB1 ) ( resid  86 and name  HG+ ) 2.62 2.62 0.00 
  peak 4291
assign ( resid  54 and name HG2+ ) ( resid  96 and name HG2+ ) 2.62 2.62 0.00 
  peak 4292
assign ( resid  54 and name HG1+ ) ( resid  96 and name HG2+ ) 2.93 2.93 0.00 
  peak 4296
assign ( resid  97 and name HG2+ ) ( resid  97 and name HD1+ ) 2.63 2.63 0.00 
  peak 4312
assign ( resid  52 and name HG1+ ) ( resid  92 and name HD1+ ) 2.40 2.40 0.00 
  peak 4329
assign ( resid  86 and name   HA ) ( resid  86 and name  HE+ ) 4.61 4.61 0.00 
  peak 4335
assign ( resid  86 and name  HB1 ) ( resid  86 and name  HE+ ) 4.25 4.25 0.00 
  peak 4336
assign ( resid  83 and name HG2+ ) ( resid  95 and name  HG1 ) 5.30 5.30 0.00 
  peak 4373
assign ( resid  83 and name HG2+ ) ( resid  94 and name  HG1 ) 4.52 4.52 0.00 
  peak 4374
assign ( resid  68 and name  HB1 ) ( resid  69 and name   HA ) 5.42 5.42 0.00 
  peak 4379
assign ( resid  27 and name  HB1 ) ( resid  27 and name HE22 ) 4.85 4.85 0.00 
  peak 4386
assign ( resid  28 and name HG2+ ) ( resid  31 and name   HA ) 4.20 4.20 0.00 
  peak 4391
assign ( resid  28 and name HG2+ ) ( resid  30 and name  HB2 ) 3.77 3.77 0.00 
  peak 4392
assign ( resid  50 and name  HB2 ) ( resid  59 and name HD2+ ) 3.35 3.35 0.00 
  peak 4396
assign ( resid  53 and name  HB2 ) ( resid  58 and name  HB+ ) 5.27 5.27 0.00 
  peak 4399
assign ( resid  53 and name  HB2 ) ( resid  55 and name  HB2 ) 5.05 5.05 0.00 
  peak 4401
assign ( resid  53 and name  HB2 ) ( resid  95 and name  HB+ ) 4.27 4.27 0.00 
  peak 4403
assign ( resid  53 and name  HB2 ) ( resid  58 and name   HN ) 4.54 4.54 0.00 
  peak 4405
assign ( resid  45 and name HG1+ ) ( resid  46 and name   HA ) 5.13 5.13 0.00 
  peak 4412
assign ( resid  42 and name  HB2 ) ( resid  45 and name HG2+ ) 4.43 4.43 0.00 
  peak 4416
assign ( resid  42 and name  HB1 ) ( resid  45 and name HG1+ ) 4.16 4.16 0.00 
  peak 4427
assign ( resid  58 and name   HN ) ( resid  59 and name   HG ) 5.48 5.48 0.00 
  peak 4435
assign ( resid  57 and name  HB1 ) ( resid  58 and name   HN ) 4.53 4.53 0.00 
  peak 4450
assign ( resid  81 and name   HN ) ( resid  98 and name   HN ) 5.34 5.34 0.00 
  peak 4451
assign ( resid  55 and name  HG+ ) ( resid  97 and name HG11 ) 4.31 4.31 0.00 
  peak 4463
assign ( resid  55 and name  HG+ ) ( resid  97 and name HG2+ ) 4.61 4.61 0.00 
  peak 4472
assign ( resid  51 and name  HD+ ) ( resid  95 and name   HN ) 5.50 5.50 0.00 
  peak 4476
assign ( resid  81 and name  HB2 ) ( resid  96 and name   HN ) 4.94 4.94 0.00 
  peak 4484
assign ( resid  96 and name   HB ) ( resid 101 and name HG2+ ) 4.43 4.43 0.00 
  peak 4485
assign ( resid  59 and name   HA ) ( resid  66 and name HD2+ ) 5.02 5.02 0.00 
  peak 4489
assign ( resid  52 and name HG1+ ) ( resid  95 and name   HA ) 5.50 5.50 0.00 
  peak 4503
assign ( resid  85 and name HG2+ ) ( resid  94 and name   HN ) 4.28 4.28 0.00 
  peak 4515
assign ( resid  23 and name  HE+ ) ( resid  45 and name   HB ) 4.86 4.86 0.00 
  peak 4519
assign ( resid  82 and name   HA ) ( resid  95 and name  HG1 ) 4.52 4.52 0.00 
  peak 4523
assign ( resid  51 and name   HA ) ( resid  93 and name  HD+ ) 4.51 4.51 0.00 
  peak 4543
assign ( resid  60 and name HG2+ ) ( resid  66 and name   HG ) 4.45 4.45 0.00 
  peak 4561
assign ( resid  83 and name   HN ) ( resid  95 and name   HN ) 5.03 5.03 0.00 
  peak 4564
assign ( resid  31 and name HD2+ ) ( resid  35 and name   HN ) 4.68 4.68 0.00 
  peak 4579
assign ( resid  45 and name HG2+ ) ( resid  46 and name   HN ) 4.53 4.53 0.00 
  peak 4584
assign ( resid  50 and name   HN ) ( resid  59 and name HD2+ ) 4.58 4.58 0.00 
  peak 4587
assign ( resid  72 and name  HG1 ) ( resid  73 and name   HA ) 4.84 4.84 0.00 
  peak 4589
assign ( resid  21 and name  HB1 ) ( resid  22 and name   HN ) 4.24 4.24 0.00 
  peak 4608
assign ( resid  19 and name  HD+ ) ( resid  31 and name   HA ) 4.41 4.41 0.00 
  peak 4613
assign ( resid  59 and name  HB1 ) ( resid  86 and name  HE+ ) 5.50 5.50 0.00 
  peak 4620
assign ( resid  22 and name  HG+ ) ( resid  23 and name  HB+ ) 5.31 5.31 0.00 
  peak 4626
assign ( resid  34 and name  HD+ ) ( resid  35 and name   HA ) 4.19 4.19 0.00 
  peak 4627
assign ( resid  67 and name   HA ) ( resid  80 and name  HD+ ) 4.52 4.52 0.00 
  peak 4633
assign ( resid  80 and name  HD+ ) ( resid  81 and name  HG2 ) 4.27 4.27 0.00 
  peak 4634
assign ( resid  80 and name  HD+ ) ( resid  95 and name   HN ) 5.39 5.39 0.00 
  peak 4636
assign ( resid  80 and name  HD+ ) ( resid  96 and name HG2+ ) 4.99 4.99 0.00 
  peak 4642
assign ( resid  19 and name  HB2 ) ( resid  34 and name   HA ) 5.05 5.05 0.00 
  peak 4650
assign ( resid  19 and name   HA ) ( resid  21 and name   HN ) 5.50 5.50 0.00 
  peak 4657
assign ( resid  28 and name   HB ) ( resid  34 and name   HN ) 5.41 5.41 0.00 
  peak 4658
assign ( resid  34 and name  HD+ ) ( resid  35 and name   HB ) 4.56 4.56 0.00 
  peak 4659
assign ( resid  22 and name  HB2 ) ( resid  23 and name  HD+ ) 4.94 4.94 0.00 
  peak 4660
assign ( resid  55 and name   HA ) ( resid  97 and name HD1+ ) 5.42 5.42 0.00 
  peak 4663
assign ( resid  53 and name   HN ) ( resid  94 and name   HA ) 5.36 5.36 0.00 
  peak 4667
assign ( resid  83 and name   HN ) ( resid  94 and name   HA ) 4.84 4.84 0.00 
  peak 4672
assign ( resid  80 and name  HB1 ) ( resid  95 and name  HG2 ) 4.11 4.11 0.00 
  peak 4681
assign ( resid  77 and name  HB+ ) ( resid  79 and name  HB2 ) 4.43 4.43 0.00 
  peak 4682
assign ( resid  68 and name  HB1 ) ( resid  72 and name  HB1 ) 5.50 5.50 0.00 
  peak 4688
assign ( resid  86 and name  HG+ ) ( resid  90 and name  HB2 ) 5.50 5.50 0.00 
  peak 4688
assign ( resid  54 and name HG1+ ) ( resid  94 and name   HA ) 4.50 4.50 0.00 
  peak 4690
assign ( resid  28 and name   HB ) ( resid  30 and name  HB2 ) 5.47 5.47 0.00 
  peak 4703
assign ( resid  28 and name   HB ) ( resid  34 and name  HB+ ) 5.50 5.50 0.00 
  peak 4703
assign ( resid  21 and name  HB2 ) ( resid  34 and name  HD+ ) 5.50 5.50 0.00 
  peak 4707
assign ( resid  73 and name  HB2 ) ( resid  75 and name  HD1 ) 5.05 5.05 0.00 
  peak 4708
assign ( resid  52 and name HG2+ ) ( resid  58 and name   HA ) 4.30 4.30 0.00 
  peak 4716
assign ( resid  85 and name   HB ) ( resid  86 and name  HD+ ) 5.50 5.50 0.00 
  peak 4724
assign ( resid  86 and name  HB1 ) ( resid  94 and name  HG1 ) 5.50 5.50 0.00 
  peak 4727
assign ( resid  19 and name  HB2 ) ( resid  31 and name   HA ) 5.31 5.31 0.00 
  peak 4741
assign ( resid  67 and name   HN ) ( resid  68 and name  HB2 ) 5.50 5.50 0.00 
  peak 4742
assign ( resid  54 and name   HA ) ( resid  55 and name   HA ) 5.00 5.00 0.00 
  peak 4747
assign ( resid  77 and name   HA ) ( resid  79 and name   HN ) 5.50 5.50 0.00 
  peak 4755
assign ( resid  70 and name   HN ) ( resid  71 and name   HA ) 5.32 5.32 0.00 
  peak 4756
assign ( resid  40 and name   HA ) ( resid  43 and name  HD1 ) 4.26 4.26 0.00 
  peak 4757
assign ( resid  71 and name   HA ) ( resid  73 and name   HN ) 5.25 5.25 0.00 
  peak 4763
assign ( resid  18 and name  HA1 ) ( resid  28 and name HG2+ ) 5.16 5.16 0.00 
  peak 4768
assign ( resid  18 and name  HA1 ) ( resid  19 and name  HE+ ) 5.50 5.50 0.00 
  peak 4770
assign ( resid  53 and name   HA ) ( resid  95 and name   HA ) 5.08 5.08 0.00 
  peak 4774
assign ( resid  80 and name  HB1 ) ( resid  95 and name   HA ) 4.96 4.96 0.00 
  peak 4775
assign ( resid  53 and name   HN ) ( resid  56 and name   HN ) 4.78 4.78 0.00 
  peak 4778
assign ( resid  78 and name  HB1 ) ( resid  79 and name HD21 ) 4.78 4.78 0.00 
  peak 4782
assign ( resid  70 and name   HA ) ( resid  77 and name   HN ) 5.50 5.50 0.00 
  peak 4786
assign ( resid  89 and name   HA ) ( resid  89 and name HD21 ) 4.64 4.64 0.00 
  peak 4792
assign ( resid  15 and name HG1+ ) ( resid  58 and name   HZ ) 4.01 4.01 0.00 
  peak 4801
assign ( resid  70 and name   HN ) ( resid  95 and name HE21 ) 5.37 5.37 0.00 
  peak 4804
assign ( resid  67 and name   HA ) ( resid  80 and name  HE+ ) 4.83 4.83 0.00 
  peak 4814
assign ( resid  56 and name   HN ) ( resid  97 and name HD1+ ) 5.50 5.50 0.00 
  peak 4821
assign ( resid  99 and name  HB1 ) ( resid 100 and name  HB2 ) 4.64 4.64 0.00 
  peak 4822
assign ( resid  97 and name   HB ) ( resid  99 and name  HB2 ) 5.50 5.50 0.00 
  peak 4824
assign ( resid  92 and name   HB ) ( resid  94 and name  HG2 ) 5.08 5.08 0.00 
  peak 4825
assign ( resid  42 and name  HB2 ) ( resid  43 and name   HA ) 5.46 5.46 0.00 
  peak 4826
assign ( resid  97 and name   HA ) ( resid  98 and name  HB1 ) 5.50 5.50 0.00 
  peak 4826
assign ( resid  56 and name  HB1 ) ( resid  58 and name  HE+ ) 5.50 5.50 0.00 
  peak 4830
assign ( resid  67 and name   HN ) ( resid  69 and name  HB1 ) 5.48 5.48 0.00 
  peak 4832
assign ( resid  32 and name   HA ) ( resid  35 and name   HB ) 5.41 5.41 0.00 
  peak 4837
assign ( resid  38 and name   HB ) ( resid  41 and name   HN ) 5.50 5.50 0.00 
  peak 4840
assign ( resid  41 and name   HN ) ( resid  43 and name  HB1 ) 5.50 5.50 0.00 
  peak 4840
assign ( resid  27 and name HE21 ) ( resid  29 and name  HD1 ) 5.50 5.50 0.00 
  peak 4845
assign ( resid  80 and name  HE+ ) ( resid 100 and name  HB2 ) 5.34 5.34 0.00 
  peak 4851
assign ( resid  80 and name  HE+ ) ( resid  97 and name   HB ) 5.50 5.50 0.00 
  peak 4852
assign ( resid  97 and name   HB ) ( resid  98 and name HD21 ) 5.50 5.50 0.00 
  peak 4852
assign ( resid  15 and name   HB ) ( resid  60 and name HG2+ ) 5.11 5.11 0.00 
  peak 4855
assign ( resid  21 and name   HN ) ( resid  27 and name HE21 ) 5.50 5.50 0.00 
  peak 4865
assign ( resid  21 and name   HN ) ( resid  27 and name  HG1 ) 5.24 5.24 0.00 
  peak 4866
assign ( resid  23 and name   HN ) ( resid  24 and name   HA ) 4.92 4.92 0.00 
  peak 4872
assign ( resid  23 and name  HD+ ) ( resid  59 and name  HB1 ) 4.96 4.96 0.00 
  peak 4878
assign ( resid  23 and name  HD+ ) ( resid  45 and name   HB ) 4.80 4.80 0.00 
  peak 4879
assign ( resid  23 and name  HE+ ) ( resid  38 and name   HA ) 4.45 4.45 0.00 
  peak 4880
assign ( resid  23 and name  HE+ ) ( resid  42 and name  HB1 ) 4.89 4.89 0.00 
  peak 4885
assign ( resid  19 and name   HN ) ( resid  29 and name  HD2 ) 5.12 5.12 0.00 
  peak 4893
assign ( resid  28 and name   HN ) ( resid  29 and name  HD2 ) 5.46 5.46 0.00 
  peak 4893
assign ( resid  31 and name   HA ) ( resid  34 and name  HB+ ) 3.83 3.83 0.00 
  peak 4895
assign ( resid  30 and name  HB1 ) ( resid  34 and name   HN ) 4.35 4.35 0.00 
  peak 4896
assign ( resid  52 and name   HA ) ( resid  95 and name   HN ) 4.90 4.90 0.00 
  peak 4923
assign ( resid  83 and name HG2+ ) ( resid  85 and name   HN ) 4.14 4.14 0.00 
  peak 4928
assign ( resid  94 and name  HB+ ) ( resid  96 and name   HN ) 4.65 4.65 0.00 
  peak 4932
assign ( resid  54 and name   HN ) ( resid  56 and name   HN ) 4.48 4.48 0.00 
  peak 4953
assign ( resid  58 and name  HE+ ) ( resid  60 and name   HN ) 4.67 4.67 0.00 
  peak 4954
assign ( resid  83 and name   HN ) ( resid  93 and name  HD+ ) 5.09 5.09 0.00 
  peak 4957
assign ( resid  58 and name  HD+ ) ( resid  60 and name   HN ) 4.99 4.99 0.00 
  peak 4958
assign ( resid  55 and name   HN ) ( resid  56 and name   HA ) 5.50 5.50 0.00 
  peak 4964
assign ( resid  99 and name   HN ) ( resid 100 and name   HA ) 4.80 4.80 0.00 
  peak 4967
assign ( resid  73 and name   HN ) ( resid  75 and name  HD2 ) 5.50 5.50 0.00 
  peak 4970
assign ( resid  79 and name  HB2 ) ( resid  98 and name   HN ) 4.00 4.00 0.00 
  peak 4973
assign ( resid  19 and name   HN ) ( resid  29 and name  HD1 ) 4.36 4.36 0.00 
  peak 4984
assign ( resid  19 and name   HN ) ( resid  27 and name   HA ) 4.36 4.36 0.00 
  peak 4986
assign ( resid  19 and name  HD+ ) ( resid  20 and name   HN ) 4.64 4.64 0.00 
  peak 4989
assign ( resid  70 and name HD21 ) ( resid  80 and name   HN ) 4.42 4.42 0.00 
  peak 4990
assign ( resid  68 and name   HN ) ( resid  69 and name  HB2 ) 4.48 4.48 0.00 
  peak 5063
assign ( resid  42 and name   HN ) ( resid  43 and name  HG1 ) 5.50 5.50 0.00 
  peak 5066
assign ( resid  70 and name HD22 ) ( resid  97 and name HG12 ) 5.49 5.49 0.00 
  peak 5067
assign ( resid 100 and name  HB1 ) ( resid 102 and name   HN ) 4.99 4.99 0.00 
  peak 5068
assign ( resid  66 and name   HG ) ( resid  95 and name HE21 ) 4.69 4.69 0.00 
  peak 5076
assign ( resid  72 and name  HD+ ) ( resid  73 and name  HE+ ) 3.26 3.26 0.00 
  peak 5077
assign ( resid  72 and name  HD+ ) ( resid  73 and name  HD+ ) 4.00 4.00 0.00 
  peak 5078
assign ( resid  19 and name  HE+ ) ( resid  31 and name  HB2 ) 3.61 3.61 0.00 
  peak 5079
assign ( resid  50 and name   HA ) ( resid  51 and name  HD+ ) 3.71 3.71 0.00 
  peak 5083
assign ( resid  72 and name   HN ) ( resid  73 and name  HE+ ) 4.90 4.90 0.00 
  peak 5094
assign ( resid  19 and name  HE+ ) ( resid  30 and name   HN ) 4.36 4.36 0.00 
  peak 5104
assign ( resid  51 and name   HA ) ( resid  52 and name HG1+ ) 3.97 3.97 0.00 
  peak 5111
assign ( resid  51 and name   HA ) ( resid  93 and name  HB1 ) 4.59 4.59 0.00 
  peak 5112
assign ( resid  52 and name   HA ) ( resid  59 and name   HA ) 4.18 4.18 0.00 
  peak 5113
assign ( resid  15 and name HG1+ ) ( resid  16 and name   HA ) 4.24 4.24 0.00 
  peak 5119
assign ( resid  64 and name   HA ) ( resid  67 and name   HA ) 5.50 5.50 0.00 
  peak 5128
assign ( resid  68 and name   HA ) ( resid  69 and name   HA ) 5.50 5.50 0.00 
  peak 5128
assign ( resid  39 and name   HA ) ( resid  40 and name   HA ) 5.20 5.20 0.00 
  peak 5129
assign ( resid  76 and name  HA2 ) ( resid  77 and name   HA ) 5.50 5.50 0.00 
  peak 5129
assign ( resid  16 and name   HA ) ( resid  17 and name  HA2 ) 4.81 4.81 0.00 
  peak 5136
assign ( resid  54 and name   HA ) ( resid  57 and name   HA ) 3.85 3.85 0.00 
  peak 5142
assign ( resid  84 and name   HA ) ( resid  85 and name   HA ) 4.47 4.47 0.00 
  peak 5147
assign ( resid  83 and name   HA ) ( resid  84 and name   HA ) 4.59 4.59 0.00 
  peak 5149
assign ( resid  83 and name   HB ) ( resid  84 and name   HN ) 4.47 4.47 0.00 
  peak 5153
assign ( resid  73 and name   HA ) ( resid  74 and name   HA ) 4.79 4.79 0.00 
  peak 5156
assign ( resid  45 and name   HA ) ( resid  46 and name   HA ) 4.49 4.49 0.00 
  peak 5160
assign ( resid  28 and name   HB ) ( resid  29 and name  HD2 ) 4.54 4.54 0.00 
  peak 5161
assign ( resid  15 and name   HA ) ( resid  16 and name   HA ) 4.65 4.65 0.00 
  peak 5162
assign ( resid  67 and name   HA ) ( resid  80 and name  HB2 ) 4.55 4.55 0.00 
  peak 5165
assign ( resid  35 and name   HA ) ( resid  35 and name HG2+ ) 3.22 3.22 0.00 
  peak 5170
assign ( resid  32 and name  HB1 ) ( resid  36 and name  HB1 ) 5.11 5.11 0.00 
  peak 5179
assign ( resid  70 and name  HB+ ) ( resid  71 and name   HA ) 4.46 4.46 0.00 
  peak 5185
assign ( resid  20 and name   HA ) ( resid  21 and name  HB2 ) 5.23 5.23 0.00 
  peak 5188
assign ( resid  28 and name   HA ) ( resid  30 and name  HB2 ) 5.16 5.16 0.00 
  peak 5189
assign ( resid  19 and name  HE+ ) ( resid  34 and name  HB+ ) 3.79 3.79 0.00 
  peak 5193
assign ( resid  74 and name  HB1 ) ( resid  80 and name  HE+ ) 5.37 5.37 0.00 
  peak 5195
assign ( resid  34 and name   HN ) ( resid  36 and name  HB1 ) 4.67 4.67 0.00 
  peak 5203
assign ( resid  86 and name  HE+ ) ( resid  90 and name HE22 ) 4.34 4.34 0.00 
  peak 5215
assign ( resid  68 and name  HB1 ) ( resid  71 and name   HG ) 3.55 3.55 0.00 
  peak 5231
assign ( resid  68 and name  HB2 ) ( resid  68 and name  HG1 ) 2.60 2.60 0.00 
  peak 5236
assign ( resid  54 and name   HB ) ( resid  95 and name   HN ) 5.29 5.29 0.00 
  peak 5254
assign ( resid  27 and name  HB1 ) ( resid  27 and name HE21 ) 4.50 4.50 0.00 
  peak 5260
assign ( resid  72 and name  HB2 ) ( resid  73 and name   HA ) 4.57 4.57 0.00 
  peak 5266
assign ( resid  77 and name   HA ) ( resid  78 and name  HB2 ) 4.49 4.49 0.00 
  peak 5267
assign ( resid  35 and name HG2+ ) ( resid  36 and name  HB1 ) 4.33 4.33 0.00 
  peak 5274
assign ( resid  86 and name  HE+ ) ( resid  92 and name   HB ) 5.09 5.09 0.00 
  peak 5278
assign ( resid  31 and name  HB2 ) ( resid  35 and name HG2+ ) 5.28 5.28 0.00 
  peak 5282
assign ( resid  72 and name  HB1 ) ( resid  72 and name  HD+ ) 3.27 3.27 0.00 
  peak 5286
assign ( resid  86 and name  HG+ ) ( resid  92 and name HD1+ ) 3.32 3.32 0.00 
  peak 5288
assign ( resid  86 and name  HB2 ) ( resid  92 and name HD1+ ) 3.17 3.17 0.00 
  peak 5289
assign ( resid  71 and name  HB1 ) ( resid  72 and name  HG1 ) 4.35 4.35 0.00 
  peak 5290
assign ( resid  54 and name HG1+ ) ( resid  94 and name  HG2 ) 3.89 3.89 0.00 
  peak 5299
assign ( resid  15 and name HG1+ ) ( resid  17 and name  HA2 ) 4.82 4.82 0.00 
  peak 5306
assign ( resid  52 and name HG2+ ) ( resid  54 and name   HN ) 4.13 4.13 0.00 
  peak 5322
assign ( resid  76 and name   HN ) ( resid 100 and name HD2+ ) 4.14 4.14 0.00 
  peak 5325
assign ( resid  97 and name HG11 ) ( resid  98 and name   HN ) 5.02 5.02 0.00 
  peak 5328
assign ( resid  59 and name   HA ) ( resid  92 and name HD1+ ) 4.65 4.65 0.00 
  peak 5339
assign ( resid  59 and name HD2+ ) ( resid  92 and name   HA ) 4.71 4.71 0.00 
  peak 5340
assign ( resid  78 and name   HA ) ( resid 100 and name HD2+ ) 5.26 5.26 0.00 
  peak 5342
assign ( resid  75 and name  HD2 ) ( resid 100 and name HD2+ ) 4.44 4.44 0.00 
  peak 5350
assign ( resid  87 and name  HG+ ) ( resid  91 and name HG2+ ) 4.01 4.01 0.00 
  peak 5371
assign ( resid  14 and name  HB+ ) ( resid  14 and name  HD+ ) 3.06 3.06 0.00 
  peak 2925
assign ( resid  14 and name  HB+ ) ( resid  14 and name  HE+ ) 4.37 4.37 0.00 
  peak 4731
assign ( resid  14 and name  HB+ ) ( resid  15 and name   HN ) 4.03 4.03 0.00 
  peak 1318
assign ( resid  14 and name  HE+ ) ( resid  62 and name  HD+ ) 2.55 2.55 0.00 
  peak 3013
assign ( resid  15 and name   HA ) ( resid  16 and name  HB+ ) 4.89 4.89 0.00 
  peak 104
assign ( resid  15 and name   HB ) ( resid  62 and name  HD+ ) 4.51 4.51 0.00 
  peak 5246
assign ( resid  15 and name HG2+ ) ( resid  20 and name  HG+ ) 4.87 4.87 0.00 
  peak 1045
assign ( resid  16 and name   HN ) ( resid  16 and name  HB+ ) 3.37 3.37 0.00 
  peak 861
assign ( resid  19 and name   HA ) ( resid  20 and name  HB+ ) 4.63 4.63 0.00 
  peak 130
assign ( resid  20 and name   HN ) ( resid  20 and name  HB+ ) 2.94 2.94 0.00 
  peak 366
assign ( resid  20 and name   HN ) ( resid  20 and name  HG+ ) 4.80 4.80 0.00 
  peak 2138
assign ( resid  20 and name   HA ) ( resid  20 and name  HG+ ) 3.25 3.25 0.00 
  peak 4164
assign ( resid  20 and name  HB+ ) ( resid  21 and name   HN ) 4.03 4.03 0.00 
  peak 2405
assign ( resid  20 and name  HB+ ) ( resid  27 and name   HA ) 4.59 4.59 0.00 
  peak 1361
assign ( resid  20 and name  HB+ ) ( resid  27 and name HE21 ) 3.36 3.36 0.00 
  peak 1829
assign ( resid  20 and name  HB+ ) ( resid  27 and name HE22 ) 3.21 3.21 0.00 
  peak 1780
assign ( resid  20 and name  HG+ ) ( resid  21 and name   HN ) 4.09 4.09 0.00 
  peak 313
assign ( resid  20 and name  HG+ ) ( resid  21 and name   HA ) 4.84 4.84 0.00 
  peak 4746
assign ( resid  20 and name  HG+ ) ( resid  24 and name   HN ) 5.34 5.34 0.00 
  peak 4742
assign ( resid  20 and name  HG+ ) ( resid  27 and name   HA ) 4.53 4.53 0.00 
  peak 361
assign ( resid  20 and name  HG+ ) ( resid  27 and name  HB2 ) 3.62 3.62 0.00 
  peak 2754
assign ( resid  20 and name  HG+ ) ( resid  27 and name HE21 ) 5.34 5.34 0.00 
  peak 4858
assign ( resid  23 and name   HN ) ( resid  24 and name  HB+ ) 4.49 4.49 0.00 
  peak 852
assign ( resid  23 and name   HA ) ( resid  45 and name HG++ ) 4.91 4.91 0.00 
  peak 370
assign ( resid  23 and name  HB+ ) ( resid  45 and name HG++ ) 3.88 3.88 0.00 
  peak 781
assign ( resid  23 and name  HD+ ) ( resid  45 and name HG++ ) 3.45 3.45 0.00 
  peak 1949
assign ( resid  23 and name  HE+ ) ( resid  45 and name HG++ ) 3.23 3.23 0.00 
  peak 3918
assign ( resid  24 and name   HN ) ( resid  24 and name  HB+ ) 3.23 3.23 0.00 
  peak 845
assign ( resid  28 and name   HB ) ( resid  33 and name  HB+ ) 4.41 4.41 0.00 
  peak 896
assign ( resid  28 and name HG2+ ) ( resid  33 and name  HB+ ) 3.81 3.81 0.00 
  peak 4393
assign ( resid  28 and name HG2+ ) ( resid  33 and name  HG+ ) 4.24 4.24 0.00 
  peak 1383
assign ( resid  30 and name   HN ) ( resid  33 and name  HB+ ) 4.34 4.34 0.00 
  peak 3127
assign ( resid  30 and name  HB2 ) ( resid  33 and name  HB+ ) 4.55 4.55 0.00 
  peak 1735
assign ( resid  30 and name  HB1 ) ( resid  33 and name  HG+ ) 3.27 3.27 0.00 
  peak 2715
assign ( resid  32 and name   HN ) ( resid  33 and name  HG+ ) 4.30 4.30 0.00 
  peak 2260
assign ( resid  33 and name   HN ) ( resid  33 and name  HB+ ) 3.18 3.18 0.00 
  peak 321
assign ( resid  33 and name   HN ) ( resid  33 and name  HG+ ) 3.11 3.11 0.00 
  peak 4
assign ( resid  33 and name   HA ) ( resid  33 and name  HG+ ) 3.20 3.20 0.00 
  peak 2839
assign ( resid  33 and name  HB+ ) ( resid  34 and name   HN ) 3.30 3.30 0.00 
  peak 520
assign ( resid  33 and name  HB+ ) ( resid  34 and name   HA ) 5.34 5.34 0.00 
  peak 4650
assign ( resid  33 and name  HB+ ) ( resid  36 and name   HN ) 5.18 5.18 0.00 
  peak 1129
assign ( resid  33 and name  HB+ ) ( resid  36 and name  HB1 ) 4.23 4.23 0.00 
  peak 674
assign ( resid  33 and name  HB+ ) ( resid  36 and name  HD+ ) 4.70 4.70 0.00 
  peak 1438
assign ( resid  33 and name  HB+ ) ( resid  37 and name   HN ) 4.44 4.44 0.00 
  peak 2000
assign ( resid  33 and name  HG+ ) ( resid  34 and name   HN ) 3.81 3.81 0.00 
  peak 829
assign ( resid  36 and name   HA ) ( resid  39 and name  HB+ ) 3.72 3.72 0.00 
  peak 3434
assign ( resid  36 and name  HD+ ) ( resid  39 and name  HB+ ) 4.80 4.80 0.00 
  peak 4798
assign ( resid  36 and name  HD+ ) ( resid  40 and name  HB+ ) 3.64 3.64 0.00 
  peak 2170
assign ( resid  37 and name   HA ) ( resid  40 and name  HB+ ) 3.84 3.84 0.00 
  peak 1737
assign ( resid  38 and name   HN ) ( resid  39 and name  HB+ ) 5.02 5.02 0.00 
  peak 818
assign ( resid  39 and name   HN ) ( resid  39 and name  HB+ ) 2.95 2.95 0.00 
  peak 148
assign ( resid  39 and name   HN ) ( resid  40 and name  HB+ ) 4.35 4.35 0.00 
  peak 812
assign ( resid  39 and name  HB+ ) ( resid  40 and name   HN ) 3.36 3.36 0.00 
  peak 577
assign ( resid  39 and name  HB+ ) ( resid  40 and name   HA ) 5.04 5.04 0.00 
  peak 526
assign ( resid  40 and name  HB+ ) ( resid  41 and name   HN ) 3.27 3.27 0.00 
  peak 1
assign ( resid  40 and name  HB+ ) ( resid  41 and name   HA ) 4.39 4.39 0.00 
  peak 3101
assign ( resid  40 and name  HB+ ) ( resid  42 and name   HN ) 5.10 5.10 0.00 
  peak 360
assign ( resid  42 and name   HN ) ( resid  45 and name HG++ ) 5.27 5.27 0.00 
  peak 2426
assign ( resid  42 and name  HB2 ) ( resid  45 and name HG++ ) 3.81 3.81 0.00 
  peak 1235
assign ( resid  42 and name  HB1 ) ( resid  45 and name HG++ ) 3.62 3.62 0.00 
  peak 4427
assign ( resid  44 and name   HA ) ( resid  44 and name HD2+ ) 3.79 3.79 0.00 
  peak 1546
assign ( resid  44 and name  HB+ ) ( resid  44 and name HD2+ ) 3.24 3.24 0.00 
  peak 1864
assign ( resid  45 and name   HN ) ( resid  45 and name HG++ ) 3.48 3.48 0.00 
  peak 493
assign ( resid  45 and name   HA ) ( resid  45 and name HG++ ) 2.91 2.91 0.00 
  peak 4081
assign ( resid  45 and name HG++ ) ( resid  46 and name   HA ) 4.14 4.14 0.00 
  peak 3156
assign ( resid  49 and name  HB+ ) ( resid  50 and name   HN ) 3.73 3.73 0.00 
  peak 801
assign ( resid  49 and name  HB+ ) ( resid  93 and name  HD+ ) 3.90 3.90 0.00 
  peak 1346
assign ( resid  50 and name   HN ) ( resid  50 and name  HB+ ) 2.94 2.94 0.00 
  peak 328
assign ( resid  50 and name  HB+ ) ( resid  51 and name   HN ) 3.27 3.27 0.00 
  peak 504
assign ( resid  50 and name  HB+ ) ( resid  59 and name HD1+ ) 4.20 4.20 0.00 
  peak 2332
assign ( resid  50 and name  HB+ ) ( resid  60 and name   HN ) 4.73 4.73 0.00 
  peak 1719
assign ( resid  50 and name  HB+ ) ( resid  92 and name   HA ) 4.88 4.88 0.00 
  peak 1037
assign ( resid  50 and name  HB+ ) ( resid  92 and name HG2+ ) 3.07 3.07 0.00 
  peak 2656
assign ( resid  50 and name  HB+ ) ( resid  92 and name HG12 ) 4.09 4.09 0.00 
  peak 5268
assign ( resid  50 and name  HB+ ) ( resid  93 and name   HN ) 4.82 4.82 0.00 
  peak 2092
assign ( resid  51 and name   HN ) ( resid  66 and name HD++ ) 4.42 4.42 0.00 
  peak 2015
assign ( resid  51 and name  HB+ ) ( resid  66 and name HD++ ) 3.68 3.68 0.00 
  peak 2173
assign ( resid  51 and name  HD+ ) ( resid  66 and name HD++ ) 3.94 3.94 0.00 
  peak 1774
assign ( resid  52 and name   HA ) ( resid  66 and name HD++ ) 3.00 3.00 0.00 
  peak 4146
assign ( resid  53 and name   HN ) ( resid  66 and name HD++ ) 3.28 3.28 0.00 
  peak 4013
assign ( resid  53 and name   HA ) ( resid  66 and name HD++ ) 3.78 3.78 0.00 
  peak 3557
assign ( resid  53 and name  HB2 ) ( resid  66 and name HD++ ) 3.81 3.81 0.00 
  peak 3531
assign ( resid  53 and name  HB1 ) ( resid  66 and name HD++ ) 4.11 4.11 0.00 
  peak 1259
assign ( resid  58 and name  HD+ ) ( resid  66 and name HD++ ) 3.89 3.89 0.00 
  peak 2737
assign ( resid  58 and name  HE+ ) ( resid  66 and name HD++ ) 3.50 3.50 0.00 
  peak 2451
assign ( resid  58 and name   HZ ) ( resid  66 and name HD++ ) 3.92 3.92 0.00 
  peak 5073
assign ( resid  59 and name   HA ) ( resid  66 and name HD++ ) 3.97 3.97 0.00 
  peak 2708
assign ( resid  60 and name   HN ) ( resid  66 and name HD++ ) 3.53 3.53 0.00 
  peak 3876
assign ( resid  60 and name   HA ) ( resid  66 and name HD++ ) 5.09 5.09 0.00 
  peak 1309
assign ( resid  60 and name HG2+ ) ( resid  66 and name HD++ ) 3.01 3.01 0.00 
  peak 4444
assign ( resid  62 and name  HG+ ) ( resid  65 and name   HN ) 3.16 3.16 0.00 
  peak 2681
assign ( resid  62 and name  HD+ ) ( resid  65 and name   HA ) 4.60 4.60 0.00 
  peak 252
assign ( resid  64 and name   HA ) ( resid  66 and name HD++ ) 4.55 4.55 0.00 
  peak 1842
assign ( resid  64 and name  HB+ ) ( resid  66 and name HD++ ) 4.97 4.97 0.00 
  peak 967
assign ( resid  65 and name   HN ) ( resid  66 and name HD++ ) 3.59 3.59 0.00 
  peak 730
assign ( resid  65 and name  HB+ ) ( resid  66 and name HD++ ) 3.49 3.49 0.00 
  peak 2625
assign ( resid  66 and name   HN ) ( resid  66 and name HD++ ) 2.85 2.85 0.00 
  peak 85
assign ( resid  66 and name   HA ) ( resid  66 and name HD++ ) 4.03 4.03 0.00 
  peak 3346
assign ( resid  66 and name  HB2 ) ( resid  66 and name HD++ ) 3.01 3.01 0.00 
  peak 4301
assign ( resid  66 and name HD++ ) ( resid  67 and name   HN ) 3.33 3.33 0.00 
  peak 356
assign ( resid  66 and name HD++ ) ( resid  69 and name   HN ) 4.91 4.91 0.00 
  peak 3260
assign ( resid  66 and name HD++ ) ( resid  69 and name  HB2 ) 4.00 4.00 0.00 
  peak 5302
assign ( resid  70 and name  HB+ ) ( resid  77 and name  HG+ ) 4.20 4.20 0.00 
  peak 1500
assign ( resid  70 and name HD21 ) ( resid  77 and name  HG+ ) 4.73 4.73 0.00 
  peak 1368
assign ( resid  76 and name  HA1 ) ( resid  77 and name  HG+ ) 5.10 5.10 0.00 
  peak 319
assign ( resid  77 and name   HN ) ( resid  77 and name  HG+ ) 3.27 3.27 0.00 
  peak 615
assign ( resid  77 and name  HG+ ) ( resid  78 and name   HN ) 3.86 3.86 0.00 
  peak 96
assign ( resid  77 and name  HG+ ) ( resid  79 and name   HN ) 4.38 4.38 0.00 
  peak 1020
assign ( resid  77 and name  HG+ ) ( resid  79 and name  HB2 ) 4.95 4.95 0.00 
  peak 1424
assign ( resid  77 and name  HG+ ) ( resid  79 and name HD21 ) 3.79 3.79 0.00 
  peak 1886
assign ( resid  77 and name  HG+ ) ( resid  79 and name HD22 ) 5.33 5.33 0.00 
  peak 431
assign ( resid  77 and name  HG+ ) ( resid  97 and name HG2+ ) 3.75 3.75 0.00 
  peak 2353
assign ( resid  77 and name  HG+ ) ( resid  99 and name   HN ) 5.34 5.34 0.00 
  peak 2498
assign ( resid  77 and name  HG+ ) ( resid  99 and name  HB2 ) 4.61 4.61 0.00 
  peak 210
assign ( resid  77 and name  HG+ ) ( resid 100 and name   HN ) 4.18 4.18 0.00 
  peak 609
assign ( resid  77 and name  HG+ ) ( resid 100 and name  HB2 ) 4.85 4.85 0.00 
  peak 2342
assign ( resid  77 and name  HG+ ) ( resid 100 and name   HG ) 3.29 3.29 0.00 
  peak 2706
assign ( resid  77 and name  HG+ ) ( resid 100 and name HD1+ ) 3.25 3.25 0.00 
  peak 2739
assign ( resid  77 and name  HG+ ) ( resid 100 and name HD2+ ) 3.01 3.01 0.00 
  peak 2920
assign ( resid  84 and name   HN ) ( resid  84 and name  HB+ ) 3.29 3.29 0.00 
  peak 2492
assign ( resid  84 and name  HB+ ) ( resid  85 and name   HN ) 3.99 3.99 0.00 
  peak 363
assign ( resid  84 and name  HB+ ) ( resid  85 and name HG1+ ) 4.13 4.13 0.00 
  peak 2092
assign ( resid  84 and name  HB+ ) ( resid  85 and name HG2+ ) 4.83 4.83 0.00 
  peak 1643
assign ( resid  84 and name  HB+ ) ( resid  93 and name   HA ) 4.20 4.20 0.00 
  peak 794
assign ( resid  84 and name  HB+ ) ( resid  93 and name  HD+ ) 3.70 3.70 0.00 
  peak 1905
assign ( resid  85 and name HG1+ ) ( resid  87 and name  HD+ ) 3.75 3.75 0.00 
  peak 1552
assign ( resid  86 and name   HN ) ( resid  87 and name  HD+ ) 4.32 4.32 0.00 
  peak 675
assign ( resid  87 and name   HN ) ( resid  87 and name  HD+ ) 4.24 4.24 0.00 
  peak 2081
assign ( resid  87 and name   HA ) ( resid  87 and name  HD+ ) 4.51 4.51 0.00 
  peak 3310
assign ( resid  87 and name  HB2 ) ( resid  87 and name  HD+ ) 3.26 3.26 0.00 
  peak 3765
assign ( resid  87 and name  HB1 ) ( resid  87 and name  HD+ ) 3.55 3.55 0.00 
  peak 3922
assign ( resid 101 and name HG2+ ) ( resid 102 and name  HB+ ) 5.31 5.31 0.00 
  peak 4350
assign ( resid 102 and name   HN ) ( resid 102 and name  HB+ ) 2.63 2.63 0.00 
  peak 98
assign ( resid  21 and name   SG ) ( resid 205 ) 2.60 2.60 0.00 
  peak 98
assign ( resid  24 and name   SG ) ( resid 205 ) 2.60 2.60 0.00 
  peak 98
assign ( resid  37 and name  NE2 ) ( resid 205 ) 2.30 2.30 0.00 
  peak 98
assign ( resid  42 and name  NE2 ) ( resid 205 ) 2.30 2.30 0.00 
  peak 98
assign ( resid  53 and name   SG ) ( resid 305 ) 2.60 2.60 0.00 
  peak 98
assign ( resid  56 and name   SG ) ( resid 305 ) 2.60 2.60 0.00 
  peak 98
assign ( resid  69 and name  NE2 ) ( resid 305 ) 2.30 2.30 0.00 
  peak 98
assign ( resid  74 and name  NE2 ) ( resid 305 ) 2.30 2.30 0.00 
  peak 98
assign ( resid  21 and name   SG ) ( resid  24 and name   SG ) 3.90 3.90 0.00 
  peak 98
assign ( resid  21 and name   SG ) ( resid  37 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  21 and name   SG ) ( resid  42 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  24 and name   SG ) ( resid  37 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  24 and name   SG ) ( resid  42 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  37 and name  NE2 ) ( resid  42 and name  NE2 ) 3.30 3.30 0.00 
  peak 98
assign ( resid  53 and name   SG ) ( resid  56 and name   SG ) 3.90 3.90 0.00 
  peak 98
assign ( resid  53 and name   SG ) ( resid  69 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  53 and name   SG ) ( resid  74 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  56 and name   SG ) ( resid  69 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  56 and name   SG ) ( resid  74 and name  NE2 ) 3.70 3.70 0.00 
  peak 98
assign ( resid  69 and name  NE2 ) ( resid  74 and name  NE2 ) 3.30 3.30 0.00 
  peak 98

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    HA   MET   1           HA       MET   1  -7.109   6.313 -31.460
    2   1HB   MET   1          HB2       MET   1  -7.519   4.177 -30.199
    3   2HB   MET   1          HB1       MET   1  -6.787   4.910 -28.778
    4   1HG   MET   1          HG2       MET   1  -8.556   6.665 -28.887
    5   2HG   MET   1          HG1       MET   1  -9.334   5.719 -30.148
    6   1HE   MET   1          HE1       MET   1 -11.581   5.711 -28.733
    7   2HE   MET   1          HE2       MET   1 -10.777   6.677 -27.498
    8   3HE   MET   1          HE3       MET   1 -11.663   5.229 -27.037
    9    H    ALA   2           H        ALA   2  -7.746   8.324 -30.467
   10    HA   ALA   2           HA       ALA   2  -5.601   9.814 -29.292
   11   1HB   ALA   2          HB1       ALA   2  -8.510  10.552 -29.642
   12   2HB   ALA   2          HB2       ALA   2  -7.246  10.834 -30.828
   13   3HB   ALA   2          HB3       ALA   2  -7.196  11.665 -29.273
   14    H    HIS   3           H        HIS   3  -8.425   8.214 -28.236
   15    HA   HIS   3           HA       HIS   3  -8.929   7.212 -26.332
   16   1HB   HIS   3          HB2       HIS   3  -6.729   8.811 -25.033
   17   2HB   HIS   3          HB1       HIS   3  -7.850   7.831 -24.092
   18    HD1  HIS   3           HD1      HIS   3  -4.652   7.620 -25.841
   19    HD2  HIS   3           HD2      HIS   3  -7.759   5.014 -24.910
   20    HE1  HIS   3           HE1      HIS   3  -3.705   5.298 -26.039
   21    H    HIS   4           H        HIS   4 -10.521   7.425 -25.017
   22    HA   HIS   4           HA       HIS   4 -11.698  10.097 -24.820
   23   1HB   HIS   4          HB2       HIS   4 -12.930   8.474 -26.289
   24   2HB   HIS   4          HB1       HIS   4 -13.042   7.372 -24.932
   25    HD1  HIS   4           HD1      HIS   4 -14.991   9.829 -26.682
   26    HD2  HIS   4           HD2      HIS   4 -14.642   8.637 -22.715
   27    HE1  HIS   4           HE1      HIS   4 -17.091  10.565 -25.559
   28    H    HIS   5           H        HIS   5 -10.877  10.622 -22.817
   29    HA   HIS   5           HA       HIS   5 -10.789   8.744 -20.710
   30   1HB   HIS   5          HB2       HIS   5  -9.174  10.588 -20.799
   31   2HB   HIS   5          HB1       HIS   5 -10.479  11.758 -20.642
   32    HD1  HIS   5           HD1      HIS   5 -10.875  12.543 -18.288
   33    HD2  HIS   5           HD2      HIS   5  -9.030   8.823 -18.419
   34    HE1  HIS   5           HE1      HIS   5 -10.404  11.912 -15.901
   35    H    HIS   6           H        HIS   6 -12.335   8.127 -19.550
   36    HA   HIS   6           HA       HIS   6 -14.315   9.796 -18.384
   37   1HB   HIS   6          HB2       HIS   6 -15.330   9.490 -20.661
   38   2HB   HIS   6          HB1       HIS   6 -15.257   7.749 -20.433
   39    HD1  HIS   6           HD1      HIS   6 -17.432   6.738 -19.590
   40    HD2  HIS   6           HD2      HIS   6 -17.015  10.752 -18.568
   41    HE1  HIS   6           HE1      HIS   6 -19.556   7.392 -18.442
   42    H    HIS   7           H        HIS   7 -13.599   6.520 -19.462
   43    HA   HIS   7           HA       HIS   7 -14.519   5.470 -16.954
   44   1HB   HIS   7          HB2       HIS   7 -13.507   4.057 -19.430
   45   2HB   HIS   7          HB1       HIS   7 -14.070   3.228 -17.978
   46    HD1  HIS   7           HD1      HIS   7 -16.647   3.316 -17.482
   47    HD2  HIS   7           HD2      HIS   7 -15.476   5.219 -20.986
   48    HE1  HIS   7           HE1      HIS   7 -18.757   3.850 -18.731
   49    H    HIS   8           H        HIS   8 -13.243   6.180 -15.598
   50    HA   HIS   8           HA       HIS   8 -10.837   4.922 -14.892
   51   1HB   HIS   8          HB2       HIS   8  -9.856   6.331 -16.698
   52   2HB   HIS   8          HB1       HIS   8 -10.570   7.763 -15.974
   53    HD1  HIS   8           HD1      HIS   8  -8.710   9.108 -14.961
   54    HD2  HIS   8           HD2      HIS   8  -8.173   5.021 -14.412
   55    HE1  HIS   8           HE1      HIS   8  -6.609   8.854 -13.597
   56    H    ASN   9           H        ASN   9 -12.960   7.692 -14.837
   57    HA   ASN   9           HA       ASN   9 -12.514   8.617 -12.263
   58   1HB   ASN   9          HB2       ASN   9 -15.103   8.627 -13.844
   59   2HB   ASN   9          HB1       ASN   9 -14.841   9.527 -12.355
   60   1HD2  ASN   9          HD21      ASN   9 -14.309   9.405 -15.747
   61   2HD2  ASN   9          HD22      ASN   9 -13.581  10.962 -15.893
   62    H    GLN  10           H        GLN  10 -12.703   7.628 -10.457
   63    HA   GLN  10           HA       GLN  10 -13.343   6.371  -8.755
   64   1HB   GLN  10          HB2       GLN  10 -15.976   6.012 -10.191
   65   2HB   GLN  10          HB1       GLN  10 -15.672   5.656  -8.495
   66   1HG   GLN  10          HG2       GLN  10 -15.557   8.354  -9.820
   67   2HG   GLN  10          HG1       GLN  10 -16.777   7.791  -8.678
   68   1HE2  GLN  10          HE21      GLN  10 -14.927  10.071  -8.573
   69   2HE2  GLN  10          HE22      GLN  10 -14.059   9.908  -7.097
   70    H    GLN  11           H        GLN  11 -12.751   5.099 -11.642
   71    HA   GLN  11           HA       GLN  11 -13.051   2.299 -10.950
   72   1HB   GLN  11          HB2       GLN  11 -12.979   2.938 -13.321
   73   2HB   GLN  11          HB1       GLN  11 -11.406   3.687 -13.097
   74   1HG   GLN  11          HG2       GLN  11 -10.501   1.431 -12.491
   75   2HG   GLN  11          HG1       GLN  11 -12.056   0.746 -12.937
   76   1HE2  GLN  11          HE21      GLN  11 -12.419   2.544 -15.247
   77   2HE2  GLN  11          HE22      GLN  11 -11.289   1.991 -16.424
   78    H    ASN  12           H        ASN  12 -10.692   4.804 -10.998
   79    HA   ASN  12           HA       ASN  12  -8.745   3.149  -9.571
   80   1HB   ASN  12          HB2       ASN  12  -7.975   3.887 -11.766
   81   2HB   ASN  12          HB1       ASN  12  -8.408   5.545 -11.388
   82   1HD2  ASN  12          HD21      ASN  12  -6.296   6.180 -11.864
   83   2HD2  ASN  12          HD22      ASN  12  -5.000   5.905 -10.763
   84    H    LYS  13           H        LYS  13  -8.998   3.574  -7.452
   85    HA   LYS  13           HA       LYS  13  -9.672   6.207  -6.470
   86   1HB   LYS  13          HB2       LYS  13 -10.480   4.139  -5.327
   87   2HB   LYS  13          HB1       LYS  13  -8.821   3.696  -4.967
   88   1HG   LYS  13          HG2       LYS  13  -8.628   5.730  -3.549
   89   2HG   LYS  13          HG1       LYS  13 -10.322   6.086  -3.882
   90   1HD   LYS  13          HD2       LYS  13  -9.363   3.527  -2.587
   91   2HD   LYS  13          HD1       LYS  13  -9.881   4.943  -1.679
   92   1HE   LYS  13          HE2       LYS  13 -11.623   3.453  -3.663
   93   2HE   LYS  13          HE1       LYS  13 -11.629   3.164  -1.929
   94   1HZ   LYS  13          HZ1       LYS  13 -12.352   5.730  -3.259
   95   2HZ   LYS  13          HZ2       LYS  13 -12.315   5.455  -1.592
   96   3HZ   LYS  13          HZ3       LYS  13 -13.423   4.636  -2.542
   97    H    LYS  14           H        LYS  14  -6.915   4.548  -7.424
   98    HA   LYS  14           HA       LYS  14  -4.740   4.979  -7.532
   99   1HB   LYS  14          HB2       LYS  14  -5.481   7.215  -8.243
  100   2HB   LYS  14          HB1       LYS  14  -5.530   7.746  -6.574
  101   1HG   LYS  14          HG2       LYS  14  -3.562   8.586  -7.696
  102   2HG   LYS  14          HG1       LYS  14  -3.098   7.438  -6.434
  103   1HD   LYS  14          HD2       LYS  14  -2.820   5.717  -8.038
  104   2HD   LYS  14          HD1       LYS  14  -3.382   6.765  -9.356
  105   1HE   LYS  14          HE2       LYS  14  -0.932   7.113  -7.655
  106   2HE   LYS  14          HE1       LYS  14  -0.976   6.534  -9.311
  107   1HZ   LYS  14          HZ1       LYS  14  -1.689   9.296  -8.388
  108   2HZ   LYS  14          HZ2       LYS  14  -1.879   8.735  -9.976
  109   3HZ   LYS  14          HZ3       LYS  14  -0.361   8.835  -9.311
  110    H    VAL  15           H        VAL  15  -4.951   7.133  -4.958
  111    HA   VAL  15           HA       VAL  15  -4.825   5.644  -2.768
  112    HB   VAL  15           HB       VAL  15  -2.481   5.041  -3.957
  113   1HG1  VAL  15          HG11      VAL  15  -1.832   7.636  -2.655
  114   2HG1  VAL  15          HG12      VAL  15  -1.564   7.185  -4.357
  115   3HG1  VAL  15          HG13      VAL  15  -0.661   6.384  -3.042
  116   1HG2  VAL  15          HG21      VAL  15  -1.494   4.694  -1.769
  117   2HG2  VAL  15          HG22      VAL  15  -3.227   4.252  -1.866
  118   3HG2  VAL  15          HG23      VAL  15  -2.736   5.774  -1.109
  119    H    GLU  16           H        GLU  16  -5.091   7.143  -1.161
  120    HA   GLU  16           HA       GLU  16  -4.676   9.874  -2.048
  121   1HB   GLU  16          HB2       GLU  16  -6.820  10.395  -0.701
  122   2HB   GLU  16          HB1       GLU  16  -6.958   9.687  -2.302
  123   1HG   GLU  16          HG2       GLU  16  -7.351   7.532  -1.371
  124   2HG   GLU  16          HG1       GLU  16  -7.039   8.130   0.252
  125    H    GLY  17           H        GLY  17  -5.359   8.021   0.926
  126   1HA   GLY  17          HA2       GLY  17  -3.061   9.187   2.099
  127   2HA   GLY  17          HA1       GLY  17  -4.540   9.850   2.765
  128    H    GLY  18           H        GLY  18  -2.624   7.135   2.339
  129   1HA   GLY  18          HA2       GLY  18  -2.579   6.051   4.707
  130   2HA   GLY  18          HA1       GLY  18  -4.206   5.563   4.252
  131    H    TYR  19           H        TYR  19  -3.515   3.403   4.466
  132    HA   TYR  19           HA       TYR  19  -1.586   2.535   2.444
  133   1HB   TYR  19          HB2       TYR  19  -2.602   0.983   4.815
  134   2HB   TYR  19          HB1       TYR  19  -1.194   0.627   3.814
  135    HD1  TYR  19           HD1      TYR  19  -2.124   1.800   6.915
  136    HD2  TYR  19           HD2      TYR  19   0.495   2.778   3.712
  137    HE1  TYR  19           HE1      TYR  19  -0.811   3.135   8.433
  138    HE2  TYR  19           HE2      TYR  19   1.865   4.123   5.245
  139    HH   TYR  19           HH       TYR  19   1.613   5.286   7.315
  140    H    GLU  20           H        GLU  20  -2.488   1.971   0.672
  141    HA   GLU  20           HA       GLU  20  -5.098   0.682   0.669
  142   1HB   GLU  20          HB2       GLU  20  -4.699   2.474  -1.006
  143   2HB   GLU  20          HB1       GLU  20  -3.315   1.574  -1.620
  144   1HG   GLU  20          HG2       GLU  20  -5.126  -0.345  -1.832
  145   2HG   GLU  20          HG1       GLU  20  -6.214   1.031  -1.930
  146    H    CYS  21           H        CYS  21  -5.050  -1.435   0.743
  147    HA   CYS  21           HA       CYS  21  -2.707  -3.030   0.421
  148   1HB   CYS  21          HB2       CYS  21  -5.561  -3.908   0.145
  149   2HB   CYS  21          HB1       CYS  21  -4.177  -4.962   0.424
  150    H    LYS  22           H        LYS  22  -2.098  -4.338  -1.307
  151    HA   LYS  22           HA       LYS  22  -2.757  -3.730  -3.994
  152   1HB   LYS  22          HB2       LYS  22  -0.701  -4.798  -3.372
  153   2HB   LYS  22          HB1       LYS  22  -1.576  -6.178  -2.702
  154   1HG   LYS  22          HG2       LYS  22  -2.579  -6.464  -5.000
  155   2HG   LYS  22          HG1       LYS  22  -1.337  -5.353  -5.565
  156   1HD   LYS  22          HD2       LYS  22   0.383  -6.827  -4.865
  157   2HD   LYS  22          HD1       LYS  22  -0.787  -7.883  -4.057
  158   1HE   LYS  22          HE2       LYS  22  -0.269  -8.868  -6.182
  159   2HE   LYS  22          HE1       LYS  22  -1.906  -8.175  -6.172
  160   1HZ   LYS  22          HZ1       LYS  22  -1.199  -6.341  -7.469
  161   2HZ   LYS  22          HZ2       LYS  22  -0.595  -7.710  -8.239
  162   3HZ   LYS  22          HZ3       LYS  22   0.421  -6.762  -7.279
  163    H    TYR  23           H        TYR  23  -4.240  -5.850  -1.663
  164    HA   TYR  23           HA       TYR  23  -5.576  -7.369  -3.744
  165   1HB   TYR  23          HB2       TYR  23  -5.994  -8.525  -1.167
  166   2HB   TYR  23          HB1       TYR  23  -5.006  -9.141  -2.491
  167    HD1  TYR  23           HD1      TYR  23  -2.583  -8.717  -2.544
  168    HD2  TYR  23           HD2      TYR  23  -4.983  -7.312   0.666
  169    HE1  TYR  23           HE1      TYR  23  -0.556  -8.213  -1.248
  170    HE2  TYR  23           HE2      TYR  23  -2.967  -6.814   1.969
  171    HH   TYR  23           HH       TYR  23  -0.608  -7.565   2.047
  172    H    CYS  24           H        CYS  24  -6.252  -4.818  -1.831
  173    HA   CYS  24           HA       CYS  24  -9.039  -5.301  -2.265
  174   1HB   CYS  24          HB2       CYS  24  -9.771  -4.705   0.023
  175   2HB   CYS  24          HB1       CYS  24  -8.704  -6.102  -0.006
  176    H    THR  25           H        THR  25 -10.323  -3.303  -2.098
  177    HA   THR  25           HA       THR  25  -8.620  -1.088  -2.910
  178    HB   THR  25           HB       THR  25 -10.889  -0.191  -3.853
  179    HG1  THR  25           HG1      THR  25 -11.456  -2.979  -3.678
  180   1HG2  THR  25          HG21      THR  25  -9.018  -0.942  -5.252
  181   2HG2  THR  25          HG22      THR  25 -10.560  -1.463  -5.937
  182   3HG2  THR  25          HG23      THR  25  -9.546  -2.615  -5.070
  183    H    PHE  26           H        PHE  26  -9.383  -1.961  -0.183
  184    HA   PHE  26           HA       PHE  26 -10.677   0.461   0.805
  185   1HB   PHE  26          HB2       PHE  26 -10.011  -2.146   2.208
  186   2HB   PHE  26          HB1       PHE  26 -10.753  -0.754   2.986
  187    HD1  PHE  26           HD1      PHE  26 -13.046  -0.075   2.354
  188    HD2  PHE  26           HD2      PHE  26 -11.282  -3.656   0.890
  189    HE1  PHE  26           HE1      PHE  26 -15.274  -0.917   1.739
  190    HE2  PHE  26           HE2      PHE  26 -13.507  -4.503   0.265
  191    HZ   PHE  26           HZ       PHE  26 -15.505  -3.129   0.694
  192    H    GLN  27           H        GLN  27  -9.596   1.765   2.285
  193    HA   GLN  27           HA       GLN  27  -6.747   1.270   2.610
  194   1HB   GLN  27          HB2       GLN  27  -6.648   2.618   0.727
  195   2HB   GLN  27          HB1       GLN  27  -8.019   3.610   1.237
  196   1HG   GLN  27          HG2       GLN  27  -6.643   4.655   2.933
  197   2HG   GLN  27          HG1       GLN  27  -5.338   3.529   2.544
  198   1HE2  GLN  27          HE21      GLN  27  -4.102   3.938   1.011
  199   2HE2  GLN  27          HE22      GLN  27  -4.050   5.328  -0.006
  200    H    THR  28           H        THR  28  -5.882   2.043   4.428
  201    HA   THR  28           HA       THR  28  -7.352   3.957   5.974
  202    HB   THR  28           HB       THR  28  -8.185   1.921   6.976
  203    HG1  THR  28           HG1      THR  28  -7.842   3.215   8.653
  204   1HG2  THR  28          HG21      THR  28  -6.713   0.176   7.883
  205   2HG2  THR  28          HG22      THR  28  -5.308   1.068   7.344
  206   3HG2  THR  28          HG23      THR  28  -6.417   0.383   6.155
  207    HA   PRO  29           HA       PRO  29  -3.076   5.276   6.459
  208   1HB   PRO  29          HB2       PRO  29  -3.605   7.446   8.013
  209   2HB   PRO  29          HB1       PRO  29  -3.821   7.420   6.256
  210   1HG   PRO  29          HG2       PRO  29  -5.870   7.067   8.406
  211   2HG   PRO  29          HG1       PRO  29  -5.960   8.026   6.917
  212   1HD   PRO  29          HD2       PRO  29  -7.100   5.583   7.141
  213   2HD   PRO  29          HD1       PRO  29  -6.405   6.160   5.602
  214    H    ASP  30           H        ASP  30  -5.138   3.978   8.729
  215    HA   ASP  30           HA       ASP  30  -3.244   4.233  10.914
  216   1HB   ASP  30          HB2       ASP  30  -5.997   3.039  10.722
  217   2HB   ASP  30          HB1       ASP  30  -4.935   2.647  12.063
  218    H    LEU  31           H        LEU  31  -1.585   2.976  10.785
  219    HA   LEU  31           HA       LEU  31  -1.246   0.751   9.238
  220   1HB   LEU  31          HB2       LEU  31   0.374   2.236  10.678
  221   2HB   LEU  31          HB1       LEU  31   0.135   0.998  11.887
  222    HG   LEU  31           HG       LEU  31   2.191   0.509  10.754
  223   1HD1  LEU  31          HD11      LEU  31   0.868  -1.474  11.209
  224   2HD1  LEU  31          HD12      LEU  31   1.783  -1.669   9.696
  225   3HD1  LEU  31          HD13      LEU  31   0.061  -1.251   9.661
  226   1HD2  LEU  31          HD21      LEU  31   1.831   1.862   8.804
  227   2HD2  LEU  31          HD22      LEU  31   0.624   0.723   8.226
  228   3HD2  LEU  31          HD23      LEU  31   2.323   0.226   8.328
  229    H    ASN  32           H        ASN  32  -2.418   1.007  12.646
  230    HA   ASN  32           HA       ASN  32  -2.368  -1.697  13.226
  231   1HB   ASN  32          HB2       ASN  32  -2.771   0.206  14.866
  232   2HB   ASN  32          HB1       ASN  32  -4.393   0.279  14.140
  233   1HD2  ASN  32          HD21      ASN  32  -5.913  -1.226  14.596
  234   2HD2  ASN  32          HD22      ASN  32  -5.635  -2.432  15.780
  235    H    MET  33           H        MET  33  -4.847   0.373  11.807
  236    HA   MET  33           HA       MET  33  -6.812  -1.704  11.696
  237   1HB   MET  33          HB2       MET  33  -6.740   0.858  10.099
  238   2HB   MET  33          HB1       MET  33  -8.136  -0.176  10.346
  239   1HG   MET  33          HG2       MET  33  -6.662   1.381  12.402
  240   2HG   MET  33          HG1       MET  33  -8.256   1.785  11.747
  241   1HE   MET  33          HE1       MET  33  -7.780   1.734  14.825
  242   2HE   MET  33          HE2       MET  33  -9.143   0.788  15.417
  243   3HE   MET  33          HE3       MET  33  -9.382   1.970  14.128
  244    H    PHE  34           H        PHE  34  -4.350  -0.444   9.605
  245    HA   PHE  34           HA       PHE  34  -5.131  -1.780   7.267
  246   1HB   PHE  34          HB2       PHE  34  -3.507  -0.027   7.078
  247   2HB   PHE  34          HB1       PHE  34  -2.439  -0.783   8.228
  248    HD1  PHE  34           HD1      PHE  34  -0.755  -2.220   7.516
  249    HD2  PHE  34           HD2      PHE  34  -3.921  -1.265   4.807
  250    HE1  PHE  34           HE1      PHE  34   0.445  -3.358   5.689
  251    HE2  PHE  34           HE2      PHE  34  -2.724  -2.396   3.005
  252    HZ   PHE  34           HZ       PHE  34  -0.545  -3.446   3.434
  253    H    THR  35           H        THR  35  -2.730  -2.669   9.710
  254    HA   THR  35           HA       THR  35  -2.377  -5.179   8.470
  255    HB   THR  35           HB       THR  35  -0.473  -4.295   9.671
  256    HG1  THR  35           HG1      THR  35  -1.536  -6.740  10.169
  257   1HG2  THR  35          HG21      THR  35  -1.602  -3.086  11.431
  258   2HG2  THR  35          HG22      THR  35  -0.428  -4.202  12.142
  259   3HG2  THR  35          HG23      THR  35  -2.156  -4.594  12.163
  260    H    PHE  36           H        PHE  36  -4.512  -4.032  10.905
  261    HA   PHE  36           HA       PHE  36  -5.274  -6.544  11.902
  262   1HB   PHE  36          HB2       PHE  36  -5.933  -4.711  13.228
  263   2HB   PHE  36          HB1       PHE  36  -6.625  -3.838  11.893
  264    HD1  PHE  36           HD1      PHE  36  -7.084  -7.239  13.417
  265    HD2  PHE  36           HD2      PHE  36  -8.912  -3.676  12.010
  266    HE1  PHE  36           HE1      PHE  36  -9.290  -8.144  14.036
  267    HE2  PHE  36           HE2      PHE  36 -11.135  -4.571  12.617
  268    HZ   PHE  36           HZ       PHE  36 -11.319  -6.809  13.630
  269    H    HIS  37           H        HIS  37  -6.770  -4.496   9.374
  270    HA   HIS  37           HA       HIS  37  -8.635  -6.533   8.790
  271   1HB   HIS  37          HB2       HIS  37  -9.604  -5.099   7.206
  272   2HB   HIS  37          HB1       HIS  37  -8.765  -3.969   8.255
  273    HD1  HIS  37           HD1      HIS  37  -7.109  -2.415   7.135
  274    HD2  HIS  37           HD2      HIS  37  -8.330  -5.537   4.685
  275    HE1  HIS  37           HE1      HIS  37  -6.230  -1.865   4.823
  276    H    VAL  38           H        VAL  38  -5.447  -5.865   7.731
  277    HA   VAL  38           HA       VAL  38  -5.443  -7.594   5.489
  278    HB   VAL  38           HB       VAL  38  -3.187  -6.613   7.240
  279   1HG1  VAL  38          HG11      VAL  38  -1.612  -7.533   5.568
  280   2HG1  VAL  38          HG12      VAL  38  -2.972  -8.266   4.711
  281   3HG1  VAL  38          HG13      VAL  38  -2.560  -8.806   6.342
  282   1HG2  VAL  38          HG21      VAL  38  -3.937  -5.962   4.386
  283   2HG2  VAL  38          HG22      VAL  38  -2.556  -5.302   5.261
  284   3HG2  VAL  38          HG23      VAL  38  -4.195  -4.949   5.801
  285    H    ASP  39           H        ASP  39  -4.389  -8.079   8.858
  286    HA   ASP  39           HA       ASP  39  -3.700 -10.792   8.576
  287   1HB   ASP  39          HB2       ASP  39  -3.075  -9.350  10.504
  288   2HB   ASP  39          HB1       ASP  39  -4.750  -9.389  11.042
  289    H    SER  40           H        SER  40  -6.693  -9.190   9.029
  290    HA   SER  40           HA       SER  40  -8.174 -11.488   9.820
  291   1HB   SER  40          HB2       SER  40  -8.772  -9.196  10.528
  292   2HB   SER  40          HB1       SER  40  -9.073  -8.767   8.856
  293    HG   SER  40           HG       SER  40 -10.832 -10.137   8.800
  294    H    GLU  41           H        GLU  41  -7.840  -9.610   6.786
  295    HA   GLU  41           HA       GLU  41  -9.651 -11.569   5.545
  296   1HB   GLU  41          HB2       GLU  41  -8.883  -8.849   4.527
  297   2HB   GLU  41          HB1       GLU  41 -10.095  -9.910   3.829
  298   1HG   GLU  41          HG2       GLU  41 -10.165  -8.558   6.507
  299   2HG   GLU  41          HG1       GLU  41 -11.209  -8.221   5.122
  300    H    HIS  42           H        HIS  42  -6.424 -10.273   5.220
  301    HA   HIS  42           HA       HIS  42  -5.869 -12.239   3.183
  302   1HB   HIS  42          HB2       HIS  42  -4.331 -10.037   2.455
  303   2HB   HIS  42          HB1       HIS  42  -5.647 -10.718   1.517
  304    HD1  HIS  42           HD1      HIS  42  -7.949  -9.334   1.693
  305    HD2  HIS  42           HD2      HIS  42  -4.686  -7.527   3.511
  306    HE1  HIS  42           HE1      HIS  42  -8.631  -6.939   2.075
  307    HA   PRO  43           HA       PRO  43  -2.823 -11.766   6.761
  308   1HB   PRO  43          HB2       PRO  43  -2.791 -14.398   7.501
  309   2HB   PRO  43          HB1       PRO  43  -3.909 -13.207   8.165
  310   1HG   PRO  43          HG2       PRO  43  -4.363 -15.203   5.980
  311   2HG   PRO  43          HG1       PRO  43  -5.418 -14.761   7.337
  312   1HD   PRO  43          HD2       PRO  43  -5.834 -13.769   4.864
  313   2HD   PRO  43          HD1       PRO  43  -6.120 -12.810   6.325
  314    H    ASN  44           H        ASN  44  -3.045 -14.281   4.294
  315    HA   ASN  44           HA       ASN  44  -0.171 -13.953   3.904
  316   1HB   ASN  44          HB2       ASN  44  -0.436 -16.150   4.975
  317   2HB   ASN  44          HB1       ASN  44  -1.598 -16.623   3.737
  318   1HD2  ASN  44          HD21      ASN  44   1.789 -15.996   4.396
  319   2HD2  ASN  44          HD22      ASN  44   2.390 -16.676   2.946
  320    H    VAL  45           H        VAL  45  -0.002 -12.934   2.147
  321    HA   VAL  45           HA       VAL  45  -1.688 -13.749  -0.056
  322    HB   VAL  45           HB       VAL  45  -1.145 -11.342  -0.934
  323   1HG1  VAL  45          HG11      VAL  45  -3.354 -12.205  -0.384
  324   2HG1  VAL  45          HG12      VAL  45  -3.175 -10.540   0.179
  325   3HG1  VAL  45          HG13      VAL  45  -3.071 -11.885   1.327
  326   1HG2  VAL  45          HG21      VAL  45  -0.980  -9.713   0.867
  327   2HG2  VAL  45          HG22      VAL  45   0.429 -10.785   0.884
  328   3HG2  VAL  45          HG23      VAL  45  -0.879 -11.010   2.051
  329    H    VAL  46           H        VAL  46  -0.797 -14.518  -1.719
  330    HA   VAL  46           HA       VAL  46   1.912 -13.797  -2.317
  331    HB   VAL  46           HB       VAL  46   2.363 -16.208  -3.051
  332   1HG1  VAL  46          HG11      VAL  46   2.764 -17.087  -0.788
  333   2HG1  VAL  46          HG12      VAL  46   1.757 -15.801  -0.125
  334   3HG1  VAL  46          HG13      VAL  46   3.266 -15.404  -0.942
  335   1HG2  VAL  46          HG21      VAL  46  -0.129 -16.791  -1.454
  336   2HG2  VAL  46          HG22      VAL  46   0.958 -17.988  -2.155
  337   3HG2  VAL  46          HG23      VAL  46   0.013 -16.929  -3.203
  338    H    LEU  47           H        LEU  47   2.164 -13.341  -4.553
  339    HA   LEU  47           HA       LEU  47   0.246 -14.483  -6.350
  340   1HB   LEU  47          HB2       LEU  47  -0.884 -12.444  -5.501
  341   2HB   LEU  47          HB1       LEU  47   0.403 -11.472  -6.181
  342    HG   LEU  47           HG       LEU  47  -0.238 -12.216  -8.445
  343   1HD1  LEU  47          HD11      LEU  47  -1.166 -14.393  -7.909
  344   2HD1  LEU  47          HD12      LEU  47  -2.361 -13.415  -8.759
  345   3HD1  LEU  47          HD13      LEU  47  -2.485 -13.637  -7.017
  346   1HD2  LEU  47          HD21      LEU  47  -1.179 -10.164  -7.584
  347   2HD2  LEU  47          HD22      LEU  47  -2.464 -11.062  -6.782
  348   3HD2  LEU  47          HD23      LEU  47  -2.389 -11.018  -8.544
  349    H    ASN  48           H        ASN  48   2.032 -11.524  -7.219
  350    HA   ASN  48           HA       ASN  48   3.908 -13.203  -8.688
  351   1HB   ASN  48          HB2       ASN  48   2.051 -12.857 -10.260
  352   2HB   ASN  48          HB1       ASN  48   2.183 -11.121 -10.063
  353   1HD2  ASN  48          HD21      ASN  48   3.548 -13.943 -11.541
  354   2HD2  ASN  48          HD22      ASN  48   4.639 -13.119 -12.585
  355    H    SER  49           H        SER  49   3.261  -9.674  -9.062
  356    HA   SER  49           HA       SER  49   5.625  -9.095  -7.542
  357   1HB   SER  49          HB2       SER  49   6.650  -7.786  -9.454
  358   2HB   SER  49          HB1       SER  49   6.696  -9.541  -9.637
  359    HG   SER  49           HG       SER  49   4.915  -9.401 -11.013
  360    H    SER  50           H        SER  50   5.554  -7.031  -6.622
  361    HA   SER  50           HA       SER  50   3.781  -5.026  -7.497
  362   1HB   SER  50          HB2       SER  50   3.280  -6.632  -5.000
  363   2HB   SER  50          HB1       SER  50   2.508  -5.104  -5.421
  364    HG   SER  50           HG       SER  50   2.409  -6.838  -7.442
  365    H    TYR  51           H        TYR  51   3.821  -3.346  -5.608
  366    HA   TYR  51           HA       TYR  51   6.531  -3.281  -4.528
  367   1HB   TYR  51          HB2       TYR  51   4.787  -1.184  -5.712
  368   2HB   TYR  51          HB1       TYR  51   5.989  -0.761  -4.516
  369    HD1  TYR  51           HD1      TYR  51   6.633  -3.384  -7.038
  370    HD2  TYR  51           HD2      TYR  51   7.132   0.692  -5.972
  371    HE1  TYR  51           HE1      TYR  51   8.279  -3.130  -8.841
  372    HE2  TYR  51           HE2      TYR  51   8.792   0.961  -7.773
  373    HH   TYR  51           HH       TYR  51  10.286  -0.385  -9.078
  374    H    VAL  52           H        VAL  52   6.777  -2.773  -2.496
  375    HA   VAL  52           HA       VAL  52   4.446  -2.032  -0.879
  376    HB   VAL  52           HB       VAL  52   4.922  -4.444  -0.592
  377   1HG1  VAL  52          HG11      VAL  52   7.595  -3.570   0.334
  378   2HG1  VAL  52          HG12      VAL  52   7.233  -4.384  -1.199
  379   3HG1  VAL  52          HG13      VAL  52   6.969  -5.217   0.329
  380   1HG2  VAL  52          HG21      VAL  52   4.137  -3.322   1.379
  381   2HG2  VAL  52          HG22      VAL  52   5.787  -2.872   1.809
  382   3HG2  VAL  52          HG23      VAL  52   5.300  -4.572   1.814
  383    H    CYS  53           H        CYS  53   4.897  -0.507   0.629
  384    HA   CYS  53           HA       CYS  53   7.507   0.818   0.576
  385   1HB   CYS  53          HB2       CYS  53   5.520   2.194   0.758
  386   2HB   CYS  53          HB1       CYS  53   4.953   1.295   2.148
  387    H    VAL  54           H        VAL  54   9.054  -0.436   1.548
  388    HA   VAL  54           HA       VAL  54   8.680  -2.341   3.522
  389    HB   VAL  54           HB       VAL  54  11.163  -0.905   3.891
  390   1HG1  VAL  54          HG11      VAL  54  10.773  -3.179   4.548
  391   2HG1  VAL  54          HG12      VAL  54  12.109  -3.028   3.362
  392   3HG1  VAL  54          HG13      VAL  54  10.495  -3.531   2.831
  393   1HG2  VAL  54          HG21      VAL  54  11.110  -0.163   1.730
  394   2HG2  VAL  54          HG22      VAL  54  10.296  -1.558   1.148
  395   3HG2  VAL  54          HG23      VAL  54  12.014  -1.672   1.586
  396    H    GLU  55           H        GLU  55   9.069   1.034   3.686
  397    HA   GLU  55           HA       GLU  55   9.799   1.390   6.326
  398   1HB   GLU  55          HB2       GLU  55   8.045   3.254   4.734
  399   2HB   GLU  55          HB1       GLU  55   9.134   3.666   6.047
  400   1HG   GLU  55          HG2       GLU  55  10.031   2.594   3.380
  401   2HG   GLU  55          HG1       GLU  55   9.941   4.301   3.790
  402    H    CYS  56           H        CYS  56   6.749   1.193   4.720
  403    HA   CYS  56           HA       CYS  56   5.245   1.434   7.282
  404   1HB   CYS  56          HB2       CYS  56   4.186   1.459   4.478
  405   2HB   CYS  56          HB1       CYS  56   3.315   1.944   5.925
  406    H    ASN  57           H        ASN  57   6.361  -0.859   5.163
  407    HA   ASN  57           HA       ASN  57   5.835  -2.910   4.428
  408   1HB   ASN  57          HB2       ASN  57   4.996  -2.875   7.259
  409   2HB   ASN  57          HB1       ASN  57   4.824  -4.396   6.334
  410   1HD2  ASN  57          HD21      ASN  57   7.310  -3.879   4.821
  411   2HD2  ASN  57          HD22      ASN  57   8.555  -4.183   5.951
  412    H    PHE  58           H        PHE  58   4.254  -1.531   3.095
  413    HA   PHE  58           HA       PHE  58   1.616  -2.753   3.352
  414   1HB   PHE  58          HB2       PHE  58   0.413  -0.831   3.536
  415   2HB   PHE  58          HB1       PHE  58   1.918  -0.121   4.086
  416    HD1  PHE  58           HD1      PHE  58   3.080   1.469   2.678
  417    HD2  PHE  58           HD2      PHE  58  -0.460  -0.398   1.324
  418    HE1  PHE  58           HE1      PHE  58   2.868   3.194   0.853
  419    HE2  PHE  58           HE2      PHE  58  -0.688   1.305  -0.483
  420    HZ   PHE  58           HZ       PHE  58   0.966   3.096  -0.708
  421    H    LEU  59           H        LEU  59   0.980  -3.627   1.575
  422    HA   LEU  59           HA       LEU  59   2.520  -3.224  -0.862
  423   1HB   LEU  59          HB2       LEU  59   0.966  -5.411   0.326
  424   2HB   LEU  59          HB1       LEU  59   0.763  -5.218  -1.396
  425    HG   LEU  59           HG       LEU  59   3.460  -5.609  -0.092
  426   1HD1  LEU  59          HD11      LEU  59   1.595  -7.554  -1.423
  427   2HD1  LEU  59          HD12      LEU  59   1.928  -7.487   0.302
  428   3HD1  LEU  59          HD13      LEU  59   3.223  -7.933  -0.823
  429   1HD2  LEU  59          HD21      LEU  59   4.099  -6.207  -2.408
  430   2HD2  LEU  59          HD22      LEU  59   3.519  -4.555  -2.313
  431   3HD2  LEU  59          HD23      LEU  59   2.479  -5.810  -2.961
  432    H    THR  60           H        THR  60   1.540  -2.407  -2.664
  433    HA   THR  60           HA       THR  60  -1.306  -1.887  -2.525
  434    HB   THR  60           HB       THR  60  -0.450   0.225  -2.018
  435    HG1  THR  60           HG1      THR  60  -1.882   0.665  -3.658
  436   1HG2  THR  60          HG21      THR  60   1.933  -0.302  -2.452
  437   2HG2  THR  60          HG22      THR  60   1.500   1.282  -3.025
  438   3HG2  THR  60          HG23      THR  60   1.669  -0.047  -4.175
  439    H    LYS  61           H        LYS  61  -2.079  -1.283  -4.778
  440    HA   LYS  61           HA       LYS  61  -1.197  -3.516  -6.423
  441   1HB   LYS  61          HB2       LYS  61  -3.282  -3.146  -7.688
  442   2HB   LYS  61          HB1       LYS  61  -3.567  -3.405  -5.973
  443   1HG   LYS  61          HG2       LYS  61  -3.826  -0.972  -5.685
  444   2HG   LYS  61          HG1       LYS  61  -3.589  -0.764  -7.416
  445   1HD   LYS  61          HD2       LYS  61  -5.944  -0.709  -6.965
  446   2HD   LYS  61          HD1       LYS  61  -5.574  -2.214  -7.804
  447   1HE   LYS  61          HE2       LYS  61  -7.159  -2.556  -5.957
  448   2HE   LYS  61          HE1       LYS  61  -5.656  -3.429  -5.681
  449   1HZ   LYS  61          HZ1       LYS  61  -4.964  -1.776  -4.128
  450   2HZ   LYS  61          HZ2       LYS  61  -6.510  -2.172  -3.668
  451   3HZ   LYS  61          HZ3       LYS  61  -6.193  -0.746  -4.527
  452    H    ARG  62           H        ARG  62  -0.323  -0.408  -6.197
  453    HA   ARG  62           HA       ARG  62   0.464  -0.327  -8.996
  454   1HB   ARG  62          HB2       ARG  62  -0.143   2.090  -9.072
  455   2HB   ARG  62          HB1       ARG  62  -1.522   1.002  -8.984
  456   1HG   ARG  62          HG2       ARG  62  -1.650   1.453  -6.545
  457   2HG   ARG  62          HG1       ARG  62  -0.365   2.645  -6.742
  458   1HD   ARG  62          HD2       ARG  62  -2.628   3.614  -6.723
  459   2HD   ARG  62          HD1       ARG  62  -1.733   3.975  -8.190
  460    HE   ARG  62           HE       ARG  62  -3.180   2.633  -9.409
  461   1HH1  ARG  62          HH11      ARG  62  -4.023   2.387  -5.966
  462   2HH1  ARG  62          HH12      ARG  62  -5.406   1.507  -6.150
  463   1HH2  ARG  62          HH21      ARG  62  -5.123   1.474  -9.775
  464   2HH2  ARG  62          HH22      ARG  62  -6.126   0.951  -8.503
  465    H    TYR  63           H        TYR  63   2.432   0.620  -9.339
  466    HA   TYR  63           HA       TYR  63   4.246   0.757  -7.177
  467   1HB   TYR  63          HB2       TYR  63   5.917   1.390  -8.843
  468   2HB   TYR  63          HB1       TYR  63   4.878   0.149  -9.530
  469    HD1  TYR  63           HD1      TYR  63   6.189   3.467  -9.920
  470    HD2  TYR  63           HD2      TYR  63   3.019   0.902 -11.129
  471    HE1  TYR  63           HE1      TYR  63   5.706   4.960 -11.806
  472    HE2  TYR  63           HE2      TYR  63   2.534   2.390 -13.023
  473    HH   TYR  63           HH       TYR  63   2.854   4.803 -13.530
  474    H    ASP  64           H        ASP  64   2.173   2.943  -8.659
  475    HA   ASP  64           HA       ASP  64   3.301   5.510  -8.388
  476   1HB   ASP  64          HB2       ASP  64   0.406   4.789  -8.144
  477   2HB   ASP  64          HB1       ASP  64   1.117   6.286  -8.734
  478    H    ALA  65           H        ALA  65   1.406   3.590  -6.134
  479    HA   ALA  65           HA       ALA  65   0.865   5.721  -4.372
  480   1HB   ALA  65          HB1       ALA  65   0.217   3.892  -2.803
  481   2HB   ALA  65          HB2       ALA  65   0.857   2.744  -4.000
  482   3HB   ALA  65          HB3       ALA  65  -0.499   3.772  -4.411
  483    H    LEU  66           H        LEU  66   3.569   3.705  -4.830
  484    HA   LEU  66           HA       LEU  66   4.860   4.310  -2.321
  485   1HB   LEU  66          HB2       LEU  66   5.987   3.167  -4.829
  486   2HB   LEU  66          HB1       LEU  66   6.823   3.218  -3.291
  487    HG   LEU  66           HG       LEU  66   6.129   1.028  -3.485
  488   1HD1  LEU  66          HD11      LEU  66   4.412   0.669  -1.797
  489   2HD1  LEU  66          HD12      LEU  66   3.958   2.366  -1.925
  490   3HD1  LEU  66          HD13      LEU  66   5.560   1.928  -1.313
  491   1HD2  LEU  66          HD21      LEU  66   3.441   2.001  -4.363
  492   2HD2  LEU  66          HD22      LEU  66   3.928   0.306  -4.199
  493   3HD2  LEU  66          HD23      LEU  66   4.706   1.359  -5.392
  494    H    SER  67           H        SER  67   4.769   5.508  -5.517
  495    HA   SER  67           HA       SER  67   7.112   7.145  -5.379
  496   1HB   SER  67          HB2       SER  67   4.844   6.724  -7.173
  497   2HB   SER  67          HB1       SER  67   5.807   8.190  -7.426
  498    HG   SER  67           HG       SER  67   7.120   5.705  -7.113
  499    H    GLU  68           H        GLU  68   3.650   7.762  -5.219
  500    HA   GLU  68           HA       GLU  68   4.091  10.484  -4.539
  501   1HB   GLU  68          HB2       GLU  68   1.567   9.275  -3.665
  502   2HB   GLU  68          HB1       GLU  68   1.888  10.772  -4.537
  503   1HG   GLU  68          HG2       GLU  68   2.483   9.232  -6.537
  504   2HG   GLU  68          HG1       GLU  68   1.674   7.998  -5.628
  505    H    HIS  69           H        HIS  69   4.209   7.628  -2.864
  506    HA   HIS  69           HA       HIS  69   3.372   8.146  -0.300
  507   1HB   HIS  69          HB2       HIS  69   4.319   6.026  -1.369
  508   2HB   HIS  69          HB1       HIS  69   5.889   6.642  -0.808
  509    HD1  HIS  69           HD1      HIS  69   2.485   5.724   0.576
  510    HD2  HIS  69           HD2      HIS  69   6.470   5.887   1.601
  511    HE1  HIS  69           HE1      HIS  69   2.619   4.740   2.894
  512    H    ASN  70           H        ASN  70   6.822   8.590  -1.359
  513    HA   ASN  70           HA       ASN  70   7.477  10.095   1.016
  514   1HB   ASN  70          HB2       ASN  70   9.626  10.498  -0.109
  515   2HB   ASN  70          HB1       ASN  70   9.212   8.800  -0.034
  516   1HD2  ASN  70          HD21      ASN  70  11.016   9.905  -1.625
  517   2HD2  ASN  70          HD22      ASN  70  10.586   9.667  -3.306
  518    H    LEU  71           H        LEU  71   5.882  10.893  -1.730
  519    HA   LEU  71           HA       LEU  71   6.672  13.640  -1.827
  520   1HB   LEU  71          HB2       LEU  71   5.908  12.818  -3.879
  521   2HB   LEU  71          HB1       LEU  71   4.669  11.860  -3.126
  522    HG   LEU  71           HG       LEU  71   3.244  13.700  -2.910
  523   1HD1  LEU  71          HD11      LEU  71   5.482  15.381  -4.161
  524   2HD1  LEU  71          HD12      LEU  71   4.928  15.516  -2.490
  525   3HD1  LEU  71          HD13      LEU  71   3.855  15.970  -3.812
  526   1HD2  LEU  71          HD21      LEU  71   3.195  12.556  -5.002
  527   2HD2  LEU  71          HD22      LEU  71   4.475  13.584  -5.647
  528   3HD2  LEU  71          HD23      LEU  71   2.892  14.271  -5.284
  529    H    LYS  72           H        LYS  72   3.849  11.855  -0.674
  530    HA   LYS  72           HA       LYS  72   3.117  14.212   0.886
  531   1HB   LYS  72          HB2       LYS  72   0.824  12.724   0.789
  532   2HB   LYS  72          HB1       LYS  72   1.168  14.136  -0.238
  533   1HG   LYS  72          HG2       LYS  72   2.207  12.365  -1.797
  534   2HG   LYS  72          HG1       LYS  72   1.407  11.188  -0.822
  535   1HD   LYS  72          HD2       LYS  72   0.064  13.451  -2.295
  536   2HD   LYS  72          HD1       LYS  72   0.035  11.739  -2.729
  537   1HE   LYS  72          HE2       LYS  72  -1.158  11.255  -0.619
  538   2HE   LYS  72          HE1       LYS  72  -1.118  12.967  -0.229
  539   1HZ   LYS  72          HZ1       LYS  72  -3.247  12.237  -1.184
  540   2HZ   LYS  72          HZ2       LYS  72  -2.458  11.859  -2.626
  541   3HZ   LYS  72          HZ3       LYS  72  -2.514  13.445  -2.090
  542    H    TYR  73           H        TYR  73   3.389  10.806   1.097
  543    HA   TYR  73           HA       TYR  73   2.343  10.584   3.798
  544   1HB   TYR  73          HB2       TYR  73   3.732   8.615   2.009
  545   2HB   TYR  73          HB1       TYR  73   3.083   8.174   3.590
  546    HD1  TYR  73           HD1      TYR  73   1.209   6.843   3.315
  547    HD2  TYR  73           HD2      TYR  73   1.793  10.063   0.630
  548    HE1  TYR  73           HE1      TYR  73  -0.877   6.269   2.161
  549    HE2  TYR  73           HE2      TYR  73  -0.272   9.533  -0.504
  550    HH   TYR  73           HH       TYR  73  -1.714   7.678  -0.814
  551    H    HIS  74           H        HIS  74   5.555  10.015   2.281
  552    HA   HIS  74           HA       HIS  74   6.788  10.703   4.920
  553   1HB   HIS  74          HB2       HIS  74   7.970   9.069   2.642
  554   2HB   HIS  74          HB1       HIS  74   8.878   9.584   4.047
  555    HD1  HIS  74           HD1      HIS  74   9.037   7.801   5.857
  556    HD2  HIS  74           HD2      HIS  74   5.890   7.221   3.227
  557    HE1  HIS  74           HE1      HIS  74   8.166   5.499   6.347
  558    HA   PRO  75           HA       PRO  75   7.688  13.992   1.752
  559   1HB   PRO  75          HB2       PRO  75   6.958  16.127   3.170
  560   2HB   PRO  75          HB1       PRO  75   5.752  15.111   2.361
  561   1HG   PRO  75          HG2       PRO  75   6.635  15.034   5.240
  562   2HG   PRO  75          HG1       PRO  75   4.982  15.040   4.575
  563   1HD   PRO  75          HD2       PRO  75   6.242  12.748   5.339
  564   2HD   PRO  75          HD1       PRO  75   5.091  12.831   3.990
  565    H    GLY  76           H        GLY  76   9.339  15.359   1.556
  566   1HA   GLY  76          HA2       GLY  76  10.859  16.805   3.136
  567   2HA   GLY  76          HA1       GLY  76  11.417  15.194   3.590
  568    H    GLU  77           H        GLU  77  11.352  13.892   1.193
  569    HA   GLU  77           HA       GLU  77  12.821  15.347  -0.791
  570   1HB   GLU  77          HB2       GLU  77  14.811  13.865  -0.634
  571   2HB   GLU  77          HB1       GLU  77  14.632  14.878   0.785
  572   1HG   GLU  77          HG2       GLU  77  14.979  12.972   1.940
  573   2HG   GLU  77          HG1       GLU  77  13.294  12.630   1.505
  574    H    GLU  78           H        GLU  78  13.505  13.606  -2.502
  575    HA   GLU  78           HA       GLU  78  11.495  11.492  -2.472
  576   1HB   GLU  78          HB2       GLU  78  10.661  13.367  -3.839
  577   2HB   GLU  78          HB1       GLU  78  12.179  13.255  -4.747
  578   1HG   GLU  78          HG2       GLU  78  11.579  11.135  -5.657
  579   2HG   GLU  78          HG1       GLU  78  10.193  11.008  -4.576
  580    H    ASN  79           H        ASN  79  13.095  10.042  -1.952
  581    HA   ASN  79           HA       ASN  79  14.681   9.093  -4.202
  582   1HB   ASN  79          HB2       ASN  79  15.717   9.737  -1.467
  583   2HB   ASN  79          HB1       ASN  79  16.666   8.845  -2.674
  584   1HD2  ASN  79          HD21      ASN  79  15.435  11.797  -1.625
  585   2HD2  ASN  79          HD22      ASN  79  16.149  12.891  -2.771
  586    H    PHE  80           H        PHE  80  13.338   7.337  -4.229
  587    HA   PHE  80           HA       PHE  80  13.310   5.623  -1.856
  588   1HB   PHE  80          HB2       PHE  80  11.392   6.162  -3.996
  589   2HB   PHE  80          HB1       PHE  80  11.699   4.454  -3.764
  590    HD1  PHE  80           HD1      PHE  80   9.833   7.241  -2.709
  591    HD2  PHE  80           HD2      PHE  80  11.487   3.598  -1.327
  592    HE1  PHE  80           HE1      PHE  80   8.152   7.158  -0.908
  593    HE2  PHE  80           HE2      PHE  80   9.810   3.499   0.447
  594    HZ   PHE  80           HZ       PHE  80   8.138   5.273   0.663
  595    H    LYS  81           H        LYS  81  14.007   3.508  -2.038
  596    HA   LYS  81           HA       LYS  81  15.590   2.862  -4.433
  597   1HB   LYS  81          HB2       LYS  81  17.226   2.000  -3.026
  598   2HB   LYS  81          HB1       LYS  81  16.465   3.115  -1.895
  599   1HG   LYS  81          HG2       LYS  81  15.170   1.402  -0.904
  600   2HG   LYS  81          HG1       LYS  81  15.657   0.248  -2.132
  601   1HD   LYS  81          HD2       LYS  81  18.043   0.674  -1.317
  602   2HD   LYS  81          HD1       LYS  81  17.237   1.413   0.083
  603   1HE   LYS  81          HE2       LYS  81  16.008  -0.633   0.502
  604   2HE   LYS  81          HE1       LYS  81  16.717  -1.346  -0.944
  605   1HZ   LYS  81          HZ1       LYS  81  17.805  -2.106   1.109
  606   2HZ   LYS  81          HZ2       LYS  81  18.277  -0.527   1.468
  607   3HZ   LYS  81          HZ3       LYS  81  18.884  -1.297   0.112
  608    H    LEU  82           H        LEU  82  15.603   0.372  -4.758
  609    HA   LEU  82           HA       LEU  82  13.091  -0.763  -3.843
  610   1HB   LEU  82          HB2       LEU  82  12.786  -1.897  -6.021
  611   2HB   LEU  82          HB1       LEU  82  12.666  -0.163  -6.148
  612    HG   LEU  82           HG       LEU  82  15.208  -1.605  -6.852
  613   1HD1  LEU  82          HD11      LEU  82  12.835  -0.997  -8.640
  614   2HD1  LEU  82          HD12      LEU  82  13.395  -2.608  -8.184
  615   3HD1  LEU  82          HD13      LEU  82  14.402  -1.576  -9.202
  616   1HD2  LEU  82          HD21      LEU  82  15.326   0.837  -6.612
  617   2HD2  LEU  82          HD22      LEU  82  14.014   1.015  -7.776
  618   3HD2  LEU  82          HD23      LEU  82  15.568   0.353  -8.291
  619    H    THR  83           H        THR  83  13.187  -2.837  -3.165
  620    HA   THR  83           HA       THR  83  15.556  -4.404  -3.699
  621    HB   THR  83           HB       THR  83  16.152  -3.199  -1.668
  622    HG1  THR  83           HG1      THR  83  15.433  -5.472  -0.345
  623   1HG2  THR  83          HG21      THR  83  13.918  -2.495  -0.955
  624   2HG2  THR  83          HG22      THR  83  14.796  -3.236   0.381
  625   3HG2  THR  83          HG23      THR  83  13.547  -4.147  -0.469
  626    H    MET  84           H        MET  84  14.810  -6.615  -3.954
  627    HA   MET  84           HA       MET  84  11.957  -6.901  -3.235
  628   1HB   MET  84          HB2       MET  84  12.526  -7.530  -5.575
  629   2HB   MET  84          HB1       MET  84  13.687  -8.698  -4.926
  630   1HG   MET  84          HG2       MET  84  11.753  -9.798  -3.736
  631   2HG   MET  84          HG1       MET  84  10.692  -8.762  -4.682
  632   1HE   MET  84          HE1       MET  84  12.081  -8.714  -7.543
  633   2HE   MET  84          HE2       MET  84  10.360  -8.999  -7.313
  634   3HE   MET  84          HE3       MET  84  11.308 -10.091  -8.326
  635    H    VAL  85           H        VAL  85  11.919  -7.472  -1.172
  636    HA   VAL  85           HA       VAL  85  12.876 -10.119  -0.643
  637    HB   VAL  85           HB       VAL  85  13.507  -9.183   1.785
  638   1HG1  VAL  85          HG11      VAL  85  15.866  -8.966   1.069
  639   2HG1  VAL  85          HG12      VAL  85  15.316  -8.902  -0.615
  640   3HG1  VAL  85          HG13      VAL  85  15.071 -10.363   0.335
  641   1HG2  VAL  85          HG21      VAL  85  14.602  -6.969   1.677
  642   2HG2  VAL  85          HG22      VAL  85  12.882  -6.840   1.289
  643   3HG2  VAL  85          HG23      VAL  85  14.082  -6.814  -0.003
  644    H    LYS  86           H        LYS  86  10.867 -10.993  -0.333
  645    HA   LYS  86           HA       LYS  86   9.411  -9.818   1.859
  646   1HB   LYS  86          HB2       LYS  86   8.451  -9.043  -0.453
  647   2HB   LYS  86          HB1       LYS  86   7.809 -10.688  -0.542
  648   1HG   LYS  86          HG2       LYS  86   6.137  -9.279   0.183
  649   2HG   LYS  86          HG1       LYS  86   6.625 -10.297   1.532
  650   1HD   LYS  86          HD2       LYS  86   7.784  -8.579   2.648
  651   2HD   LYS  86          HD1       LYS  86   7.938  -7.621   1.186
  652   1HE   LYS  86          HE2       LYS  86   5.724  -6.766   1.400
  653   2HE   LYS  86          HE1       LYS  86   5.263  -8.016   2.561
  654   1HZ   LYS  86          HZ1       LYS  86   6.783  -7.051   4.089
  655   2HZ   LYS  86          HZ2       LYS  86   5.703  -5.879   3.543
  656   3HZ   LYS  86          HZ3       LYS  86   7.315  -5.932   2.935
  657    H    ARG  87           H        ARG  87   9.294 -11.396   3.266
  658    HA   ARG  87           HA       ARG  87   9.287 -14.064   2.128
  659   1HB   ARG  87          HB2       ARG  87  10.441 -13.164   4.770
  660   2HB   ARG  87          HB1       ARG  87  10.308 -14.851   4.281
  661   1HG   ARG  87          HG2       ARG  87  12.480 -14.397   3.653
  662   2HG   ARG  87          HG1       ARG  87  11.613 -14.020   2.164
  663   1HD   ARG  87          HD2       ARG  87  13.144 -12.254   2.485
  664   2HD   ARG  87          HD1       ARG  87  11.567 -11.618   2.936
  665    HE   ARG  87           HE       ARG  87  12.920 -12.710   5.168
  666   1HH1  ARG  87          HH11      ARG  87  12.630  -9.719   3.285
  667   2HH1  ARG  87          HH12      ARG  87  13.578  -8.798   4.347
  668   1HH2  ARG  87          HH21      ARG  87  14.190 -11.400   6.647
  669   2HH2  ARG  87          HH22      ARG  87  14.471  -9.763   6.298
  670    H    ASN  88           H        ASN  88   8.232 -15.728   3.371
  671    HA   ASN  88           HA       ASN  88   6.382 -16.669   4.205
  672   1HB   ASN  88          HB2       ASN  88   6.709 -15.303   6.270
  673   2HB   ASN  88          HB1       ASN  88   5.835 -13.976   5.537
  674   1HD2  ASN  88          HD21      ASN  88   5.451 -15.637   8.003
  675   2HD2  ASN  88          HD22      ASN  88   3.824 -16.184   7.931
  676    H    ASN  89           H        ASN  89   5.867 -13.513   2.947
  677    HA   ASN  89           HA       ASN  89   3.360 -14.140   1.593
  678   1HB   ASN  89          HB2       ASN  89   5.177 -11.715   1.357
  679   2HB   ASN  89          HB1       ASN  89   3.536 -11.834   0.754
  680   1HD2  ASN  89          HD21      ASN  89   5.551 -11.271   3.502
  681   2HD2  ASN  89          HD22      ASN  89   4.278 -10.804   4.568
  682    H    GLN  90           H        GLN  90   4.169 -12.532  -0.784
  683    HA   GLN  90           HA       GLN  90   5.602 -14.588  -2.285
  684   1HB   GLN  90          HB2       GLN  90   4.976 -13.308  -4.234
  685   2HB   GLN  90          HB1       GLN  90   3.512 -13.675  -3.291
  686   1HG   GLN  90          HG2       GLN  90   4.961 -11.080  -3.192
  687   2HG   GLN  90          HG1       GLN  90   3.718 -11.407  -4.404
  688   1HE2  GLN  90          HE21      GLN  90   4.441 -10.647  -1.138
  689   2HE2  GLN  90          HE22      GLN  90   2.794 -10.475  -0.612
  690    H    THR  91           H        THR  91   7.125 -13.502  -4.016
  691    HA   THR  91           HA       THR  91   8.750 -11.645  -2.536
  692    HB   THR  91           HB       THR  91  10.304 -12.070  -4.596
  693    HG1  THR  91           HG1      THR  91   9.688 -13.595  -5.940
  694   1HG2  THR  91          HG21      THR  91  10.724 -12.916  -2.291
  695   2HG2  THR  91          HG22      THR  91  11.205 -14.091  -3.507
  696   3HG2  THR  91          HG23      THR  91   9.696 -14.300  -2.630
  697    H    ILE  92           H        ILE  92   8.330  -9.690  -2.741
  698    HA   ILE  92           HA       ILE  92   7.641  -8.494  -5.244
  699    HB   ILE  92           HB       ILE  92   6.053  -6.954  -3.946
  700   1HG1  ILE  92          HG12      ILE  92   4.843  -8.354  -2.093
  701   2HG1  ILE  92          HG11      ILE  92   6.390  -9.157  -2.019
  702   1HG2  ILE  92          HG21      ILE  92   5.199  -8.346  -5.607
  703   2HG2  ILE  92          HG22      ILE  92   4.137  -8.476  -4.202
  704   3HG2  ILE  92          HG23      ILE  92   5.294  -9.764  -4.577
  705   1HD1  ILE  92          HD11      ILE  92   6.242  -7.324  -0.413
  706   2HD1  ILE  92          HD12      ILE  92   6.131  -6.188  -1.761
  707   3HD1  ILE  92          HD13      ILE  92   7.566  -7.172  -1.552
  708    H    PHE  93           H        PHE  93   7.915  -6.086  -5.181
  709    HA   PHE  93           HA       PHE  93  10.647  -5.812  -4.215
  710   1HB   PHE  93          HB2       PHE  93   8.879  -4.099  -5.944
  711   2HB   PHE  93          HB1       PHE  93  10.542  -3.714  -5.592
  712    HD1  PHE  93           HD1      PHE  93  12.320  -5.007  -6.657
  713    HD2  PHE  93           HD2      PHE  93   8.227  -5.708  -7.551
  714    HE1  PHE  93           HE1      PHE  93  12.976  -6.171  -8.731
  715    HE2  PHE  93           HE2      PHE  93   8.866  -6.880  -9.619
  716    HZ   PHE  93           HZ       PHE  93  11.244  -7.108 -10.212
  717    H    GLU  94           H        GLU  94  10.979  -4.778  -2.391
  718    HA   GLU  94           HA       GLU  94   8.900  -3.181  -1.226
  719   1HB   GLU  94          HB2       GLU  94  11.564  -4.075  -0.051
  720   2HB   GLU  94          HB1       GLU  94  10.236  -3.318   0.801
  721   1HG   GLU  94          HG2       GLU  94   8.976  -5.434  -0.108
  722   2HG   GLU  94          HG1       GLU  94  10.611  -6.109   0.018
  723    H    GLN  95           H        GLN  95   9.255  -1.071  -0.894
  724    HA   GLN  95           HA       GLN  95  11.600   0.038  -2.275
  725   1HB   GLN  95          HB2       GLN  95   9.197   0.254  -3.283
  726   2HB   GLN  95          HB1       GLN  95   8.957   1.461  -2.023
  727   1HG   GLN  95          HG2       GLN  95  10.788   2.753  -2.857
  728   2HG   GLN  95          HG1       GLN  95  11.183   1.495  -4.016
  729   1HE2  GLN  95          HE21      GLN  95   9.038   4.116  -3.210
  730   2HE2  GLN  95          HE22      GLN  95   8.385   4.294  -4.778
  731    H    THR  96           H        THR  96  12.966   0.899  -0.823
  732    HA   THR  96           HA       THR  96  11.860   2.001   1.675
  733    HB   THR  96           HB       THR  96  14.710   1.601   1.763
  734    HG1  THR  96           HG1      THR  96  13.607  -0.906   1.715
  735   1HG2  THR  96          HG21      THR  96  12.357   0.428   3.251
  736   2HG2  THR  96          HG22      THR  96  13.325   1.790   3.739
  737   3HG2  THR  96          HG23      THR  96  14.031   0.168   3.722
  738    H    ILE  97           H        ILE  97  12.983   3.850   2.527
  739    HA   ILE  97           HA       ILE  97  13.999   5.600   0.401
  740    HB   ILE  97           HB       ILE  97  13.147   6.418   3.199
  741   1HG1  ILE  97          HG12      ILE  97  11.359   6.459   0.804
  742   2HG1  ILE  97          HG11      ILE  97  11.433   5.024   1.802
  743   1HG2  ILE  97          HG21      ILE  97  13.035   7.868   0.518
  744   2HG2  ILE  97          HG22      ILE  97  14.426   7.935   1.573
  745   3HG2  ILE  97          HG23      ILE  97  12.894   8.570   2.138
  746   1HD1  ILE  97          HD11      ILE  97   9.581   6.176   2.539
  747   2HD1  ILE  97          HD12      ILE  97  10.336   7.733   2.393
  748   3HD1  ILE  97          HD13      ILE  97  10.801   6.636   3.727
  749    H    ASN  98           H        ASN  98  15.790   6.840   0.882
  750    HA   ASN  98           HA       ASN  98  17.707   5.478   2.607
  751   1HB   ASN  98          HB2       ASN  98  19.331   7.035   1.396
  752   2HB   ASN  98          HB1       ASN  98  18.572   5.778   0.412
  753   1HD2  ASN  98          HD21      ASN  98  17.051   8.825   1.439
  754   2HD2  ASN  98          HD22      ASN  98  16.907   9.480  -0.120
  755    H    ASP  99           H        ASP  99  15.484   7.602   3.294
  756    HA   ASP  99           HA       ASP  99  17.170   9.258   5.036
  757   1HB   ASP  99          HB2       ASP  99  17.083  10.233   2.713
  758   2HB   ASP  99          HB1       ASP  99  15.404  10.593   3.034
  759    H    LEU 100           H        LEU 100  13.929   9.058   3.590
  760    HA   LEU 100           HA       LEU 100  12.621  10.301   5.813
  761   1HB   LEU 100          HB2       LEU 100  11.335   8.893   3.451
  762   2HB   LEU 100          HB1       LEU 100  10.673  10.099   4.519
  763    HG   LEU 100           HG       LEU 100  13.061  10.930   2.990
  764   1HD1  LEU 100          HD11      LEU 100  11.804   9.777   1.245
  765   2HD1  LEU 100          HD12      LEU 100  11.617  11.497   1.057
  766   3HD1  LEU 100          HD13      LEU 100  10.319  10.543   1.799
  767   1HD2  LEU 100          HD21      LEU 100  11.879  13.000   2.952
  768   2HD2  LEU 100          HD22      LEU 100  11.810  12.367   4.611
  769   3HD2  LEU 100          HD23      LEU 100  10.420  12.218   3.513
  770    H    THR 101           H        THR 101  13.965   7.565   5.758
  771    HA   THR 101           HA       THR 101  12.173   5.505   6.389
  772    HB   THR 101           HB       THR 101  15.103   5.863   6.984
  773    HG1  THR 101           HG1      THR 101  13.805   4.866   4.693
  774   1HG2  THR 101          HG21      THR 101  13.509   3.370   6.305
  775   2HG2  THR 101          HG22      THR 101  14.070   3.779   7.923
  776   3HG2  THR 101          HG23      THR 101  15.236   3.439   6.637
  777    H    PHE 102           H        PHE 102  13.484   8.153   8.142
  778    HA   PHE 102           HA       PHE 102  13.190   6.846  10.746
  779   1HB   PHE 102          HB2       PHE 102  14.399   9.521  10.022
  780   2HB   PHE 102          HB1       PHE 102  14.331   8.854  11.649
  781    HD1  PHE 102           HD1      PHE 102  15.697   6.892  12.228
  782    HD2  PHE 102           HD2      PHE 102  16.009   8.792   8.437
  783    HE1  PHE 102           HE1      PHE 102  17.839   5.757  11.838
  784    HE2  PHE 102           HE2      PHE 102  18.148   7.662   8.037
  785    HZ   PHE 102           HZ       PHE 102  19.069   6.140   9.734
  Start of MODEL    2
    1    HA   MET   1           HA       MET   1 -24.878  20.695  -3.559
    2   1HB   MET   1          HB2       MET   1 -23.140  20.790  -6.059
    3   2HB   MET   1          HB1       MET   1 -24.806  20.256  -6.014
    4   1HG   MET   1          HG2       MET   1 -25.534  22.478  -5.390
    5   2HG   MET   1          HG1       MET   1 -23.865  23.031  -5.332
    6   1HE   MET   1          HE1       MET   1 -26.107  24.525  -7.000
    7   2HE   MET   1          HE2       MET   1 -25.241  24.863  -8.498
    8   3HE   MET   1          HE3       MET   1 -24.423  25.050  -6.947
    9    H    ALA   2           H        ALA   2 -25.271  18.498  -4.720
   10    HA   ALA   2           HA       ALA   2 -23.529  16.582  -3.441
   11   1HB   ALA   2          HB1       ALA   2 -25.993  16.203  -5.147
   12   2HB   ALA   2          HB2       ALA   2 -25.950  16.239  -3.385
   13   3HB   ALA   2          HB3       ALA   2 -25.163  14.926  -4.262
   14    H    HIS   3           H        HIS   3 -22.510  14.845  -4.646
   15    HA   HIS   3           HA       HIS   3 -21.733  15.792  -7.292
   16   1HB   HIS   3          HB2       HIS   3 -19.757  14.302  -7.157
   17   2HB   HIS   3          HB1       HIS   3 -19.812  15.427  -5.816
   18    HD1  HIS   3           HD1      HIS   3 -19.238  11.939  -6.550
   19    HD2  HIS   3           HD2      HIS   3 -20.814  14.100  -3.372
   20    HE1  HIS   3           HE1      HIS   3 -19.104  10.426  -4.544
   21    H    HIS   4           H        HIS   4 -21.516  14.318  -9.051
   22    HA   HIS   4           HA       HIS   4 -23.704  12.401  -8.963
   23   1HB   HIS   4          HB2       HIS   4 -22.347  13.731 -11.325
   24   2HB   HIS   4          HB1       HIS   4 -23.659  12.561 -11.449
   25    HD1  HIS   4           HD1      HIS   4 -23.123  16.158 -11.303
   26    HD2  HIS   4           HD2      HIS   4 -26.052  13.508  -9.992
   27    HE1  HIS   4           HE1      HIS   4 -25.153  17.539 -10.823
   28    H    HIS   5           H        HIS   5 -23.118  10.466  -8.543
   29    HA   HIS   5           HA       HIS   5 -20.450   9.591  -9.340
   30   1HB   HIS   5          HB2       HIS   5 -20.952   9.657  -6.901
   31   2HB   HIS   5          HB1       HIS   5 -22.254   8.512  -7.162
   32    HD1  HIS   5           HD1      HIS   5 -21.519   6.261  -6.346
   33    HD2  HIS   5           HD2      HIS   5 -18.424   8.386  -8.108
   34    HE1  HIS   5           HE1      HIS   5 -19.482   4.791  -6.208
   35    H    HIS   6           H        HIS   6 -20.838   8.824 -11.347
   36    HA   HIS   6           HA       HIS   6 -22.941   6.820 -11.736
   37   1HB   HIS   6          HB2       HIS   6 -21.145   8.213 -13.756
   38   2HB   HIS   6          HB1       HIS   6 -22.441   7.092 -14.152
   39    HD1  HIS   6           HD1      HIS   6 -21.761  10.659 -13.584
   40    HD2  HIS   6           HD2      HIS   6 -25.068   8.141 -13.572
   41    HE1  HIS   6           HE1      HIS   6 -23.749  12.147 -13.732
   42    H    HIS   7           H        HIS   7 -22.226   4.791 -11.378
   43    HA   HIS   7           HA       HIS   7 -19.440   4.304 -12.043
   44   1HB   HIS   7          HB2       HIS   7 -19.088   2.967  -9.997
   45   2HB   HIS   7          HB1       HIS   7 -19.390   4.664  -9.678
   46    HD1  HIS   7           HD1      HIS   7 -20.281   1.438  -8.425
   47    HD2  HIS   7           HD2      HIS   7 -22.299   5.027  -8.944
   48    HE1  HIS   7           HE1      HIS   7 -22.265   1.333  -6.915
   49    H    HIS   8           H        HIS   8 -19.528   3.095 -13.681
   50    HA   HIS   8           HA       HIS   8 -21.124   0.640 -13.644
   51   1HB   HIS   8          HB2       HIS   8 -21.162   2.028 -15.716
   52   2HB   HIS   8          HB1       HIS   8 -19.419   1.848 -15.855
   53    HD1  HIS   8           HD1      HIS   8 -18.674  -0.061 -17.346
   54    HD2  HIS   8           HD2      HIS   8 -22.547  -0.561 -15.920
   55    HE1  HIS   8           HE1      HIS   8 -19.545  -2.145 -18.422
   56    H    ASN   9           H        ASN   9 -17.886   1.893 -13.636
   57    HA   ASN   9           HA       ASN   9 -16.719  -0.782 -13.428
   58   1HB   ASN   9          HB2       ASN   9 -15.374   1.943 -13.443
   59   2HB   ASN   9          HB1       ASN   9 -14.540   0.404 -13.436
   60   1HD2  ASN   9          HD21      ASN   9 -16.410  -0.785 -15.441
   61   2HD2  ASN   9          HD22      ASN   9 -15.978  -0.047 -16.923
   62    H    GLN  10           H        GLN  10 -14.954  -0.881 -11.601
   63    HA   GLN  10           HA       GLN  10 -16.270  -0.049  -9.158
   64   1HB   GLN  10          HB2       GLN  10 -13.671  -1.574  -9.510
   65   2HB   GLN  10          HB1       GLN  10 -14.581  -1.388  -8.022
   66   1HG   GLN  10          HG2       GLN  10 -15.393  -2.949 -10.459
   67   2HG   GLN  10          HG1       GLN  10 -14.913  -3.597  -8.892
   68   1HE2  GLN  10          HE21      GLN  10 -17.312  -3.999 -10.389
   69   2HE2  GLN  10          HE22      GLN  10 -18.629  -3.515  -9.403
   70    H    GLN  11           H        GLN  11 -15.802   2.001  -8.463
   71    HA   GLN  11           HA       GLN  11 -13.506   3.300  -9.549
   72   1HB   GLN  11          HB2       GLN  11 -15.534   4.621  -9.183
   73   2HB   GLN  11          HB1       GLN  11 -15.452   4.298  -7.453
   74   1HG   GLN  11          HG2       GLN  11 -13.340   5.507  -7.301
   75   2HG   GLN  11          HG1       GLN  11 -13.359   5.789  -9.034
   76   1HE2  GLN  11          HE21      GLN  11 -16.213   6.394  -9.115
   77   2HE2  GLN  11          HE22      GLN  11 -16.398   7.927  -8.384
   78    H    ASN  12           H        ASN  12 -11.603   2.942  -8.867
   79    HA   ASN  12           HA       ASN  12 -11.205   2.022  -6.174
   80   1HB   ASN  12          HB2       ASN  12  -8.918   1.536  -6.790
   81   2HB   ASN  12          HB1       ASN  12  -9.915   1.039  -8.144
   82   1HD2  ASN  12          HD21      ASN  12  -9.804   2.293 -10.103
   83   2HD2  ASN  12          HD22      ASN  12  -8.492   3.369 -10.365
   84    H    LYS  13           H        LYS  13 -10.607   3.250  -4.552
   85    HA   LYS  13           HA       LYS  13 -10.848   6.047  -4.768
   86   1HB   LYS  13          HB2       LYS  13  -9.826   4.356  -2.490
   87   2HB   LYS  13          HB1       LYS  13 -10.199   6.071  -2.367
   88   1HG   LYS  13          HG2       LYS  13 -12.521   5.648  -2.864
   89   2HG   LYS  13          HG1       LYS  13 -12.179   3.939  -3.136
   90   1HD   LYS  13          HD2       LYS  13 -11.504   3.707  -0.792
   91   2HD   LYS  13          HD1       LYS  13 -11.836   5.419  -0.526
   92   1HE   LYS  13          HE2       LYS  13 -14.172   5.093  -1.022
   93   2HE   LYS  13          HE1       LYS  13 -13.887   3.412  -1.464
   94   1HZ   LYS  13          HZ1       LYS  13 -13.490   4.548   1.254
   95   2HZ   LYS  13          HZ2       LYS  13 -13.310   2.922   0.810
   96   3HZ   LYS  13          HZ3       LYS  13 -14.814   3.651   0.746
   97    H    LYS  14           H        LYS  14  -8.110   3.907  -4.643
   98    HA   LYS  14           HA       LYS  14  -5.969   4.116  -5.107
   99   1HB   LYS  14          HB2       LYS  14  -6.733   5.493  -7.068
  100   2HB   LYS  14          HB1       LYS  14  -6.640   6.934  -6.079
  101   1HG   LYS  14          HG2       LYS  14  -4.191   5.266  -6.543
  102   2HG   LYS  14          HG1       LYS  14  -4.759   6.370  -7.789
  103   1HD   LYS  14          HD2       LYS  14  -4.475   8.240  -6.391
  104   2HD   LYS  14          HD1       LYS  14  -4.282   7.228  -4.960
  105   1HE   LYS  14          HE2       LYS  14  -2.144   8.141  -5.667
  106   2HE   LYS  14          HE1       LYS  14  -2.169   6.395  -5.836
  107   1HZ   LYS  14          HZ1       LYS  14  -2.765   8.117  -8.167
  108   2HZ   LYS  14          HZ2       LYS  14  -1.997   6.553  -8.130
  109   3HZ   LYS  14          HZ3       LYS  14  -1.226   7.906  -7.585
  110    H    VAL  15           H        VAL  15  -4.012   4.905  -4.217
  111    HA   VAL  15           HA       VAL  15  -4.217   5.450  -1.518
  112    HB   VAL  15           HB       VAL  15  -2.143   4.714  -3.237
  113   1HG1  VAL  15          HG11      VAL  15  -1.369   7.278  -1.909
  114   2HG1  VAL  15          HG12      VAL  15  -1.436   6.977  -3.643
  115   3HG1  VAL  15          HG13      VAL  15  -0.221   6.153  -2.643
  116   1HG2  VAL  15          HG21      VAL  15  -2.014   5.343  -0.315
  117   2HG2  VAL  15          HG22      VAL  15  -0.843   4.347  -1.185
  118   3HG2  VAL  15          HG23      VAL  15  -2.526   3.818  -1.031
  119    H    GLU  16           H        GLU  16  -4.815   7.231  -0.526
  120    HA   GLU  16           HA       GLU  16  -3.935   9.794  -1.650
  121   1HB   GLU  16          HB2       GLU  16  -6.012  10.797  -0.747
  122   2HB   GLU  16          HB1       GLU  16  -6.309   9.598  -2.002
  123   1HG   GLU  16          HG2       GLU  16  -6.800   7.958  -0.314
  124   2HG   GLU  16          HG1       GLU  16  -6.509   9.125   0.948
  125    H    GLY  17           H        GLY  17  -4.926   8.117   1.276
  126   1HA   GLY  17          HA2       GLY  17  -2.704   9.107   2.691
  127   2HA   GLY  17          HA1       GLY  17  -4.215   9.820   3.262
  128    H    GLY  18           H        GLY  18  -2.230   7.182   3.195
  129   1HA   GLY  18          HA2       GLY  18  -2.629   5.829   5.268
  130   2HA   GLY  18          HA1       GLY  18  -4.212   5.495   4.572
  131    H    TYR  19           H        TYR  19  -3.608   3.245   4.664
  132    HA   TYR  19           HA       TYR  19  -1.571   2.480   2.687
  133   1HB   TYR  19          HB2       TYR  19  -2.639   0.814   4.947
  134   2HB   TYR  19          HB1       TYR  19  -1.181   0.536   3.995
  135    HD1  TYR  19           HD1      TYR  19  -2.261   1.511   7.108
  136    HD2  TYR  19           HD2      TYR  19   0.440   2.755   4.069
  137    HE1  TYR  19           HE1      TYR  19  -1.052   2.804   8.748
  138    HE2  TYR  19           HE2      TYR  19   1.697   4.072   5.716
  139    HH   TYR  19           HH       TYR  19   1.187   3.814   9.074
  140    H    GLU  20           H        GLU  20  -2.338   1.848   0.905
  141    HA   GLU  20           HA       GLU  20  -5.012   0.691   0.703
  142   1HB   GLU  20          HB2       GLU  20  -4.482   2.568  -0.808
  143   2HB   GLU  20          HB1       GLU  20  -3.041   1.724  -1.356
  144   1HG   GLU  20          HG2       GLU  20  -4.596  -0.109  -2.156
  145   2HG   GLU  20          HG1       GLU  20  -5.907   1.021  -1.871
  146    H    CYS  21           H        CYS  21  -4.988  -1.444   0.736
  147    HA   CYS  21           HA       CYS  21  -2.691  -3.102   0.525
  148   1HB   CYS  21          HB2       CYS  21  -5.561  -3.848   0.099
  149   2HB   CYS  21          HB1       CYS  21  -4.232  -4.985   0.251
  150    H    LYS  22           H        LYS  22  -1.993  -4.413  -1.036
  151    HA   LYS  22           HA       LYS  22  -2.305  -3.796  -3.740
  152   1HB   LYS  22          HB2       LYS  22  -0.295  -4.815  -3.009
  153   2HB   LYS  22          HB1       LYS  22  -1.151  -6.166  -2.282
  154   1HG   LYS  22          HG2       LYS  22  -0.024  -6.833  -4.322
  155   2HG   LYS  22          HG1       LYS  22  -1.772  -6.974  -4.501
  156   1HD   LYS  22          HD2       LYS  22  -1.792  -4.800  -5.610
  157   2HD   LYS  22          HD1       LYS  22  -0.024  -4.755  -5.470
  158   1HE   LYS  22          HE2       LYS  22   0.109  -6.776  -6.825
  159   2HE   LYS  22          HE1       LYS  22  -1.650  -6.836  -6.902
  160   1HZ   LYS  22          HZ1       LYS  22  -1.567  -4.657  -8.096
  161   2HZ   LYS  22          HZ2       LYS  22  -0.866  -5.917  -8.914
  162   3HZ   LYS  22          HZ3       LYS  22   0.122  -4.786  -8.145
  163    H    TYR  23           H        TYR  23  -3.927  -6.042  -1.630
  164    HA   TYR  23           HA       TYR  23  -5.217  -7.281  -3.925
  165   1HB   TYR  23          HB2       TYR  23  -5.641  -8.945  -1.698
  166   2HB   TYR  23          HB1       TYR  23  -4.568  -9.230  -3.060
  167    HD1  TYR  23           HD1      TYR  23  -2.135  -8.714  -2.874
  168    HD2  TYR  23           HD2      TYR  23  -4.771  -8.264   0.447
  169    HE1  TYR  23           HE1      TYR  23  -0.206  -8.612  -1.357
  170    HE2  TYR  23           HE2      TYR  23  -2.832  -8.153   1.962
  171    HH   TYR  23           HH       TYR  23  -0.446  -8.945   1.956
  172    H    CYS  24           H        CYS  24  -5.978  -4.881  -1.967
  173    HA   CYS  24           HA       CYS  24  -8.719  -5.298  -2.474
  174   1HB   CYS  24          HB2       CYS  24  -9.583  -5.133  -0.216
  175   2HB   CYS  24          HB1       CYS  24  -8.426  -6.459  -0.271
  176    H    THR  25           H        THR  25  -9.769  -3.317  -2.554
  177    HA   THR  25           HA       THR  25  -7.967  -1.058  -2.558
  178    HB   THR  25           HB       THR  25 -10.884  -1.182  -3.423
  179    HG1  THR  25           HG1      THR  25  -8.679  -2.371  -4.392
  180   1HG2  THR  25          HG21      THR  25  -8.583   0.612  -4.279
  181   2HG2  THR  25          HG22      THR  25  -9.911   1.099  -3.223
  182   3HG2  THR  25          HG23      THR  25 -10.231   0.674  -4.907
  183    H    PHE  26           H        PHE  26  -8.978  -2.359  -0.075
  184    HA   PHE  26           HA       PHE  26 -10.517  -0.249   1.195
  185   1HB   PHE  26          HB2       PHE  26 -11.005  -2.664   1.719
  186   2HB   PHE  26          HB1       PHE  26  -9.380  -2.814   2.363
  187    HD1  PHE  26           HD1      PHE  26  -8.802  -1.832   4.521
  188    HD2  PHE  26           HD2      PHE  26 -12.735  -1.471   2.938
  189    HE1  PHE  26           HE1      PHE  26  -9.623  -1.144   6.734
  190    HE2  PHE  26           HE2      PHE  26 -13.559  -0.782   5.150
  191    HZ   PHE  26           HZ       PHE  26 -12.005  -0.619   7.050
  192    H    GLN  27           H        GLN  27  -9.376   1.446   1.744
  193    HA   GLN  27           HA       GLN  27  -6.619   1.055   2.582
  194   1HB   GLN  27          HB2       GLN  27  -6.484   2.467   0.727
  195   2HB   GLN  27          HB1       GLN  27  -7.942   3.357   1.177
  196   1HG   GLN  27          HG2       GLN  27  -6.765   4.506   2.922
  197   2HG   GLN  27          HG1       GLN  27  -5.390   3.424   2.728
  198   1HE2  GLN  27          HE21      GLN  27  -3.904   3.921   1.406
  199   2HE2  GLN  27          HE22      GLN  27  -3.832   5.257   0.322
  200    H    THR  28           H        THR  28  -5.951   1.756   4.462
  201    HA   THR  28           HA       THR  28  -7.560   3.575   5.981
  202    HB   THR  28           HB       THR  28  -8.403   1.417   6.776
  203    HG1  THR  28           HG1      THR  28  -8.316   2.755   8.447
  204   1HG2  THR  28          HG21      THR  28  -6.938  -0.258   7.826
  205   2HG2  THR  28          HG22      THR  28  -5.538   0.726   7.480
  206   3HG2  THR  28          HG23      THR  28  -6.452   0.008   6.151
  207    HA   PRO  29           HA       PRO  29  -3.346   4.908   6.825
  208   1HB   PRO  29          HB2       PRO  29  -3.993   6.953   8.492
  209   2HB   PRO  29          HB1       PRO  29  -4.143   7.074   6.733
  210   1HG   PRO  29          HG2       PRO  29  -6.250   6.512   8.780
  211   2HG   PRO  29          HG1       PRO  29  -6.329   7.564   7.353
  212   1HD   PRO  29          HD2       PRO  29  -7.404   5.071   7.376
  213   2HD   PRO  29          HD1       PRO  29  -6.684   5.779   5.906
  214    H    ASP  30           H        ASP  30  -5.417   3.311   8.825
  215    HA   ASP  30           HA       ASP  30  -3.779   3.569  11.245
  216   1HB   ASP  30          HB2       ASP  30  -6.488   3.007  10.874
  217   2HB   ASP  30          HB1       ASP  30  -5.732   1.462  10.946
  218    H    LEU  31           H        LEU  31  -1.940   2.368  11.146
  219    HA   LEU  31           HA       LEU  31  -1.508   0.284   9.388
  220   1HB   LEU  31          HB2       LEU  31   0.044   1.711  10.934
  221   2HB   LEU  31          HB1       LEU  31  -0.166   0.388  12.058
  222    HG   LEU  31           HG       LEU  31   1.909   0.029  10.914
  223   1HD1  LEU  31          HD11      LEU  31   0.659  -2.015  11.227
  224   2HD1  LEU  31          HD12      LEU  31   1.531  -2.078   9.673
  225   3HD1  LEU  31          HD13      LEU  31  -0.199  -1.691   9.727
  226   1HD2  LEU  31          HD21      LEU  31   0.364   0.323   8.380
  227   2HD2  LEU  31          HD22      LEU  31   2.098  -0.045   8.491
  228   3HD2  LEU  31          HD23      LEU  31   1.460   1.511   9.064
  229    H    ASN  32           H        ASN  32  -2.732   0.338  12.745
  230    HA   ASN  32           HA       ASN  32  -2.622  -2.388  13.245
  231   1HB   ASN  32          HB2       ASN  32  -3.088  -0.378  14.816
  232   2HB   ASN  32          HB1       ASN  32  -4.739  -0.554  14.205
  233   1HD2  ASN  32          HD21      ASN  32  -4.570  -3.519  14.123
  234   2HD2  ASN  32          HD22      ASN  32  -4.653  -3.976  15.773
  235    H    MET  33           H        MET  33  -5.139  -0.299  11.911
  236    HA   MET  33           HA       MET  33  -7.033  -2.440  11.574
  237   1HB   MET  33          HB2       MET  33  -7.016   0.214  10.122
  238   2HB   MET  33          HB1       MET  33  -8.341  -0.920  10.183
  239   1HG   MET  33          HG2       MET  33  -7.148   0.497  12.497
  240   2HG   MET  33          HG1       MET  33  -8.638   0.975  11.683
  241   1HE   MET  33          HE1       MET  33 -10.884  -0.518  11.704
  242   2HE   MET  33          HE2       MET  33 -11.019  -2.071  12.524
  243   3HE   MET  33          HE3       MET  33  -9.986  -1.915  11.106
  244    H    PHE  34           H        PHE  34  -4.631  -0.909   9.607
  245    HA   PHE  34           HA       PHE  34  -5.217  -2.123   7.162
  246   1HB   PHE  34          HB2       PHE  34  -3.598  -0.337   7.229
  247   2HB   PHE  34          HB1       PHE  34  -2.570  -1.233   8.317
  248    HD1  PHE  34           HD1      PHE  34  -4.014  -1.435   4.876
  249    HD2  PHE  34           HD2      PHE  34  -0.804  -2.432   7.481
  250    HE1  PHE  34           HE1      PHE  34  -2.748  -2.325   2.963
  251    HE2  PHE  34           HE2      PHE  34   0.476  -3.326   5.567
  252    HZ   PHE  34           HZ       PHE  34  -0.501  -3.273   3.307
  253    H    THR  35           H        THR  35  -2.934  -3.224   9.609
  254    HA   THR  35           HA       THR  35  -2.547  -5.667   8.170
  255    HB   THR  35           HB       THR  35  -0.651  -4.841   9.426
  256    HG1  THR  35           HG1      THR  35  -1.570  -7.216  10.689
  257   1HG2  THR  35          HG21      THR  35  -2.346  -5.225  11.884
  258   2HG2  THR  35          HG22      THR  35  -1.761  -3.695  11.226
  259   3HG2  THR  35          HG23      THR  35  -0.617  -4.857  11.907
  260    H    PHE  36           H        PHE  36  -4.680  -4.679  10.681
  261    HA   PHE  36           HA       PHE  36  -5.470  -7.246  11.536
  262   1HB   PHE  36          HB2       PHE  36  -6.067  -5.487  12.963
  263   2HB   PHE  36          HB1       PHE  36  -6.804  -4.545  11.683
  264    HD1  PHE  36           HD1      PHE  36  -9.093  -4.447  11.768
  265    HD2  PHE  36           HD2      PHE  36  -7.182  -7.964  13.187
  266    HE1  PHE  36           HE1      PHE  36 -11.293  -5.386  12.377
  267    HE2  PHE  36           HE2      PHE  36  -9.365  -8.911  13.815
  268    HZ   PHE  36           HZ       PHE  36 -11.427  -7.625  13.404
  269    H    HIS  37           H        HIS  37  -6.929  -5.024   9.157
  270    HA   HIS  37           HA       HIS  37  -8.893  -6.923   8.499
  271   1HB   HIS  37          HB2       HIS  37  -9.744  -5.425   6.921
  272   2HB   HIS  37          HB1       HIS  37  -8.917  -4.357   8.047
  273    HD1  HIS  37           HD1      HIS  37  -7.007  -2.948   7.090
  274    HD2  HIS  37           HD2      HIS  37  -8.551  -5.719   4.422
  275    HE1  HIS  37           HE1      HIS  37  -6.045  -2.338   4.830
  276    H    VAL  38           H        VAL  38  -5.660  -6.428   7.452
  277    HA   VAL  38           HA       VAL  38  -5.751  -8.054   5.155
  278    HB   VAL  38           HB       VAL  38  -3.487  -7.354   7.019
  279   1HG1  VAL  38          HG11      VAL  38  -3.326  -8.925   4.424
  280   2HG1  VAL  38          HG12      VAL  38  -3.009  -9.559   6.041
  281   3HG1  VAL  38          HG13      VAL  38  -1.932  -8.343   5.345
  282   1HG2  VAL  38          HG21      VAL  38  -4.273  -5.543   5.616
  283   2HG2  VAL  38          HG22      VAL  38  -4.087  -6.541   4.177
  284   3HG2  VAL  38          HG23      VAL  38  -2.665  -6.043   5.099
  285    H    ASP  39           H        ASP  39  -4.745  -8.805   8.479
  286    HA   ASP  39           HA       ASP  39  -4.384 -11.571   8.055
  287   1HB   ASP  39          HB2       ASP  39  -3.533 -10.285  10.025
  288   2HB   ASP  39          HB1       ASP  39  -5.178 -10.189  10.634
  289    H    SER  40           H        SER  40  -7.152  -9.688   8.639
  290    HA   SER  40           HA       SER  40  -8.901 -11.825   9.408
  291   1HB   SER  40          HB2       SER  40  -9.230  -9.533  10.228
  292   2HB   SER  40          HB1       SER  40  -9.482  -8.978   8.587
  293    HG   SER  40           HG       SER  40 -11.102 -11.046   9.554
  294    H    GLU  41           H        GLU  41  -8.385  -9.923   6.440
  295    HA   GLU  41           HA       GLU  41 -10.471 -11.580   5.164
  296   1HB   GLU  41          HB2       GLU  41  -9.268  -9.018   4.143
  297   2HB   GLU  41          HB1       GLU  41 -10.628  -9.879   3.444
  298   1HG   GLU  41          HG2       GLU  41 -11.937  -9.459   5.435
  299   2HG   GLU  41          HG1       GLU  41 -10.564  -8.623   6.166
  300    H    HIS  42           H        HIS  42  -7.086 -10.636   4.760
  301    HA   HIS  42           HA       HIS  42  -6.776 -12.664   2.758
  302   1HB   HIS  42          HB2       HIS  42  -5.143 -10.724   1.822
  303   2HB   HIS  42          HB1       HIS  42  -6.741 -11.072   1.136
  304    HD1  HIS  42           HD1      HIS  42  -8.639  -9.307   1.880
  305    HD2  HIS  42           HD2      HIS  42  -4.760  -8.202   2.892
  306    HE1  HIS  42           HE1      HIS  42  -8.766  -6.886   2.468
  307    HA   PRO  43           HA       PRO  43  -3.514 -12.444   6.123
  308   1HB   PRO  43          HB2       PRO  43  -3.706 -15.069   6.895
  309   2HB   PRO  43          HB1       PRO  43  -4.639 -13.767   7.639
  310   1HG   PRO  43          HG2       PRO  43  -5.465 -15.739   5.549
  311   2HG   PRO  43          HG1       PRO  43  -6.385 -15.134   6.941
  312   1HD   PRO  43          HD2       PRO  43  -6.774 -14.214   4.413
  313   2HD   PRO  43          HD1       PRO  43  -6.982 -13.197   5.853
  314    H    ASN  44           H        ASN  44  -4.373 -15.016   3.922
  315    HA   ASN  44           HA       ASN  44  -1.598 -15.279   3.055
  316   1HB   ASN  44          HB2       ASN  44  -2.196 -17.321   4.248
  317   2HB   ASN  44          HB1       ASN  44  -3.689 -17.455   3.329
  318   1HD2  ASN  44          HD21      ASN  44  -0.196 -17.753   3.177
  319   2HD2  ASN  44          HD22      ASN  44  -0.179 -18.689   1.726
  320    H    VAL  45           H        VAL  45  -1.446 -14.499   1.133
  321    HA   VAL  45           HA       VAL  45  -3.563 -15.002  -0.754
  322    HB   VAL  45           HB       VAL  45  -4.136 -12.817   0.132
  323   1HG1  VAL  45          HG11      VAL  45  -2.048 -12.179   1.109
  324   2HG1  VAL  45          HG12      VAL  45  -2.641 -10.902   0.052
  325   3HG1  VAL  45          HG13      VAL  45  -1.330 -11.956  -0.487
  326   1HG2  VAL  45          HG21      VAL  45  -2.828 -12.531  -2.571
  327   2HG2  VAL  45          HG22      VAL  45  -4.013 -11.419  -1.885
  328   3HG2  VAL  45          HG23      VAL  45  -4.476 -13.080  -2.256
  329    H    VAL  46           H        VAL  46  -2.743 -15.682  -2.613
  330    HA   VAL  46           HA       VAL  46   0.118 -15.649  -2.927
  331    HB   VAL  46           HB       VAL  46  -1.967 -16.796  -4.812
  332   1HG1  VAL  46          HG11      VAL  46   0.186 -16.410  -5.882
  333   2HG1  VAL  46          HG12      VAL  46  -0.084 -18.142  -5.672
  334   3HG1  VAL  46          HG13      VAL  46   1.007 -17.284  -4.589
  335   1HG2  VAL  46          HG21      VAL  46  -2.117 -17.842  -2.603
  336   2HG2  VAL  46          HG22      VAL  46  -0.388 -18.187  -2.640
  337   3HG2  VAL  46          HG23      VAL  46  -1.470 -18.966  -3.796
  338    H    LEU  47           H        LEU  47   1.224 -14.376  -4.277
  339    HA   LEU  47           HA       LEU  47  -0.220 -12.682  -6.151
  340   1HB   LEU  47          HB2       LEU  47  -0.149 -11.557  -3.951
  341   2HB   LEU  47          HB1       LEU  47   1.590 -11.707  -3.951
  342    HG   LEU  47           HG       LEU  47   1.605 -10.247  -6.004
  343   1HD1  LEU  47          HD11      LEU  47  -0.721 -10.606  -6.667
  344   2HD1  LEU  47          HD12      LEU  47  -0.372  -8.896  -6.428
  345   3HD1  LEU  47          HD13      LEU  47  -1.264  -9.793  -5.199
  346   1HD2  LEU  47          HD21      LEU  47   2.118  -9.459  -3.725
  347   2HD2  LEU  47          HD22      LEU  47   0.415  -9.043  -3.509
  348   3HD2  LEU  47          HD23      LEU  47   1.384  -8.223  -4.737
  349    H    ASN  48           H        ASN  48   1.179 -11.938  -7.807
  350    HA   ASN  48           HA       ASN  48   3.579 -13.493  -8.180
  351   1HB   ASN  48          HB2       ASN  48   2.200 -13.103 -10.138
  352   2HB   ASN  48          HB1       ASN  48   2.277 -11.367  -9.898
  353   1HD2  ASN  48          HD21      ASN  48   5.088 -13.586  -9.674
  354   2HD2  ASN  48          HD22      ASN  48   5.861 -12.946 -11.065
  355    H    SER  49           H        SER  49   3.048  -9.956  -8.473
  356    HA   SER  49           HA       SER  49   5.373  -9.448  -6.873
  357   1HB   SER  49          HB2       SER  49   5.246  -8.628  -9.795
  358   2HB   SER  49          HB1       SER  49   6.487  -8.127  -8.647
  359    HG   SER  49           HG       SER  49   6.218 -10.788  -8.601
  360    H    SER  50           H        SER  50   5.511  -7.148  -6.310
  361    HA   SER  50           HA       SER  50   3.759  -5.187  -7.183
  362   1HB   SER  50          HB2       SER  50   2.120  -6.634  -5.918
  363   2HB   SER  50          HB1       SER  50   3.091  -6.358  -4.470
  364    HG   SER  50           HG       SER  50   1.946  -4.551  -4.279
  365    H    TYR  51           H        TYR  51   3.842  -3.411  -5.357
  366    HA   TYR  51           HA       TYR  51   6.609  -3.344  -4.381
  367   1HB   TYR  51          HB2       TYR  51   4.864  -1.237  -5.564
  368   2HB   TYR  51          HB1       TYR  51   6.149  -0.809  -4.453
  369    HD1  TYR  51           HD1      TYR  51   7.172   0.589  -6.097
  370    HD2  TYR  51           HD2      TYR  51   6.629  -3.554  -6.852
  371    HE1  TYR  51           HE1      TYR  51   8.733   0.734  -8.020
  372    HE2  TYR  51           HE2      TYR  51   8.166  -3.430  -8.753
  373    HH   TYR  51           HH       TYR  51  10.182  -0.775  -9.330
  374    H    VAL  52           H        VAL  52   6.948  -2.637  -2.387
  375    HA   VAL  52           HA       VAL  52   4.646  -1.859  -0.748
  376    HB   VAL  52           HB       VAL  52   5.144  -4.249  -0.371
  377   1HG1  VAL  52          HG11      VAL  52   7.220  -4.940   0.631
  378   2HG1  VAL  52          HG12      VAL  52   7.827  -3.294   0.491
  379   3HG1  VAL  52          HG13      VAL  52   7.462  -4.235  -0.965
  380   1HG2  VAL  52          HG21      VAL  52   5.534  -4.251   2.046
  381   2HG2  VAL  52          HG22      VAL  52   4.338  -3.067   1.538
  382   3HG2  VAL  52          HG23      VAL  52   5.974  -2.543   1.958
  383    H    CYS  53           H        CYS  53   5.103  -0.255   0.672
  384    HA   CYS  53           HA       CYS  53   7.718   1.031   0.559
  385   1HB   CYS  53          HB2       CYS  53   5.774   2.426   0.678
  386   2HB   CYS  53          HB1       CYS  53   5.169   1.601   2.101
  387    H    VAL  54           H        VAL  54   9.197  -0.239   1.545
  388    HA   VAL  54           HA       VAL  54   8.857  -2.074   3.578
  389    HB   VAL  54           HB       VAL  54  11.346  -0.647   3.864
  390   1HG1  VAL  54          HG11      VAL  54  10.963  -2.951   4.494
  391   2HG1  VAL  54          HG12      VAL  54  12.287  -2.736   3.310
  392   3HG1  VAL  54          HG13      VAL  54  10.697  -3.277   2.764
  393   1HG2  VAL  54          HG21      VAL  54  10.480  -1.357   1.101
  394   2HG2  VAL  54          HG22      VAL  54  12.169  -1.306   1.585
  395   3HG2  VAL  54          HG23      VAL  54  11.169   0.139   1.702
  396    H    GLU  55           H        GLU  55   9.295   1.315   3.685
  397    HA   GLU  55           HA       GLU  55  10.043   1.698   6.315
  398   1HB   GLU  55          HB2       GLU  55   8.304   3.561   4.707
  399   2HB   GLU  55          HB1       GLU  55   9.422   3.984   5.990
  400   1HG   GLU  55          HG2       GLU  55  10.256   2.844   3.319
  401   2HG   GLU  55          HG1       GLU  55  10.210   4.546   3.697
  402    H    CYS  56           H        CYS  56   6.953   1.541   4.734
  403    HA   CYS  56           HA       CYS  56   5.486   1.908   7.292
  404   1HB   CYS  56          HB2       CYS  56   4.378   1.719   4.510
  405   2HB   CYS  56          HB1       CYS  56   3.549   2.318   5.938
  406    H    ASN  57           H        ASN  57   6.536  -0.481   5.189
  407    HA   ASN  57           HA       ASN  57   5.976  -2.535   4.566
  408   1HB   ASN  57          HB2       ASN  57   5.220  -2.408   7.398
  409   2HB   ASN  57          HB1       ASN  57   4.905  -3.932   6.515
  410   1HD2  ASN  57          HD21      ASN  57   7.330  -3.530   4.884
  411   2HD2  ASN  57          HD22      ASN  57   8.604  -3.946   5.953
  412    H    PHE  58           H        PHE  58   4.447  -1.220   3.181
  413    HA   PHE  58           HA       PHE  58   1.816  -2.408   3.529
  414   1HB   PHE  58          HB2       PHE  58   0.611  -0.482   3.650
  415   2HB   PHE  58          HB1       PHE  58   2.115   0.239   4.176
  416    HD1  PHE  58           HD1      PHE  58   3.333   1.745   2.675
  417    HD2  PHE  58           HD2      PHE  58  -0.283  -0.078   1.484
  418    HE1  PHE  58           HE1      PHE  58   3.129   3.388   0.770
  419    HE2  PHE  58           HE2      PHE  58  -0.501   1.582  -0.383
  420    HZ   PHE  58           HZ       PHE  58   1.226   3.269  -0.723
  421    H    LEU  59           H        LEU  59   1.138  -3.337   1.801
  422    HA   LEU  59           HA       LEU  59   2.662  -3.026  -0.653
  423   1HB   LEU  59          HB2       LEU  59   1.005  -5.215   0.499
  424   2HB   LEU  59          HB1       LEU  59   1.016  -5.033  -1.244
  425    HG   LEU  59           HG       LEU  59   3.585  -5.331   0.276
  426   1HD1  LEU  59          HD11      LEU  59   1.830  -7.397  -1.014
  427   2HD1  LEU  59          HD12      LEU  59   2.042  -7.210   0.729
  428   3HD1  LEU  59          HD13      LEU  59   3.416  -7.690  -0.283
  429   1HD2  LEU  59          HD21      LEU  59   4.312  -6.076  -1.956
  430   2HD2  LEU  59          HD22      LEU  59   3.682  -4.434  -2.010
  431   3HD2  LEU  59          HD23      LEU  59   2.701  -5.767  -2.582
  432    H    THR  60           H        THR  60   1.639  -2.218  -2.436
  433    HA   THR  60           HA       THR  60  -1.147  -1.458  -2.001
  434    HB   THR  60           HB       THR  60  -0.135   0.540  -1.771
  435    HG1  THR  60           HG1      THR  60  -1.637   1.090  -3.339
  436   1HG2  THR  60          HG21      THR  60   1.773   1.397  -3.039
  437   2HG2  THR  60          HG22      THR  60   1.786  -0.075  -4.006
  438   3HG2  THR  60          HG23      THR  60   2.122  -0.145  -2.278
  439    H    LYS  61           H        LYS  61  -2.418  -1.066  -3.761
  440    HA   LYS  61           HA       LYS  61  -2.645  -3.120  -5.628
  441   1HB   LYS  61          HB2       LYS  61  -4.452  -1.726  -4.704
  442   2HB   LYS  61          HB1       LYS  61  -3.839  -0.355  -5.604
  443   1HG   LYS  61          HG2       LYS  61  -4.333  -1.533  -7.698
  444   2HG   LYS  61          HG1       LYS  61  -4.974  -2.883  -6.757
  445   1HD   LYS  61          HD2       LYS  61  -6.619  -1.322  -5.735
  446   2HD   LYS  61          HD1       LYS  61  -6.021  -0.055  -6.801
  447   1HE   LYS  61          HE2       LYS  61  -8.024  -1.016  -7.747
  448   2HE   LYS  61          HE1       LYS  61  -6.624  -1.435  -8.738
  449   1HZ   LYS  61          HZ1       LYS  61  -7.896  -3.223  -6.742
  450   2HZ   LYS  61          HZ2       LYS  61  -6.610  -3.641  -7.732
  451   3HZ   LYS  61          HZ3       LYS  61  -8.124  -3.315  -8.400
  452    H    ARG  62           H        ARG  62  -0.757  -0.292  -5.689
  453    HA   ARG  62           HA       ARG  62  -0.357  -0.480  -8.585
  454   1HB   ARG  62          HB2       ARG  62  -0.564   1.932  -8.716
  455   2HB   ARG  62          HB1       ARG  62  -2.037   1.206  -8.078
  456   1HG   ARG  62          HG2       ARG  62  -1.023   1.707  -5.764
  457   2HG   ARG  62          HG1       ARG  62   0.036   2.803  -6.647
  458   1HD   ARG  62          HD2       ARG  62  -1.787   4.087  -5.910
  459   2HD   ARG  62          HD1       ARG  62  -2.039   3.816  -7.632
  460    HE   ARG  62           HE       ARG  62  -3.390   2.360  -5.464
  461   1HH1  ARG  62          HH11      ARG  62  -3.345   3.470  -8.832
  462   2HH1  ARG  62          HH12      ARG  62  -5.005   3.272  -9.072
  463   1HH2  ARG  62          HH21      ARG  62  -5.627   2.115  -5.764
  464   2HH2  ARG  62          HH22      ARG  62  -6.376   2.506  -7.277
  465    H    TYR  63           H        TYR  63   1.527   1.078  -9.128
  466    HA   TYR  63           HA       TYR  63   3.686   0.583  -7.195
  467   1HB   TYR  63          HB2       TYR  63   5.230   0.889  -9.147
  468   2HB   TYR  63          HB1       TYR  63   4.101  -0.441  -9.353
  469    HD1  TYR  63           HD1      TYR  63   5.272   2.714 -10.667
  470    HD2  TYR  63           HD2      TYR  63   2.110  -0.124 -10.847
  471    HE1  TYR  63           HE1      TYR  63   4.513   3.694 -12.784
  472    HE2  TYR  63           HE2      TYR  63   1.348   0.843 -12.962
  473    HH   TYR  63           HH       TYR  63   1.489   3.036 -14.060
  474    H    ASP  64           H        ASP  64   1.869   3.057  -8.662
  475    HA   ASP  64           HA       ASP  64   3.732   5.209  -8.402
  476   1HB   ASP  64          HB2       ASP  64   1.690   6.579  -8.792
  477   2HB   ASP  64          HB1       ASP  64   2.073   5.417 -10.080
  478    H    ALA  65           H        ALA  65   1.488   3.746  -6.336
  479    HA   ALA  65           HA       ALA  65   1.012   5.818  -4.460
  480   1HB   ALA  65          HB1       ALA  65  -0.294   3.804  -4.394
  481   2HB   ALA  65          HB2       ALA  65   0.559   3.946  -2.852
  482   3HB   ALA  65          HB3       ALA  65   1.143   2.848  -4.104
  483    H    LEU  66           H        LEU  66   3.673   3.770  -4.993
  484    HA   LEU  66           HA       LEU  66   5.048   4.373  -2.527
  485   1HB   LEU  66          HB2       LEU  66   6.078   3.173  -5.047
  486   2HB   LEU  66          HB1       LEU  66   6.950   3.209  -3.528
  487    HG   LEU  66           HG       LEU  66   6.193   1.050  -3.656
  488   1HD1  LEU  66          HD11      LEU  66   4.480   0.759  -1.958
  489   2HD1  LEU  66          HD12      LEU  66   4.041   2.456  -2.139
  490   3HD1  LEU  66          HD13      LEU  66   5.638   2.024  -1.502
  491   1HD2  LEU  66          HD21      LEU  66   3.538   2.071  -4.598
  492   2HD2  LEU  66          HD22      LEU  66   3.946   0.372  -4.331
  493   3HD2  LEU  66          HD23      LEU  66   4.779   1.307  -5.581
  494    H    SER  67           H        SER  67   4.909   5.520  -5.732
  495    HA   SER  67           HA       SER  67   7.332   7.048  -5.747
  496   1HB   SER  67          HB2       SER  67   4.893   6.769  -7.333
  497   2HB   SER  67          HB1       SER  67   6.020   8.052  -7.779
  498    HG   SER  67           HG       SER  67   7.390   5.769  -7.497
  499    H    GLU  68           H        GLU  68   3.903   7.743  -5.501
  500    HA   GLU  68           HA       GLU  68   4.374  10.479  -4.925
  501   1HB   GLU  68          HB2       GLU  68   1.754   9.293  -4.169
  502   2HB   GLU  68          HB1       GLU  68   2.170  10.810  -4.919
  503   1HG   GLU  68          HG2       GLU  68   2.932   9.379  -6.938
  504   2HG   GLU  68          HG1       GLU  68   1.933   8.169  -6.217
  505    H    HIS  69           H        HIS  69   4.401   7.693  -3.161
  506    HA   HIS  69           HA       HIS  69   3.519   8.275  -0.623
  507   1HB   HIS  69          HB2       HIS  69   4.505   6.159  -1.599
  508   2HB   HIS  69          HB1       HIS  69   6.073   6.831  -1.052
  509    HD1  HIS  69           HD1      HIS  69   2.645   6.027   0.383
  510    HD2  HIS  69           HD2      HIS  69   6.655   5.975   1.321
  511    HE1  HIS  69           HE1      HIS  69   2.779   5.058   2.705
  512    H    ASN  70           H        ASN  70   6.941   8.820  -1.695
  513    HA   ASN  70           HA       ASN  70   7.568  10.358   0.672
  514   1HB   ASN  70          HB2       ASN  70   9.686  10.818  -0.492
  515   2HB   ASN  70          HB1       ASN  70   9.343   9.104  -0.400
  516   1HD2  ASN  70          HD21      ASN  70  11.116  10.131  -2.106
  517   2HD2  ASN  70          HD22      ASN  70  10.509   9.938  -3.752
  518    H    LEU  71           H        LEU  71   5.947  11.064  -2.100
  519    HA   LEU  71           HA       LEU  71   6.620  13.845  -2.192
  520   1HB   LEU  71          HB2       LEU  71   5.888  13.091  -4.257
  521   2HB   LEU  71          HB1       LEU  71   4.723  11.996  -3.562
  522    HG   LEU  71           HG       LEU  71   3.182  13.773  -3.211
  523   1HD1  LEU  71          HD11      LEU  71   5.279  15.566  -4.513
  524   2HD1  LEU  71          HD12      LEU  71   4.750  15.666  -2.834
  525   3HD1  LEU  71          HD13      LEU  71   3.629  16.067  -4.137
  526   1HD2  LEU  71          HD21      LEU  71   4.299  13.733  -6.000
  527   2HD2  LEU  71          HD22      LEU  71   2.701  14.332  -5.561
  528   3HD2  LEU  71          HD23      LEU  71   3.101  12.634  -5.314
  529    H    LYS  72           H        LYS  72   3.870  11.948  -1.063
  530    HA   LYS  72           HA       LYS  72   2.984  14.304   0.426
  531   1HB   LYS  72          HB2       LYS  72   0.794  12.697   0.393
  532   2HB   LYS  72          HB1       LYS  72   1.058  14.061  -0.716
  533   1HG   LYS  72          HG2       LYS  72   2.200  12.281  -2.166
  534   2HG   LYS  72          HG1       LYS  72   1.458  11.090  -1.150
  535   1HD   LYS  72          HD2       LYS  72   0.082  13.201  -2.802
  536   2HD   LYS  72          HD1       LYS  72   0.071  11.458  -3.070
  537   1HE   LYS  72          HE2       LYS  72  -1.205  11.126  -1.039
  538   2HE   LYS  72          HE1       LYS  72  -1.115  12.837  -0.665
  539   1HZ   LYS  72          HZ1       LYS  72  -3.268  12.312  -1.679
  540   2HZ   LYS  72          HZ2       LYS  72  -2.505  11.715  -3.061
  541   3HZ   LYS  72          HZ3       LYS  72  -2.383  13.325  -2.675
  542    H    TYR  73           H        TYR  73   3.473  10.928   0.777
  543    HA   TYR  73           HA       TYR  73   2.501  10.824   3.499
  544   1HB   TYR  73          HB2       TYR  73   3.888   8.826   1.755
  545   2HB   TYR  73          HB1       TYR  73   3.366   8.440   3.396
  546    HD1  TYR  73           HD1      TYR  73   1.510   7.065   3.367
  547    HD2  TYR  73           HD2      TYR  73   1.812  10.068   0.379
  548    HE1  TYR  73           HE1      TYR  73  -0.651   6.354   2.413
  549    HE2  TYR  73           HE2      TYR  73  -0.288   9.399  -0.544
  550    HH   TYR  73           HH       TYR  73  -2.414   7.364   1.111
  551    H    HIS  74           H        HIS  74   5.689  10.284   1.923
  552    HA   HIS  74           HA       HIS  74   6.968  11.069   4.511
  553   1HB   HIS  74          HB2       HIS  74   8.109   9.336   2.281
  554   2HB   HIS  74          HB1       HIS  74   9.023   9.857   3.683
  555    HD1  HIS  74           HD1      HIS  74   9.089   8.124   5.565
  556    HD2  HIS  74           HD2      HIS  74   5.988   7.552   2.884
  557    HE1  HIS  74           HE1      HIS  74   8.179   5.864   6.082
  558    HA   PRO  75           HA       PRO  75   7.907  14.289   1.244
  559   1HB   PRO  75          HB2       PRO  75   7.249  16.475   2.655
  560   2HB   PRO  75          HB1       PRO  75   6.030  15.493   1.823
  561   1HG   PRO  75          HG2       PRO  75   6.851  15.404   4.719
  562   2HG   PRO  75          HG1       PRO  75   5.211  15.439   4.033
  563   1HD   PRO  75          HD2       PRO  75   6.374  13.157   4.845
  564   2HD   PRO  75          HD1       PRO  75   5.279  13.241   3.452
  565    H    GLY  76           H        GLY  76   9.694  15.442   0.960
  566   1HA   GLY  76          HA2       GLY  76  11.235  16.934   2.563
  567   2HA   GLY  76          HA1       GLY  76  11.738  15.317   3.015
  568    H    GLU  77           H        GLU  77  11.483  14.152   0.394
  569    HA   GLU  77           HA       GLU  77  13.047  15.550  -1.539
  570   1HB   GLU  77          HB2       GLU  77  15.021  14.105  -1.462
  571   2HB   GLU  77          HB1       GLU  77  14.869  15.036   0.020
  572   1HG   GLU  77          HG2       GLU  77  14.034  13.108   1.193
  573   2HG   GLU  77          HG1       GLU  77  14.002  12.179  -0.306
  574    H    GLU  78           H        GLU  78  13.785  13.854  -3.260
  575    HA   GLU  78           HA       GLU  78  11.781  11.729  -3.333
  576   1HB   GLU  78          HB2       GLU  78  11.253  13.440  -5.007
  577   2HB   GLU  78          HB1       GLU  78  12.933  13.362  -5.555
  578   1HG   GLU  78          HG2       GLU  78  11.597  12.151  -7.196
  579   2HG   GLU  78          HG1       GLU  78  12.514  10.999  -6.219
  580    H    ASN  79           H        ASN  79  13.155  10.135  -2.558
  581    HA   ASN  79           HA       ASN  79  15.098   9.115  -4.430
  582   1HB   ASN  79          HB2       ASN  79  15.980   9.857  -1.609
  583   2HB   ASN  79          HB1       ASN  79  16.934   8.917  -2.743
  584   1HD2  ASN  79          HD21      ASN  79  15.668  11.959  -1.952
  585   2HD2  ASN  79          HD22      ASN  79  16.531  12.964  -3.046
  586    H    PHE  80           H        PHE  80  13.722   7.430  -4.525
  587    HA   PHE  80           HA       PHE  80  13.521   5.762  -2.139
  588   1HB   PHE  80          HB2       PHE  80  11.686   6.319  -4.363
  589   2HB   PHE  80          HB1       PHE  80  11.923   4.605  -4.047
  590    HD1  PHE  80           HD1      PHE  80  11.621   3.873  -1.581
  591    HD2  PHE  80           HD2      PHE  80  10.206   7.533  -3.198
  592    HE1  PHE  80           HE1      PHE  80   9.886   3.911   0.110
  593    HE2  PHE  80           HE2      PHE  80   8.438   7.585  -1.408
  594    HZ   PHE  80           HZ       PHE  80   8.291   5.773   0.200
  595    H    LYS  81           H        LYS  81  14.181   3.684  -2.219
  596    HA   LYS  81           HA       LYS  81  15.901   2.942  -4.488
  597   1HB   LYS  81          HB2       LYS  81  17.454   2.118  -2.971
  598   2HB   LYS  81          HB1       LYS  81  16.645   3.333  -1.968
  599   1HG   LYS  81          HG2       LYS  81  15.281   1.702  -0.934
  600   2HG   LYS  81          HG1       LYS  81  15.891   0.444  -2.003
  601   1HD   LYS  81          HD2       LYS  81  18.194   1.017  -1.043
  602   2HD   LYS  81          HD1       LYS  81  17.278   1.866   0.216
  603   1HE   LYS  81          HE2       LYS  81  15.971  -0.190   0.583
  604   2HE   LYS  81          HE1       LYS  81  17.011  -0.993  -0.584
  605   1HZ   LYS  81          HZ1       LYS  81  17.692  -1.395   1.765
  606   2HZ   LYS  81          HZ2       LYS  81  17.989   0.256   1.948
  607   3HZ   LYS  81          HZ3       LYS  81  18.901  -0.641   0.875
  608    H    LEU  82           H        LEU  82  16.034   0.412  -4.647
  609    HA   LEU  82           HA       LEU  82  13.405  -0.681  -4.089
  610   1HB   LEU  82          HB2       LEU  82  13.369  -1.811  -6.277
  611   2HB   LEU  82          HB1       LEU  82  13.319  -0.073  -6.428
  612    HG   LEU  82           HG       LEU  82  15.893  -1.584  -6.757
  613   1HD1  LEU  82          HD11      LEU  82  14.251  -2.565  -8.311
  614   2HD1  LEU  82          HD12      LEU  82  15.436  -1.603  -9.193
  615   3HD1  LEU  82          HD13      LEU  82  13.827  -0.953  -8.889
  616   1HD2  LEU  82          HD21      LEU  82  14.906   1.055  -7.867
  617   2HD2  LEU  82          HD22      LEU  82  16.490   0.340  -8.172
  618   3HD2  LEU  82          HD23      LEU  82  16.053   0.854  -6.540
  619    H    THR  83           H        THR  83  13.560  -2.450  -2.951
  620    HA   THR  83           HA       THR  83  15.867  -4.147  -3.336
  621    HB   THR  83           HB       THR  83  16.419  -2.883  -1.412
  622    HG1  THR  83           HG1      THR  83  17.022  -4.540  -0.430
  623   1HG2  THR  83          HG21      THR  83  14.188  -1.981  -0.868
  624   2HG2  THR  83          HG22      THR  83  15.008  -2.606   0.558
  625   3HG2  THR  83          HG23      THR  83  13.733  -3.556  -0.210
  626    H    MET  84           H        MET  84  14.981  -6.171  -3.896
  627    HA   MET  84           HA       MET  84  12.171  -6.530  -3.082
  628   1HB   MET  84          HB2       MET  84  12.738  -6.891  -5.451
  629   2HB   MET  84          HB1       MET  84  13.923  -8.088  -4.946
  630   1HG   MET  84          HG2       MET  84  12.133  -9.499  -4.085
  631   2HG   MET  84          HG1       MET  84  10.944  -8.311  -4.621
  632   1HE   MET  84          HE1       MET  84   9.692 -10.209  -5.957
  633   2HE   MET  84          HE2       MET  84  10.906 -11.407  -5.493
  634   3HE   MET  84          HE3       MET  84  10.458 -11.215  -7.186
  635    H    VAL  85           H        VAL  85  12.163  -7.233  -1.075
  636    HA   VAL  85           HA       VAL  85  13.106  -9.905  -0.663
  637    HB   VAL  85           HB       VAL  85  13.853  -9.061   1.755
  638   1HG1  VAL  85          HG11      VAL  85  16.176  -8.839   0.959
  639   2HG1  VAL  85          HG12      VAL  85  15.571  -8.712  -0.700
  640   3HG1  VAL  85          HG13      VAL  85  15.347 -10.204   0.209
  641   1HG2  VAL  85          HG21      VAL  85  14.402  -6.631   0.043
  642   2HG2  VAL  85          HG22      VAL  85  14.950  -6.867   1.706
  643   3HG2  VAL  85          HG23      VAL  85  13.226  -6.710   1.354
  644    H    LYS  86           H        LYS  86  11.027 -10.749  -0.266
  645    HA   LYS  86           HA       LYS  86   9.776  -9.488   2.034
  646   1HB   LYS  86          HB2       LYS  86   8.679  -8.780  -0.222
  647   2HB   LYS  86          HB1       LYS  86   8.036 -10.420  -0.231
  648   1HG   LYS  86          HG2       LYS  86   6.366  -8.983   0.599
  649   2HG   LYS  86          HG1       LYS  86   6.977  -9.946   1.938
  650   1HD   LYS  86          HD2       LYS  86   8.213  -8.178   2.853
  651   2HD   LYS  86          HD1       LYS  86   8.193  -7.284   1.350
  652   1HE   LYS  86          HE2       LYS  86   6.007  -6.442   1.715
  653   2HE   LYS  86          HE1       LYS  86   5.617  -7.701   2.879
  654   1HZ   LYS  86          HZ1       LYS  86   7.650  -5.575   3.221
  655   2HZ   LYS  86          HZ2       LYS  86   7.209  -6.732   4.375
  656   3HZ   LYS  86          HZ3       LYS  86   6.083  -5.575   3.922
  657    H    ARG  87           H        ARG  87   9.699 -10.936   3.521
  658    HA   ARG  87           HA       ARG  87   9.321 -13.687   2.654
  659   1HB   ARG  87          HB2       ARG  87  11.081 -12.711   4.930
  660   2HB   ARG  87          HB1       ARG  87  10.740 -14.400   4.586
  661   1HG   ARG  87          HG2       ARG  87  12.844 -14.088   3.607
  662   2HG   ARG  87          HG1       ARG  87  11.738 -13.911   2.251
  663   1HD   ARG  87          HD2       ARG  87  13.322 -12.165   2.018
  664   2HD   ARG  87          HD1       ARG  87  11.854 -11.408   2.622
  665    HE   ARG  87           HE       ARG  87  13.899 -12.198   4.541
  666   1HH1  ARG  87          HH11      ARG  87  12.269  -9.470   2.911
  667   2HH1  ARG  87          HH12      ARG  87  12.996  -8.299   3.883
  668   1HH2  ARG  87          HH21      ARG  87  14.907 -10.540   5.832
  669   2HH2  ARG  87          HH22      ARG  87  14.551  -8.905   5.579
  670    H    ASN  88           H        ASN  88   8.046 -14.997   3.902
  671    HA   ASN  88           HA       ASN  88   6.397 -15.642   5.252
  672   1HB   ASN  88          HB2       ASN  88   7.684 -14.603   7.167
  673   2HB   ASN  88          HB1       ASN  88   6.813 -13.100   6.890
  674   1HD2  ASN  88          HD21      ASN  88   5.913 -13.120   8.960
  675   2HD2  ASN  88          HD22      ASN  88   4.675 -14.206   9.430
  676    H    ASN  89           H        ASN  89   6.188 -13.872   2.964
  677    HA   ASN  89           HA       ASN  89   3.350 -13.243   3.236
  678   1HB   ASN  89          HB2       ASN  89   5.361 -11.225   2.171
  679   2HB   ASN  89          HB1       ASN  89   3.623 -11.075   2.002
  680   1HD2  ASN  89          HD21      ASN  89   6.358 -10.783   4.133
  681   2HD2  ASN  89          HD22      ASN  89   5.508 -10.022   5.404
  682    H    GLN  90           H        GLN  90   5.595 -12.261   0.696
  683    HA   GLN  90           HA       GLN  90   5.399 -14.460  -1.002
  684   1HB   GLN  90          HB2       GLN  90   4.149 -13.465  -2.820
  685   2HB   GLN  90          HB1       GLN  90   3.115 -13.404  -1.385
  686   1HG   GLN  90          HG2       GLN  90   4.741 -11.084  -2.273
  687   2HG   GLN  90          HG1       GLN  90   3.172 -11.394  -2.997
  688   1HE2  GLN  90          HE21      GLN  90   4.915 -10.216  -0.338
  689   2HE2  GLN  90          HE22      GLN  90   3.527  -9.693   0.582
  690    H    THR  91           H        THR  91   6.533 -13.579  -3.163
  691    HA   THR  91           HA       THR  91   8.561 -11.812  -2.124
  692    HB   THR  91           HB       THR  91   9.870 -12.554  -4.140
  693    HG1  THR  91           HG1      THR  91   9.044 -14.540  -5.070
  694   1HG2  THR  91          HG21      THR  91  10.378 -14.765  -3.249
  695   2HG2  THR  91          HG22      THR  91   8.840 -14.783  -2.401
  696   3HG2  THR  91          HG23      THR  91  10.085 -13.648  -1.910
  697    H    ILE  92           H        ILE  92   8.305  -9.791  -2.414
  698    HA   ILE  92           HA       ILE  92   7.455  -8.708  -4.895
  699    HB   ILE  92           HB       ILE  92   6.045  -6.998  -3.639
  700   1HG1  ILE  92          HG12      ILE  92   4.957  -8.156  -1.570
  701   2HG1  ILE  92          HG11      ILE  92   6.479  -9.006  -1.542
  702   1HG2  ILE  92          HG21      ILE  92   4.999  -8.561  -5.062
  703   2HG2  ILE  92          HG22      ILE  92   4.046  -8.456  -3.580
  704   3HG2  ILE  92          HG23      ILE  92   5.112  -9.838  -3.857
  705   1HD1  ILE  92          HD11      ILE  92   6.517  -7.013  -0.121
  706   2HD1  ILE  92          HD12      ILE  92   6.323  -6.015  -1.569
  707   3HD1  ILE  92          HD13      ILE  92   7.748  -7.021  -1.373
  708    H    PHE  93           H        PHE  93   7.897  -6.283  -5.010
  709    HA   PHE  93           HA       PHE  93  10.674  -6.019  -4.166
  710   1HB   PHE  93          HB2       PHE  93   8.892  -4.359  -5.948
  711   2HB   PHE  93          HB1       PHE  93  10.583  -4.023  -5.672
  712    HD1  PHE  93           HD1      PHE  93  12.243  -5.230  -6.809
  713    HD2  PHE  93           HD2      PHE  93   8.166  -6.297  -7.246
  714    HE1  PHE  93           HE1      PHE  93  12.827  -6.613  -8.784
  715    HE2  PHE  93           HE2      PHE  93   8.716  -7.684  -9.202
  716    HZ   PHE  93           HZ       PHE  93  11.051  -7.841  -9.979
  717    H    GLU  94           H        GLU  94  11.200  -4.698  -2.446
  718    HA   GLU  94           HA       GLU  94   9.114  -3.053  -1.317
  719   1HB   GLU  94          HB2       GLU  94  11.789  -3.803  -0.105
  720   2HB   GLU  94          HB1       GLU  94  10.407  -3.096   0.702
  721   1HG   GLU  94          HG2       GLU  94   9.221  -5.267  -0.043
  722   2HG   GLU  94          HG1       GLU  94  10.878  -5.895  -0.093
  723    H    GLN  95           H        GLN  95   9.454  -0.914  -0.992
  724    HA   GLN  95           HA       GLN  95  11.769   0.218  -2.413
  725   1HB   GLN  95          HB2       GLN  95   9.371   0.360  -3.449
  726   2HB   GLN  95          HB1       GLN  95   9.098   1.590  -2.219
  727   1HG   GLN  95          HG2       GLN  95  10.937   2.890  -3.068
  728   2HG   GLN  95          HG1       GLN  95  11.311   1.633  -4.238
  729   1HE2  GLN  95          HE21      GLN  95   9.161   4.222  -3.385
  730   2HE2  GLN  95          HE22      GLN  95   8.464   4.376  -4.948
  731    H    THR  96           H        THR  96  13.097   1.161  -0.958
  732    HA   THR  96           HA       THR  96  11.942   2.283   1.516
  733    HB   THR  96           HB       THR  96  14.794   1.915   1.573
  734    HG1  THR  96           HG1      THR  96  14.214  -0.563   1.692
  735   1HG2  THR  96          HG21      THR  96  14.202   0.558   3.565
  736   2HG2  THR  96          HG22      THR  96  12.495   0.707   3.128
  737   3HG2  THR  96          HG23      THR  96  13.409   2.127   3.551
  738    H    ILE  97           H        ILE  97  13.175   4.131   2.410
  739    HA   ILE  97           HA       ILE  97  14.249   5.852   0.273
  740    HB   ILE  97           HB       ILE  97  13.240   6.819   2.967
  741   1HG1  ILE  97          HG12      ILE  97  11.525   6.806   0.522
  742   2HG1  ILE  97          HG11      ILE  97  11.571   5.340   1.484
  743   1HG2  ILE  97          HG21      ILE  97  14.601   8.245   1.383
  744   2HG2  ILE  97          HG22      ILE  97  13.028   8.878   1.763
  745   3HG2  ILE  97          HG23      ILE  97  13.298   8.078   0.205
  746   1HD1  ILE  97          HD11      ILE  97  10.449   8.033   2.139
  747   2HD1  ILE  97          HD12      ILE  97  10.918   6.900   3.411
  748   3HD1  ILE  97          HD13      ILE  97   9.710   6.431   2.235
  749    H    ASN  98           H        ASN  98  16.038   7.108   0.856
  750    HA   ASN  98           HA       ASN  98  17.784   5.766   2.761
  751   1HB   ASN  98          HB2       ASN  98  19.549   7.173   1.550
  752   2HB   ASN  98          HB1       ASN  98  18.798   5.882   0.608
  753   1HD2  ASN  98          HD21      ASN  98  17.313   9.043   1.323
  754   2HD2  ASN  98          HD22      ASN  98  17.320   9.591  -0.279
  755    H    ASP  99           H        ASP  99  15.599   7.994   3.170
  756    HA   ASP  99           HA       ASP  99  17.188   9.601   4.999
  757   1HB   ASP  99          HB2       ASP  99  17.346  10.542   2.667
  758   2HB   ASP  99          HB1       ASP  99  15.670  10.941   2.838
  759    H    LEU 100           H        LEU 100  14.109   9.563   3.213
  760    HA   LEU 100           HA       LEU 100  12.576  10.707   5.355
  761   1HB   LEU 100          HB2       LEU 100  11.540   9.295   2.913
  762   2HB   LEU 100          HB1       LEU 100  10.797  10.539   3.880
  763    HG   LEU 100           HG       LEU 100  13.304  11.278   2.476
  764   1HD1  LEU 100          HD11      LEU 100  10.578  11.030   1.252
  765   2HD1  LEU 100          HD12      LEU 100  12.004  10.092   0.776
  766   3HD1  LEU 100          HD13      LEU 100  11.954  11.835   0.503
  767   1HD2  LEU 100          HD21      LEU 100  10.682  12.606   2.937
  768   2HD2  LEU 100          HD22      LEU 100  12.143  13.346   2.313
  769   3HD2  LEU 100          HD23      LEU 100  12.084  12.793   4.010
  770    H    THR 101           H        THR 101  13.992   8.008   5.434
  771    HA   THR 101           HA       THR 101  12.493   5.750   5.538
  772    HB   THR 101           HB       THR 101  14.752   6.544   7.329
  773    HG1  THR 101           HG1      THR 101  15.085   5.562   4.715
  774   1HG2  THR 101          HG21      THR 101  14.163   3.969   5.829
  775   2HG2  THR 101          HG22      THR 101  13.874   4.209   7.553
  776   3HG2  THR 101          HG23      THR 101  15.524   4.235   6.918
  777    H    PHE 102           H        PHE 102  12.377   8.426   7.680
  778    HA   PHE 102           HA       PHE 102  11.614   7.108  10.092
  779   1HB   PHE 102          HB2       PHE 102  10.931   9.372  10.870
  780   2HB   PHE 102          HB1       PHE 102  12.557   9.345  10.206
  781    HD1  PHE 102           HD1      PHE 102  13.081  10.520   8.158
  782    HD2  PHE 102           HD2      PHE 102   9.124  10.525   9.716
  783    HE1  PHE 102           HE1      PHE 102  12.490  12.391   6.662
  784    HE2  PHE 102           HE2      PHE 102   8.525  12.378   8.223
  785    HZ   PHE 102           HZ       PHE 102  10.206  13.310   6.688
  Start of MODEL    3
    1    HA   MET   1           HA       MET   1 -11.948  -8.446 -26.991
    2   1HB   MET   1          HB2       MET   1 -13.128  -9.003 -24.903
    3   2HB   MET   1          HB1       MET   1 -11.423  -8.710 -24.596
    4   1HG   MET   1          HG2       MET   1 -11.920  -6.516 -23.727
    5   2HG   MET   1          HG1       MET   1 -13.627  -6.708 -24.125
    6   1HE   MET   1          HE1       MET   1 -13.505  -6.753 -20.204
    7   2HE   MET   1          HE2       MET   1 -14.219  -5.991 -21.623
    8   3HE   MET   1          HE3       MET   1 -12.495  -5.810 -21.299
    9    H    ALA   2           H        ALA   2 -14.237  -8.839 -27.223
   10    HA   ALA   2           HA       ALA   2 -15.786  -6.362 -27.603
   11   1HB   ALA   2          HB1       ALA   2 -15.275  -7.556 -29.692
   12   2HB   ALA   2          HB2       ALA   2 -17.002  -7.594 -29.338
   13   3HB   ALA   2          HB3       ALA   2 -16.009  -9.019 -29.027
   14    H    HIS   3           H        HIS   3 -15.499  -7.909 -25.183
   15    HA   HIS   3           HA       HIS   3 -18.205  -8.985 -24.875
   16   1HB   HIS   3          HB2       HIS   3 -15.712  -9.756 -23.344
   17   2HB   HIS   3          HB1       HIS   3 -17.333 -10.332 -22.982
   18    HD1  HIS   3           HD1      HIS   3 -18.337 -12.126 -24.650
   19    HD2  HIS   3           HD2      HIS   3 -14.417 -10.990 -25.410
   20    HE1  HIS   3           HE1      HIS   3 -17.421 -13.823 -26.243
   21    H    HIS   4           H        HIS   4 -19.423  -8.138 -23.310
   22    HA   HIS   4           HA       HIS   4 -18.382  -5.836 -21.943
   23   1HB   HIS   4          HB2       HIS   4 -20.594  -5.665 -23.019
   24   2HB   HIS   4          HB1       HIS   4 -21.195  -6.977 -22.020
   25    HD1  HIS   4           HD1      HIS   4 -20.055  -3.336 -21.699
   26    HD2  HIS   4           HD2      HIS   4 -22.240  -6.215 -19.638
   27    HE1  HIS   4           HE1      HIS   4 -21.116  -2.153 -19.764
   28    H    HIS   5           H        HIS   5 -16.927  -6.976 -20.692
   29    HA   HIS   5           HA       HIS   5 -17.800  -8.810 -18.642
   30   1HB   HIS   5          HB2       HIS   5 -15.523  -8.921 -19.700
   31   2HB   HIS   5          HB1       HIS   5 -15.158  -7.350 -19.010
   32    HD1  HIS   5           HD1      HIS   5 -13.817  -7.493 -16.877
   33    HD2  HIS   5           HD2      HIS   5 -16.101 -10.902 -17.543
   34    HE1  HIS   5           HE1      HIS   5 -13.296  -9.048 -14.994
   35    H    HIS   6           H        HIS   6 -17.897  -8.302 -16.383
   36    HA   HIS   6           HA       HIS   6 -18.840  -5.673 -15.892
   37   1HB   HIS   6          HB2       HIS   6 -19.696  -7.719 -14.690
   38   2HB   HIS   6          HB1       HIS   6 -18.148  -7.817 -13.863
   39    HD1  HIS   6           HD1      HIS   6 -18.600  -7.101 -11.478
   40    HD2  HIS   6           HD2      HIS   6 -20.563  -4.717 -14.257
   41    HE1  HIS   6           HE1      HIS   6 -19.770  -5.315 -10.164
   42    H    HIS   7           H        HIS   7 -17.683  -3.976 -15.463
   43    HA   HIS   7           HA       HIS   7 -14.855  -4.195 -15.170
   44   1HB   HIS   7          HB2       HIS   7 -14.867  -1.705 -15.178
   45   2HB   HIS   7          HB1       HIS   7 -15.658  -2.415 -16.576
   46    HD1  HIS   7           HD1      HIS   7 -16.243  -0.096 -13.728
   47    HD2  HIS   7           HD2      HIS   7 -18.497  -2.125 -16.564
   48    HE1  HIS   7           HE1      HIS   7 -18.493   1.011 -13.757
   49    H    HIS   8           H        HIS   8 -13.686  -2.919 -13.549
   50    HA   HIS   8           HA       HIS   8 -14.594  -3.737 -10.974
   51   1HB   HIS   8          HB2       HIS   8 -12.420  -2.851 -10.133
   52   2HB   HIS   8          HB1       HIS   8 -12.235  -4.011 -11.435
   53    HD1  HIS   8           HD1      HIS   8 -10.454  -3.307 -13.057
   54    HD2  HIS   8           HD2      HIS   8 -12.260  -0.051 -11.210
   55    HE1  HIS   8           HE1      HIS   8  -9.241  -1.270 -13.880
   56    H    ASN   9           H        ASN   9 -14.071  -2.077  -9.123
   57    HA   ASN   9           HA       ASN   9 -16.134  -0.122  -9.182
   58   1HB   ASN   9          HB2       ASN   9 -15.331  -1.292  -7.138
   59   2HB   ASN   9          HB1       ASN   9 -13.799  -0.450  -7.273
   60   1HD2  ASN   9          HD21      ASN   9 -17.074   0.949  -7.735
   61   2HD2  ASN   9          HD22      ASN   9 -16.938   1.987  -6.370
   62    H    GLN  10           H        GLN  10 -16.018   2.057  -9.653
   63    HA   GLN  10           HA       GLN  10 -14.114   3.128 -11.316
   64   1HB   GLN  10          HB2       GLN  10 -15.926   4.577  -9.370
   65   2HB   GLN  10          HB1       GLN  10 -14.982   5.388 -10.600
   66   1HG   GLN  10          HG2       GLN  10 -17.255   5.209 -11.339
   67   2HG   GLN  10          HG1       GLN  10 -16.256   4.155 -12.330
   68   1HE2  GLN  10          HE21      GLN  10 -18.047   2.945 -12.917
   69   2HE2  GLN  10          HE22      GLN  10 -18.804   1.841 -11.816
   70    H    GLN  11           H        GLN  11 -12.054   3.601 -11.006
   71    HA   GLN  11           HA       GLN  11 -11.222   4.076  -8.263
   72   1HB   GLN  11          HB2       GLN  11 -10.294   2.062  -9.426
   73   2HB   GLN  11          HB1       GLN  11  -9.491   3.149 -10.549
   74   1HG   GLN  11          HG2       GLN  11  -7.958   2.442  -8.813
   75   2HG   GLN  11          HG1       GLN  11  -8.276   4.175  -8.702
   76   1HE2  GLN  11          HE21      GLN  11 -10.502   1.676  -7.647
   77   2HE2  GLN  11          HE22      GLN  11 -10.407   2.069  -5.971
   78    H    ASN  12           H        ASN  12 -11.478   6.198  -8.130
   79    HA   ASN  12           HA       ASN  12  -9.965   7.902  -9.958
   80   1HB   ASN  12          HB2       ASN  12 -12.223   8.642  -9.732
   81   2HB   ASN  12          HB1       ASN  12 -12.168   8.509  -7.980
   82   1HD2  ASN  12          HD21      ASN  12 -11.194  10.401 -10.732
   83   2HD2  ASN  12          HD22      ASN  12 -10.728  11.803  -9.850
   84    H    LYS  13           H        LYS  13 -10.269   6.963  -6.600
   85    HA   LYS  13           HA       LYS  13  -8.520   8.978  -5.686
   86   1HB   LYS  13          HB2       LYS  13  -8.473   7.795  -3.506
   87   2HB   LYS  13          HB1       LYS  13 -10.068   8.201  -4.090
   88   1HG   LYS  13          HG2       LYS  13 -10.501   5.882  -4.639
   89   2HG   LYS  13          HG1       LYS  13  -8.830   5.455  -4.263
   90   1HD   LYS  13          HD2       LYS  13  -9.131   5.979  -1.951
   91   2HD   LYS  13          HD1       LYS  13 -10.703   6.705  -2.258
   92   1HE   LYS  13          HE2       LYS  13 -10.083   3.784  -2.707
   93   2HE   LYS  13          HE1       LYS  13 -10.757   4.427  -1.212
   94   1HZ   LYS  13          HZ1       LYS  13 -12.652   5.251  -2.496
   95   2HZ   LYS  13          HZ2       LYS  13 -12.513   3.588  -2.606
   96   3HZ   LYS  13          HZ3       LYS  13 -12.046   4.547  -3.901
   97    H    LYS  14           H        LYS  14  -7.952   5.559  -6.345
   98    HA   LYS  14           HA       LYS  14  -6.266   4.318  -6.581
   99   1HB   LYS  14          HB2       LYS  14  -4.222   5.052  -7.858
  100   2HB   LYS  14          HB1       LYS  14  -5.734   5.461  -8.621
  101   1HG   LYS  14          HG2       LYS  14  -4.369   7.329  -8.973
  102   2HG   LYS  14          HG1       LYS  14  -5.410   7.794  -7.635
  103   1HD   LYS  14          HD2       LYS  14  -3.260   8.510  -7.017
  104   2HD   LYS  14          HD1       LYS  14  -3.545   7.017  -6.113
  105   1HE   LYS  14          HE2       LYS  14  -1.313   6.940  -6.972
  106   2HE   LYS  14          HE1       LYS  14  -2.280   5.783  -7.880
  107   1HZ   LYS  14          HZ1       LYS  14  -1.471   8.497  -8.738
  108   2HZ   LYS  14          HZ2       LYS  14  -2.482   7.532  -9.650
  109   3HZ   LYS  14          HZ3       LYS  14  -0.875   7.084  -9.417
  110    H    VAL  15           H        VAL  15  -5.176   6.933  -4.744
  111    HA   VAL  15           HA       VAL  15  -4.771   5.413  -2.543
  112    HB   VAL  15           HB       VAL  15  -2.660   4.786  -4.033
  113   1HG1  VAL  15          HG11      VAL  15  -1.771   7.419  -2.975
  114   2HG1  VAL  15          HG12      VAL  15  -1.873   6.918  -4.673
  115   3HG1  VAL  15          HG13      VAL  15  -0.704   6.154  -3.576
  116   1HG2  VAL  15          HG21      VAL  15  -1.337   4.511  -2.010
  117   2HG2  VAL  15          HG22      VAL  15  -3.057   4.062  -1.850
  118   3HG2  VAL  15          HG23      VAL  15  -2.484   5.604  -1.204
  119    H    GLU  16           H        GLU  16  -5.224   6.900  -0.948
  120    HA   GLU  16           HA       GLU  16  -4.945   9.673  -1.806
  121   1HB   GLU  16          HB2       GLU  16  -6.617   8.594   0.452
  122   2HB   GLU  16          HB1       GLU  16  -6.629  10.246  -0.158
  123   1HG   GLU  16          HG2       GLU  16  -7.356   9.358  -2.349
  124   2HG   GLU  16          HG1       GLU  16  -7.449   7.765  -1.594
  125    H    GLY  17           H        GLY  17  -5.079   8.523   1.550
  126   1HA   GLY  17          HA2       GLY  17  -2.310   9.300   1.750
  127   2HA   GLY  17          HA1       GLY  17  -3.479  10.115   2.826
  128    H    GLY  18           H        GLY  18  -4.271   6.982   2.168
  129   1HA   GLY  18          HA2       GLY  18  -2.905   6.166   4.608
  130   2HA   GLY  18          HA1       GLY  18  -4.521   5.566   4.202
  131    H    TYR  19           H        TYR  19  -3.711   3.435   4.432
  132    HA   TYR  19           HA       TYR  19  -1.831   2.540   2.319
  133   1HB   TYR  19          HB2       TYR  19  -2.622   1.128   4.834
  134   2HB   TYR  19          HB1       TYR  19  -1.241   0.786   3.787
  135    HD1  TYR  19           HD1      TYR  19  -2.131   2.082   6.859
  136    HD2  TYR  19           HD2      TYR  19   0.379   2.979   3.542
  137    HE1  TYR  19           HE1      TYR  19  -0.813   3.517   8.275
  138    HE2  TYR  19           HE2      TYR  19   1.744   4.441   4.969
  139    HH   TYR  19           HH       TYR  19   1.566   5.673   6.977
  140    H    GLU  20           H        GLU  20  -2.634   1.745   0.721
  141    HA   GLU  20           HA       GLU  20  -5.214   0.435   0.877
  142   1HB   GLU  20          HB2       GLU  20  -4.778   1.954  -1.066
  143   2HB   GLU  20          HB1       GLU  20  -3.386   0.976  -1.499
  144   1HG   GLU  20          HG2       GLU  20  -5.037  -1.014  -1.592
  145   2HG   GLU  20          HG1       GLU  20  -6.288   0.216  -1.635
  146    H    CYS  21           H        CYS  21  -5.291  -1.630   0.671
  147    HA   CYS  21           HA       CYS  21  -2.859  -3.267   0.634
  148   1HB   CYS  21          HB2       CYS  21  -5.716  -4.191   0.525
  149   2HB   CYS  21          HB1       CYS  21  -4.304  -5.176   0.882
  150    H    LYS  22           H        LYS  22  -2.085  -4.151  -1.206
  151    HA   LYS  22           HA       LYS  22  -2.938  -3.703  -3.805
  152   1HB   LYS  22          HB2       LYS  22  -0.728  -4.579  -3.139
  153   2HB   LYS  22          HB1       LYS  22  -1.454  -6.151  -2.819
  154   1HG   LYS  22          HG2       LYS  22  -2.239  -5.913  -5.319
  155   2HG   LYS  22          HG1       LYS  22  -0.894  -4.780  -5.411
  156   1HD   LYS  22          HD2       LYS  22  -0.078  -6.927  -6.094
  157   2HD   LYS  22          HD1       LYS  22   0.578  -6.602  -4.487
  158   1HE   LYS  22          HE2       LYS  22  -1.116  -7.980  -3.477
  159   2HE   LYS  22          HE1       LYS  22  -1.885  -8.246  -5.043
  160   1HZ   LYS  22          HZ1       LYS  22   0.739  -9.296  -4.092
  161   2HZ   LYS  22          HZ2       LYS  22   0.268  -9.297  -5.700
  162   3HZ   LYS  22          HZ3       LYS  22  -0.649 -10.138  -4.567
  163    H    TYR  23           H        TYR  23  -4.169  -5.913  -1.514
  164    HA   TYR  23           HA       TYR  23  -5.620  -7.401  -3.556
  165   1HB   TYR  23          HB2       TYR  23  -5.844  -8.856  -1.170
  166   2HB   TYR  23          HB1       TYR  23  -4.866  -9.257  -2.573
  167    HD1  TYR  23           HD1      TYR  23  -2.492  -9.002  -2.526
  168    HD2  TYR  23           HD2      TYR  23  -4.803  -7.750   0.810
  169    HE1  TYR  23           HE1      TYR  23  -0.445  -8.833  -1.196
  170    HE2  TYR  23           HE2      TYR  23  -2.748  -7.575   2.164
  171    HH   TYR  23           HH       TYR  23  -0.440  -8.603   2.128
  172    H    CYS  24           H        CYS  24  -6.209  -4.843  -1.703
  173    HA   CYS  24           HA       CYS  24  -8.972  -5.230  -1.938
  174   1HB   CYS  24          HB2       CYS  24  -9.735  -5.294   0.380
  175   2HB   CYS  24          HB1       CYS  24  -8.492  -6.498   0.202
  176    H    THR  25           H        THR  25  -9.501  -3.287  -2.779
  177    HA   THR  25           HA       THR  25  -7.988  -1.023  -1.942
  178    HB   THR  25           HB       THR  25 -10.327  -1.142  -3.897
  179    HG1  THR  25           HG1      THR  25  -7.559  -0.762  -4.382
  180   1HG2  THR  25          HG21      THR  25 -10.037   1.126  -2.930
  181   2HG2  THR  25          HG22      THR  25  -9.567   1.093  -4.630
  182   3HG2  THR  25          HG23      THR  25  -8.331   1.088  -3.376
  183    H    PHE  26           H        PHE  26  -8.625  -1.578   0.139
  184    HA   PHE  26           HA       PHE  26 -10.711   0.198   1.089
  185   1HB   PHE  26          HB2       PHE  26  -9.955  -2.534   2.217
  186   2HB   PHE  26          HB1       PHE  26 -10.954  -1.360   3.063
  187    HD1  PHE  26           HD1      PHE  26 -13.258  -1.039   2.459
  188    HD2  PHE  26           HD2      PHE  26 -10.800  -3.716   0.266
  189    HE1  PHE  26           HE1      PHE  26 -15.254  -1.992   1.387
  190    HE2  PHE  26           HE2      PHE  26 -12.785  -4.679  -0.807
  191    HZ   PHE  26           HZ       PHE  26 -15.020  -3.817  -0.251
  192    H    GLN  27           H        GLN  27  -9.568   1.739   1.847
  193    HA   GLN  27           HA       GLN  27  -6.819   1.172   2.608
  194   1HB   GLN  27          HB2       GLN  27  -6.780   2.493   0.689
  195   2HB   GLN  27          HB1       GLN  27  -8.126   3.494   1.225
  196   1HG   GLN  27          HG2       GLN  27  -6.693   4.562   2.857
  197   2HG   GLN  27          HG1       GLN  27  -5.434   3.383   2.457
  198   1HE2  GLN  27          HE21      GLN  27  -4.180   3.774   0.959
  199   2HE2  GLN  27          HE22      GLN  27  -4.093   5.119  -0.123
  200    H    THR  28           H        THR  28  -5.992   1.956   4.413
  201    HA   THR  28           HA       THR  28  -7.581   3.766   5.948
  202    HB   THR  28           HB       THR  28  -8.208   1.518   6.797
  203    HG1  THR  28           HG1      THR  28  -8.392   2.483   8.556
  204   1HG2  THR  28          HG21      THR  28  -6.108   0.309   6.327
  205   2HG2  THR  28          HG22      THR  28  -6.570   0.134   8.016
  206   3HG2  THR  28          HG23      THR  28  -5.287   1.239   7.576
  207    HA   PRO  29           HA       PRO  29  -3.419   5.407   6.245
  208   1HB   PRO  29          HB2       PRO  29  -4.078   7.534   7.800
  209   2HB   PRO  29          HB1       PRO  29  -4.327   7.481   6.048
  210   1HG   PRO  29          HG2       PRO  29  -6.272   6.967   8.259
  211   2HG   PRO  29          HG1       PRO  29  -6.505   7.904   6.769
  212   1HD   PRO  29          HD2       PRO  29  -7.423   5.388   7.014
  213   2HD   PRO  29          HD1       PRO  29  -6.755   5.971   5.464
  214    H    ASP  30           H        ASP  30  -5.124   3.870   8.543
  215    HA   ASP  30           HA       ASP  30  -3.253   4.422  10.739
  216   1HB   ASP  30          HB2       ASP  30  -5.920   3.737  10.798
  217   2HB   ASP  30          HB1       ASP  30  -5.128   2.216  10.767
  218    H    LEU  31           H        LEU  31  -1.408   3.255  10.672
  219    HA   LEU  31           HA       LEU  31  -1.000   1.084   9.019
  220   1HB   LEU  31          HB2       LEU  31   0.605   2.686  10.331
  221   2HB   LEU  31          HB1       LEU  31   0.517   1.450  11.565
  222    HG   LEU  31           HG       LEU  31   2.529   1.084  10.312
  223   1HD1  LEU  31          HD11      LEU  31   0.435  -0.831   9.417
  224   2HD1  LEU  31          HD12      LEU  31   1.380  -0.969  10.899
  225   3HD1  LEU  31          HD13      LEU  31   2.170  -1.155   9.312
  226   1HD2  LEU  31          HD21      LEU  31   0.785   1.097   7.901
  227   2HD2  LEU  31          HD22      LEU  31   2.531   0.782   7.898
  228   3HD2  LEU  31          HD23      LEU  31   1.893   2.367   8.387
  229    H    ASN  32           H        ASN  32  -1.919   1.292  12.473
  230    HA   ASN  32           HA       ASN  32  -1.677  -1.407  13.063
  231   1HB   ASN  32          HB2       ASN  32  -2.008   0.423  14.743
  232   2HB   ASN  32          HB1       ASN  32  -3.635   0.565  14.032
  233   1HD2  ASN  32          HD21      ASN  32  -5.220  -0.765  14.572
  234   2HD2  ASN  32          HD22      ASN  32  -5.065  -1.976  15.770
  235    H    MET  33           H        MET  33  -4.380   0.543  11.940
  236    HA   MET  33           HA       MET  33  -6.213  -1.666  11.898
  237   1HB   MET  33          HB2       MET  33  -6.462   0.863  10.257
  238   2HB   MET  33          HB1       MET  33  -7.723  -0.301  10.593
  239   1HG   MET  33          HG2       MET  33  -6.308   1.361  12.596
  240   2HG   MET  33          HG1       MET  33  -7.928   1.689  11.968
  241   1HE   MET  33          HE1       MET  33  -8.926   1.810  14.405
  242   2HE   MET  33          HE2       MET  33  -7.321   1.543  15.089
  243   3HE   MET  33          HE3       MET  33  -8.689   0.573  15.637
  244    H    PHE  34           H        PHE  34  -4.047  -0.221   9.604
  245    HA   PHE  34           HA       PHE  34  -4.840  -1.720   7.377
  246   1HB   PHE  34          HB2       PHE  34  -3.324   0.120   7.044
  247   2HB   PHE  34          HB1       PHE  34  -2.140  -0.562   8.119
  248    HD1  PHE  34           HD1      PHE  34  -3.873  -1.194   4.869
  249    HD2  PHE  34           HD2      PHE  34  -0.477  -1.966   7.317
  250    HE1  PHE  34           HE1      PHE  34  -2.793  -2.346   2.995
  251    HE2  PHE  34           HE2      PHE  34   0.613  -3.128   5.435
  252    HZ   PHE  34           HZ       PHE  34  -0.556  -3.318   3.271
  253    H    THR  35           H        THR  35  -2.253  -2.437   9.690
  254    HA   THR  35           HA       THR  35  -1.821  -4.985   8.476
  255    HB   THR  35           HB       THR  35   0.111  -3.990   9.555
  256    HG1  THR  35           HG1      THR  35  -0.638  -6.441   9.924
  257   1HG2  THR  35          HG21      THR  35   0.259  -3.767  12.022
  258   2HG2  THR  35          HG22      THR  35  -1.458  -4.209  12.125
  259   3HG2  THR  35          HG23      THR  35  -0.970  -2.729  11.294
  260    H    PHE  36           H        PHE  36  -3.849  -3.860  10.983
  261    HA   PHE  36           HA       PHE  36  -4.360  -6.314  12.229
  262   1HB   PHE  36          HB2       PHE  36  -4.960  -4.328  13.409
  263   2HB   PHE  36          HB1       PHE  36  -5.911  -3.704  12.108
  264    HD1  PHE  36           HD1      PHE  36  -5.894  -7.056  13.691
  265    HD2  PHE  36           HD2      PHE  36  -8.025  -3.493  12.934
  266    HE1  PHE  36           HE1      PHE  36  -7.882  -8.017  14.837
  267    HE2  PHE  36           HE2      PHE  36 -10.028  -4.425  14.042
  268    HZ   PHE  36           HZ       PHE  36  -9.949  -6.694  14.993
  269    H    HIS  37           H        HIS  37  -6.221  -4.555   9.757
  270    HA   HIS  37           HA       HIS  37  -7.987  -6.737   9.489
  271   1HB   HIS  37          HB2       HIS  37  -9.204  -5.464   7.911
  272   2HB   HIS  37          HB1       HIS  37  -8.388  -4.247   8.887
  273    HD1  HIS  37           HD1      HIS  37  -6.867  -2.614   7.655
  274    HD2  HIS  37           HD2      HIS  37  -8.150  -5.786   5.302
  275    HE1  HIS  37           HE1      HIS  37  -6.238  -2.011   5.269
  276    H    VAL  38           H        VAL  38  -4.988  -5.919   8.044
  277    HA   VAL  38           HA       VAL  38  -5.169  -7.680   5.824
  278    HB   VAL  38           HB       VAL  38  -2.820  -6.425   7.214
  279   1HG1  VAL  38          HG11      VAL  38  -2.749  -8.189   4.742
  280   2HG1  VAL  38          HG12      VAL  38  -2.066  -8.592   6.315
  281   3HG1  VAL  38          HG13      VAL  38  -1.375  -7.271   5.367
  282   1HG2  VAL  38          HG21      VAL  38  -4.000  -6.023   4.471
  283   2HG2  VAL  38          HG22      VAL  38  -2.582  -5.187   5.103
  284   3HG2  VAL  38          HG23      VAL  38  -4.158  -4.942   5.854
  285    H    ASP  39           H        ASP  39  -3.533  -7.972   8.975
  286    HA   ASP  39           HA       ASP  39  -2.649 -10.602   8.445
  287   1HB   ASP  39          HB2       ASP  39  -1.515  -9.088  10.003
  288   2HB   ASP  39          HB1       ASP  39  -2.917  -9.107  11.048
  289    H    SER  40           H        SER  40  -5.597  -9.351   9.490
  290    HA   SER  40           HA       SER  40  -6.555 -11.810  10.666
  291   1HB   SER  40          HB2       SER  40  -7.337  -9.632  11.530
  292   2HB   SER  40          HB1       SER  40  -8.020  -9.257   9.954
  293    HG   SER  40           HG       SER  40  -9.593 -10.743  10.242
  294    H    GLU  41           H        GLU  41  -7.141  -9.913   7.676
  295    HA   GLU  41           HA       GLU  41  -8.961 -12.055   6.845
  296   1HB   GLU  41          HB2       GLU  41  -8.593  -9.317   5.649
  297   2HB   GLU  41          HB1       GLU  41  -9.832 -10.484   5.207
  298   1HG   GLU  41          HG2       GLU  41  -9.530  -9.080   7.855
  299   2HG   GLU  41          HG1       GLU  41 -10.796  -8.819   6.659
  300    H    HIS  42           H        HIS  42  -6.139 -10.289   5.629
  301    HA   HIS  42           HA       HIS  42  -5.682 -12.443   3.766
  302   1HB   HIS  42          HB2       HIS  42  -4.738 -10.389   2.385
  303   2HB   HIS  42          HB1       HIS  42  -6.347 -11.036   2.064
  304    HD1  HIS  42           HD1      HIS  42  -8.320  -9.423   2.875
  305    HD2  HIS  42           HD2      HIS  42  -4.518  -7.819   3.379
  306    HE1  HIS  42           HE1      HIS  42  -8.672  -6.997   3.367
  307    HA   PRO  43           HA       PRO  43  -1.953 -11.229   6.308
  308   1HB   PRO  43          HB2       PRO  43  -1.401 -13.706   7.272
  309   2HB   PRO  43          HB1       PRO  43  -2.506 -12.599   8.091
  310   1HG   PRO  43          HG2       PRO  43  -3.106 -14.895   6.283
  311   2HG   PRO  43          HG1       PRO  43  -3.912 -14.424   7.791
  312   1HD   PRO  43          HD2       PRO  43  -4.943 -13.845   5.339
  313   2HD   PRO  43          HD1       PRO  43  -5.161 -12.791   6.749
  314    H    ASN  44           H        ASN  44  -2.687 -13.753   4.055
  315    HA   ASN  44           HA       ASN  44  -0.056 -13.559   2.856
  316   1HB   ASN  44          HB2       ASN  44   0.215 -15.534   4.226
  317   2HB   ASN  44          HB1       ASN  44  -1.348 -16.163   3.712
  318   1HD2  ASN  44          HD21      ASN  44   1.949 -15.632   2.793
  319   2HD2  ASN  44          HD22      ASN  44   1.924 -16.663   1.392
  320    H    VAL  45           H        VAL  45  -0.385 -13.115   0.815
  321    HA   VAL  45           HA       VAL  45  -2.511 -14.436  -0.678
  322    HB   VAL  45           HB       VAL  45  -1.873 -11.514  -1.122
  323   1HG1  VAL  45          HG11      VAL  45  -3.031 -12.678  -2.903
  324   2HG1  VAL  45          HG12      VAL  45  -4.053 -11.432  -2.169
  325   3HG1  VAL  45          HG13      VAL  45  -4.322 -13.123  -1.774
  326   1HG2  VAL  45          HG21      VAL  45  -2.608 -11.608   1.149
  327   2HG2  VAL  45          HG22      VAL  45  -4.054 -12.514   0.681
  328   3HG2  VAL  45          HG23      VAL  45  -3.838 -10.833   0.145
  329    H    VAL  46           H        VAL  46  -1.711 -14.781  -2.864
  330    HA   VAL  46           HA       VAL  46   0.994 -13.847  -3.094
  331    HB   VAL  46           HB       VAL  46   1.211 -16.125  -2.369
  332   1HG1  VAL  46          HG11      VAL  46  -0.494 -16.929  -4.717
  333   2HG1  VAL  46          HG12      VAL  46  -0.938 -17.008  -3.014
  334   3HG1  VAL  46          HG13      VAL  46   0.349 -18.042  -3.640
  335   1HG2  VAL  46          HG21      VAL  46   1.866 -15.945  -5.313
  336   2HG2  VAL  46          HG22      VAL  46   2.518 -17.144  -4.203
  337   3HG2  VAL  46          HG23      VAL  46   2.902 -15.438  -3.977
  338    H    LEU  47           H        LEU  47   1.546 -12.926  -4.977
  339    HA   LEU  47           HA       LEU  47   0.458 -13.723  -7.479
  340   1HB   LEU  47          HB2       LEU  47  -1.283 -12.157  -6.584
  341   2HB   LEU  47          HB1       LEU  47  -0.069 -10.903  -6.494
  342    HG   LEU  47           HG       LEU  47   0.165 -11.036  -8.976
  343   1HD1  LEU  47          HD11      LEU  47  -0.580 -13.308  -9.334
  344   2HD1  LEU  47          HD12      LEU  47  -1.567 -12.184 -10.265
  345   3HD1  LEU  47          HD13      LEU  47  -2.197 -12.884  -8.772
  346   1HD2  LEU  47          HD21      LEU  47  -2.613 -10.475  -7.947
  347   2HD2  LEU  47          HD22      LEU  47  -1.945  -9.897  -9.473
  348   3HD2  LEU  47          HD23      LEU  47  -1.259  -9.344  -7.943
  349    H    ASN  48           H        ASN  48   1.591 -12.591  -9.213
  350    HA   ASN  48           HA       ASN  48   4.245 -12.964  -9.030
  351   1HB   ASN  48          HB2       ASN  48   2.867 -11.179 -11.012
  352   2HB   ASN  48          HB1       ASN  48   4.519 -11.752 -11.169
  353   1HD2  ASN  48          HD21      ASN  48   4.176 -12.887 -13.012
  354   2HD2  ASN  48          HD22      ASN  48   3.216 -14.314 -13.090
  355    H    SER  49           H        SER  49   3.406  -9.577  -9.815
  356    HA   SER  49           HA       SER  49   5.723  -8.831  -8.181
  357   1HB   SER  49          HB2       SER  49   6.243  -7.212 -10.081
  358   2HB   SER  49          HB1       SER  49   6.562  -8.920 -10.372
  359    HG   SER  49           HG       SER  49   5.320  -8.725 -12.013
  360    H    SER  50           H        SER  50   5.550  -7.024  -6.947
  361    HA   SER  50           HA       SER  50   3.825  -4.900  -7.628
  362   1HB   SER  50          HB2       SER  50   2.224  -6.511  -6.567
  363   2HB   SER  50          HB1       SER  50   3.245  -6.533  -5.133
  364    HG   SER  50           HG       SER  50   1.891  -4.268  -6.188
  365    H    TYR  51           H        TYR  51   3.937  -3.315  -5.728
  366    HA   TYR  51           HA       TYR  51   6.660  -3.274  -4.666
  367   1HB   TYR  51          HB2       TYR  51   5.013  -1.277  -6.075
  368   2HB   TYR  51          HB1       TYR  51   6.039  -0.729  -4.780
  369    HD1  TYR  51           HD1      TYR  51   6.991  -3.425  -7.197
  370    HD2  TYR  51           HD2      TYR  51   7.476   0.629  -6.023
  371    HE1  TYR  51           HE1      TYR  51   8.869  -3.187  -8.772
  372    HE2  TYR  51           HE2      TYR  51   9.354   0.866  -7.578
  373    HH   TYR  51           HH       TYR  51  10.919  -0.415  -8.708
  374    H    VAL  52           H        VAL  52   6.862  -2.660  -2.633
  375    HA   VAL  52           HA       VAL  52   4.474  -1.841  -1.126
  376    HB   VAL  52           HB       VAL  52   4.842  -4.258  -0.833
  377   1HG1  VAL  52          HG11      VAL  52   7.174  -4.277  -1.344
  378   2HG1  VAL  52          HG12      VAL  52   6.795  -5.103   0.168
  379   3HG1  VAL  52          HG13      VAL  52   7.501  -3.486   0.205
  380   1HG2  VAL  52          HG21      VAL  52   5.120  -4.412   1.582
  381   2HG2  VAL  52          HG22      VAL  52   4.011  -3.137   1.085
  382   3HG2  VAL  52          HG23      VAL  52   5.644  -2.719   1.613
  383    H    CYS  53           H        CYS  53   4.895  -0.396   0.493
  384    HA   CYS  53           HA       CYS  53   7.538   0.902   0.567
  385   1HB   CYS  53          HB2       CYS  53   5.581   2.332   0.623
  386   2HB   CYS  53          HB1       CYS  53   4.915   1.456   1.987
  387    H    VAL  54           H        VAL  54   8.960  -0.419   1.623
  388    HA   VAL  54           HA       VAL  54   8.387  -2.272   3.599
  389    HB   VAL  54           HB       VAL  54  10.916  -1.018   4.119
  390   1HG1  VAL  54          HG11      VAL  54  10.363  -3.295   4.654
  391   2HG1  VAL  54          HG12      VAL  54  11.769  -3.152   3.558
  392   3HG1  VAL  54          HG13      VAL  54  10.179  -3.572   2.906
  393   1HG2  VAL  54          HG21      VAL  54  11.906  -1.664   1.906
  394   2HG2  VAL  54          HG22      VAL  54  11.002  -0.166   2.012
  395   3HG2  VAL  54          HG23      VAL  54  10.260  -1.549   1.256
  396    H    GLU  55           H        GLU  55   8.862   1.130   3.805
  397    HA   GLU  55           HA       GLU  55   9.463   1.354   6.501
  398   1HB   GLU  55          HB2       GLU  55   7.915   3.378   4.884
  399   2HB   GLU  55          HB1       GLU  55   8.933   3.688   6.281
  400   1HG   GLU  55          HG2       GLU  55   9.913   2.702   3.607
  401   2HG   GLU  55          HG1       GLU  55   9.948   4.373   4.149
  402    H    CYS  56           H        CYS  56   6.537   1.229   4.695
  403    HA   CYS  56           HA       CYS  56   4.849   1.421   7.135
  404   1HB   CYS  56          HB2       CYS  56   3.933   1.471   4.285
  405   2HB   CYS  56          HB1       CYS  56   3.050   2.011   5.713
  406    H    ASN  57           H        ASN  57   6.113  -0.847   5.051
  407    HA   ASN  57           HA       ASN  57   5.648  -2.925   4.284
  408   1HB   ASN  57          HB2       ASN  57   4.514  -2.851   7.002
  409   2HB   ASN  57          HB1       ASN  57   4.447  -4.385   6.082
  410   1HD2  ASN  57          HD21      ASN  57   7.123  -3.882   4.888
  411   2HD2  ASN  57          HD22      ASN  57   8.193  -4.161   6.197
  412    H    PHE  58           H        PHE  58   4.109  -1.393   2.893
  413    HA   PHE  58           HA       PHE  58   1.448  -2.588   3.032
  414   1HB   PHE  58          HB2       PHE  58   0.306  -0.634   3.271
  415   2HB   PHE  58          HB1       PHE  58   1.833   0.038   3.801
  416    HD1  PHE  58           HD1      PHE  58   3.033   1.589   2.393
  417    HD2  PHE  58           HD2      PHE  58  -0.558  -0.195   1.056
  418    HE1  PHE  58           HE1      PHE  58   2.895   3.247   0.535
  419    HE2  PHE  58           HE2      PHE  58  -0.717   1.434  -0.772
  420    HZ   PHE  58           HZ       PHE  58   1.011   3.164  -1.033
  421    H    LEU  59           H        LEU  59   0.823  -3.417   1.220
  422    HA   LEU  59           HA       LEU  59   2.423  -3.021  -1.184
  423   1HB   LEU  59          HB2       LEU  59   0.755  -5.188  -0.076
  424   2HB   LEU  59          HB1       LEU  59   0.705  -5.024  -1.809
  425    HG   LEU  59           HG       LEU  59   3.277  -5.413  -0.263
  426   1HD1  LEU  59          HD11      LEU  59   1.712  -7.303   0.011
  427   2HD1  LEU  59          HD12      LEU  59   3.109  -7.723  -0.984
  428   3HD1  LEU  59          HD13      LEU  59   1.550  -7.379  -1.745
  429   1HD2  LEU  59          HD21      LEU  59   2.540  -5.652  -3.185
  430   2HD2  LEU  59          HD22      LEU  59   4.090  -6.068  -2.505
  431   3HD2  LEU  59          HD23      LEU  59   3.546  -4.392  -2.481
  432    H    THR  60           H        THR  60   1.501  -2.197  -3.033
  433    HA   THR  60           HA       THR  60  -1.318  -1.375  -2.813
  434    HB   THR  60           HB       THR  60  -0.394   0.671  -2.517
  435    HG1  THR  60           HG1      THR  60   0.210   1.185  -5.073
  436   1HG2  THR  60          HG21      THR  60   1.951  -0.067  -4.262
  437   2HG2  THR  60          HG22      THR  60   1.907  -0.138  -2.506
  438   3HG2  THR  60          HG23      THR  60   1.790   1.412  -3.310
  439    H    LYS  61           H        LYS  61  -2.502  -1.068  -4.766
  440    HA   LYS  61           HA       LYS  61  -1.917  -3.086  -6.696
  441   1HB   LYS  61          HB2       LYS  61  -4.060  -0.957  -6.677
  442   2HB   LYS  61          HB1       LYS  61  -3.938  -2.207  -7.902
  443   1HG   LYS  61          HG2       LYS  61  -4.209  -3.913  -6.131
  444   2HG   LYS  61          HG1       LYS  61  -4.419  -2.609  -4.961
  445   1HD   LYS  61          HD2       LYS  61  -6.400  -1.837  -6.120
  446   2HD   LYS  61          HD1       LYS  61  -6.170  -3.052  -7.379
  447   1HE   LYS  61          HE2       LYS  61  -6.494  -4.832  -5.722
  448   2HE   LYS  61          HE1       LYS  61  -6.689  -3.623  -4.458
  449   1HZ   LYS  61          HZ1       LYS  61  -8.647  -2.807  -5.565
  450   2HZ   LYS  61          HZ2       LYS  61  -8.831  -4.459  -5.247
  451   3HZ   LYS  61          HZ3       LYS  61  -8.499  -3.943  -6.805
  452    H    ARG  62           H        ARG  62  -1.095   0.197  -6.450
  453    HA   ARG  62           HA       ARG  62   0.023  -0.019  -9.145
  454   1HB   ARG  62          HB2       ARG  62  -0.354   2.306  -9.723
  455   2HB   ARG  62          HB1       ARG  62  -1.875   1.522  -9.368
  456   1HG   ARG  62          HG2       ARG  62  -0.446   3.224  -7.349
  457   2HG   ARG  62          HG1       ARG  62  -1.554   3.900  -8.541
  458   1HD   ARG  62          HD2       ARG  62  -2.178   1.851  -6.426
  459   2HD   ARG  62          HD1       ARG  62  -2.665   3.548  -6.458
  460    HE   ARG  62           HE       ARG  62  -3.666   2.648  -8.789
  461   1HH1  ARG  62          HH11      ARG  62  -4.042   1.436  -5.485
  462   2HH1  ARG  62          HH12      ARG  62  -5.520   0.783  -5.674
  463   1HH2  ARG  62          HH21      ARG  62  -5.742   1.719  -9.172
  464   2HH2  ARG  62          HH22      ARG  62  -6.565   0.920  -7.889
  465    H    TYR  63           H        TYR  63   1.978   0.713  -9.510
  466    HA   TYR  63           HA       TYR  63   3.817   0.829  -7.418
  467   1HB   TYR  63          HB2       TYR  63   5.471   1.381  -9.135
  468   2HB   TYR  63          HB1       TYR  63   4.378   0.131  -9.714
  469    HD1  TYR  63           HD1      TYR  63   2.598   0.738 -11.392
  470    HD2  TYR  63           HD2      TYR  63   5.648   3.479 -10.250
  471    HE1  TYR  63           HE1      TYR  63   2.126   2.097 -13.386
  472    HE2  TYR  63           HE2      TYR  63   5.177   4.838 -12.241
  473    HH   TYR  63           HH       TYR  63   2.405   4.363 -14.141
  474    H    ASP  64           H        ASP  64   1.963   3.305  -8.957
  475    HA   ASP  64           HA       ASP  64   3.295   5.675  -8.524
  476   1HB   ASP  64          HB2       ASP  64   0.377   5.115  -8.061
  477   2HB   ASP  64          HB1       ASP  64   1.088   6.709  -8.129
  478    H    ALA  65           H        ALA  65   1.380   3.856  -6.217
  479    HA   ALA  65           HA       ALA  65   1.175   5.883  -4.358
  480   1HB   ALA  65          HB1       ALA  65   1.004   2.919  -4.019
  481   2HB   ALA  65          HB2       ALA  65  -0.321   4.051  -4.293
  482   3HB   ALA  65          HB3       ALA  65   0.565   4.082  -2.774
  483    H    LEU  66           H        LEU  66   3.819   3.799  -5.025
  484    HA   LEU  66           HA       LEU  66   5.166   4.246  -2.506
  485   1HB   LEU  66          HB2       LEU  66   6.237   3.109  -5.055
  486   2HB   LEU  66          HB1       LEU  66   7.057   3.073  -3.508
  487    HG   LEU  66           HG       LEU  66   6.262   0.929  -3.737
  488   1HD1  LEU  66          HD11      LEU  66   4.492   0.616  -2.113
  489   2HD1  LEU  66          HD12      LEU  66   4.088   2.327  -2.238
  490   3HD1  LEU  66          HD13      LEU  66   5.656   1.838  -1.573
  491   1HD2  LEU  66          HD21      LEU  66   4.924   1.297  -5.702
  492   2HD2  LEU  66          HD22      LEU  66   3.666   2.054  -4.737
  493   3HD2  LEU  66          HD23      LEU  66   4.028   0.332  -4.526
  494    H    SER  67           H        SER  67   5.214   5.461  -5.772
  495    HA   SER  67           HA       SER  67   7.634   6.996  -5.590
  496   1HB   SER  67          HB2       SER  67   5.269   6.757  -7.320
  497   2HB   SER  67          HB1       SER  67   6.454   8.016  -7.668
  498    HG   SER  67           HG       SER  67   7.227   6.303  -8.798
  499    H    GLU  68           H        GLU  68   4.241   7.633  -5.457
  500    HA   GLU  68           HA       GLU  68   4.576  10.399  -4.860
  501   1HB   GLU  68          HB2       GLU  68   2.003   9.096  -4.182
  502   2HB   GLU  68          HB1       GLU  68   2.365  10.608  -5.001
  503   1HG   GLU  68          HG2       GLU  68   3.150   9.265  -6.979
  504   2HG   GLU  68          HG1       GLU  68   2.566   7.884  -6.150
  505    H    HIS  69           H        HIS  69   4.592   7.557  -3.156
  506    HA   HIS  69           HA       HIS  69   3.528   8.079  -0.657
  507   1HB   HIS  69          HB2       HIS  69   4.645   5.971  -1.556
  508   2HB   HIS  69          HB1       HIS  69   6.131   6.658  -0.882
  509    HD1  HIS  69           HD1      HIS  69   2.705   5.494   0.199
  510    HD2  HIS  69           HD2      HIS  69   6.467   6.254   1.652
  511    HE1  HIS  69           HE1      HIS  69   2.667   4.673   2.588
  512    H    ASN  70           H        ASN  70   7.020   8.587  -1.408
  513    HA   ASN  70           HA       ASN  70   7.447  10.146   0.953
  514   1HB   ASN  70          HB2       ASN  70   9.657  10.641  -0.073
  515   2HB   ASN  70          HB1       ASN  70   9.312   8.927   0.094
  516   1HD2  ASN  70          HD21      ASN  70  11.183   9.992  -1.470
  517   2HD2  ASN  70          HD22      ASN  70  10.816   9.644  -3.153
  518    H    LEU  71           H        LEU  71   6.051  10.868  -1.899
  519    HA   LEU  71           HA       LEU  71   6.673  13.679  -1.917
  520   1HB   LEU  71          HB2       LEU  71   6.140  12.969  -4.059
  521   2HB   LEU  71          HB1       LEU  71   4.969  11.814  -3.477
  522    HG   LEU  71           HG       LEU  71   3.341  13.563  -3.186
  523   1HD1  LEU  71          HD11      LEU  71   3.752  15.843  -4.033
  524   2HD1  LEU  71          HD12      LEU  71   5.412  15.406  -4.429
  525   3HD1  LEU  71          HD13      LEU  71   4.894  15.463  -2.744
  526   1HD2  LEU  71          HD21      LEU  71   4.584  13.568  -5.923
  527   2HD2  LEU  71          HD22      LEU  71   2.939  14.068  -5.544
  528   3HD2  LEU  71          HD23      LEU  71   3.433  12.395  -5.289
  529    H    LYS  72           H        LYS  72   3.874  11.703  -1.058
  530    HA   LYS  72           HA       LYS  72   2.762  14.035   0.306
  531   1HB   LYS  72          HB2       LYS  72   0.627  12.339   0.063
  532   2HB   LYS  72          HB1       LYS  72   0.959  13.701  -1.027
  533   1HG   LYS  72          HG2       LYS  72   2.317  11.963  -2.337
  534   2HG   LYS  72          HG1       LYS  72   1.527  10.753  -1.374
  535   1HD   LYS  72          HD2       LYS  72   0.214  12.743  -3.226
  536   2HD   LYS  72          HD1       LYS  72   0.395  11.011  -3.481
  537   1HE   LYS  72          HE2       LYS  72  -1.035  10.661  -1.444
  538   2HE   LYS  72          HE1       LYS  72  -1.303  12.397  -1.426
  539   1HZ   LYS  72          HZ1       LYS  72  -2.267  12.240  -3.638
  540   2HZ   LYS  72          HZ2       LYS  72  -3.105  11.259  -2.566
  541   3HZ   LYS  72          HZ3       LYS  72  -2.030  10.579  -3.659
  542    H    TYR  73           H        TYR  73   3.314  10.670   0.732
  543    HA   TYR  73           HA       TYR  73   2.094  10.551   3.347
  544   1HB   TYR  73          HB2       TYR  73   3.701   8.590   1.748
  545   2HB   TYR  73          HB1       TYR  73   3.043   8.190   3.337
  546    HD1  TYR  73           HD1      TYR  73   1.179   6.838   3.204
  547    HD2  TYR  73           HD2      TYR  73   1.792   9.725   0.160
  548    HE1  TYR  73           HE1      TYR  73  -0.894   6.118   2.064
  549    HE2  TYR  73           HE2      TYR  73  -0.235   9.006  -0.948
  550    HH   TYR  73           HH       TYR  73  -2.417   6.905   0.642
  551    H    HIS  74           H        HIS  74   5.428  10.046   2.085
  552    HA   HIS  74           HA       HIS  74   6.437  10.877   4.757
  553   1HB   HIS  74          HB2       HIS  74   7.779   9.116   2.678
  554   2HB   HIS  74          HB1       HIS  74   8.540   9.590   4.186
  555    HD1  HIS  74           HD1      HIS  74   6.020   8.734   6.047
  556    HD2  HIS  74           HD2      HIS  74   7.775   6.503   3.029
  557    HE1  HIS  74           HE1      HIS  74   5.392   6.349   6.513
  558    HA   PRO  75           HA       PRO  75   7.678  14.042   1.528
  559   1HB   PRO  75          HB2       PRO  75   6.851  16.242   2.793
  560   2HB   PRO  75          HB1       PRO  75   5.705  15.203   1.928
  561   1HG   PRO  75          HG2       PRO  75   6.357  15.218   4.869
  562   2HG   PRO  75          HG1       PRO  75   4.754  15.248   4.098
  563   1HD   PRO  75          HD2       PRO  75   5.847  12.954   5.013
  564   2HD   PRO  75          HD1       PRO  75   4.853  13.031   3.544
  565    H    GLY  76           H        GLY  76   9.385  15.440   1.485
  566   1HA   GLY  76          HA2       GLY  76  10.757  16.852   3.215
  567   2HA   GLY  76          HA1       GLY  76  11.201  15.245   3.777
  568    H    GLU  77           H        GLU  77  11.397  13.954   1.309
  569    HA   GLU  77           HA       GLU  77  13.153  15.366  -0.453
  570   1HB   GLU  77          HB2       GLU  77  15.073  13.848  -0.101
  571   2HB   GLU  77          HB1       GLU  77  14.739  14.777   1.349
  572   1HG   GLU  77          HG2       GLU  77  14.982  12.774   2.365
  573   2HG   GLU  77          HG1       GLU  77  13.314  12.554   1.825
  574    H    GLU  78           H        GLU  78  13.924  13.560  -2.130
  575    HA   GLU  78           HA       GLU  78  11.760  11.592  -2.260
  576   1HB   GLU  78          HB2       GLU  78  11.176  13.599  -3.601
  577   2HB   GLU  78          HB1       GLU  78  12.675  13.358  -4.488
  578   1HG   GLU  78          HG2       GLU  78  11.846  11.233  -5.314
  579   2HG   GLU  78          HG1       GLU  78  10.326  11.480  -4.443
  580    H    ASN  79           H        ASN  79  13.327  10.033  -1.671
  581    HA   ASN  79           HA       ASN  79  14.986   9.071  -3.875
  582   1HB   ASN  79          HB2       ASN  79  15.947   9.709  -1.114
  583   2HB   ASN  79          HB1       ASN  79  16.944   8.817  -2.288
  584   1HD2  ASN  79          HD21      ASN  79  15.726  11.761  -1.215
  585   2HD2  ASN  79          HD22      ASN  79  16.453  12.877  -2.316
  586    H    PHE  80           H        PHE  80  13.661   7.270  -3.935
  587    HA   PHE  80           HA       PHE  80  13.519   5.629  -1.521
  588   1HB   PHE  80          HB2       PHE  80  11.741   6.052  -3.802
  589   2HB   PHE  80          HB1       PHE  80  12.033   4.356  -3.479
  590    HD1  PHE  80           HD1      PHE  80  11.595   3.559  -1.078
  591    HD2  PHE  80           HD2      PHE  80  10.136   7.234  -2.582
  592    HE1  PHE  80           HE1      PHE  80   9.791   3.518   0.587
  593    HE2  PHE  80           HE2      PHE  80   8.346   7.214  -0.866
  594    HZ   PHE  80           HZ       PHE  80   8.168   5.345   0.686
  595    H    LYS  81           H        LYS  81  14.139   3.445  -1.613
  596    HA   LYS  81           HA       LYS  81  15.950   2.756  -3.815
  597   1HB   LYS  81          HB2       LYS  81  17.451   1.909  -2.254
  598   2HB   LYS  81          HB1       LYS  81  16.618   3.073  -1.224
  599   1HG   LYS  81          HG2       LYS  81  15.218   1.390  -0.300
  600   2HG   LYS  81          HG1       LYS  81  15.815   0.199  -1.443
  601   1HD   LYS  81          HD2       LYS  81  18.114   0.688  -0.413
  602   2HD   LYS  81          HD1       LYS  81  17.154   1.432   0.883
  603   1HE   LYS  81          HE2       LYS  81  15.909  -0.632   1.196
  604   2HE   LYS  81          HE1       LYS  81  16.800  -1.365  -0.135
  605   1HZ   LYS  81          HZ1       LYS  81  18.818  -1.232   1.156
  606   2HZ   LYS  81          HZ2       LYS  81  17.669  -2.047   2.049
  607   3HZ   LYS  81          HZ3       LYS  81  18.030  -0.442   2.418
  608    H    LEU  82           H        LEU  82  15.988   0.253  -4.073
  609    HA   LEU  82           HA       LEU  82  13.404  -0.845  -3.332
  610   1HB   LEU  82          HB2       LEU  82  13.207  -2.021  -5.479
  611   2HB   LEU  82          HB1       LEU  82  13.137  -0.288  -5.669
  612    HG   LEU  82           HG       LEU  82  15.701  -1.768  -6.139
  613   1HD1  LEU  82          HD11      LEU  82  13.943  -2.853  -7.517
  614   2HD1  LEU  82          HD12      LEU  82  15.052  -1.925  -8.525
  615   3HD1  LEU  82          HD13      LEU  82  13.459  -1.272  -8.137
  616   1HD2  LEU  82          HD21      LEU  82  15.748   0.688  -6.033
  617   2HD2  LEU  82          HD22      LEU  82  14.549   0.764  -7.327
  618   3HD2  LEU  82          HD23      LEU  82  16.149   0.102  -7.646
  619    H    THR  83           H        THR  83  13.405  -2.831  -2.584
  620    HA   THR  83           HA       THR  83  15.735  -4.482  -2.915
  621    HB   THR  83           HB       THR  83  16.256  -3.371  -0.876
  622    HG1  THR  83           HG1      THR  83  15.531  -5.235   0.706
  623   1HG2  THR  83          HG21      THR  83  14.739  -3.134   1.044
  624   2HG2  THR  83          HG22      THR  83  13.483  -3.981   0.147
  625   3HG2  THR  83          HG23      THR  83  14.030  -2.399  -0.403
  626    H    MET  84           H        MET  84  14.902  -6.563  -3.389
  627    HA   MET  84           HA       MET  84  11.985  -6.819  -2.984
  628   1HB   MET  84          HB2       MET  84  12.917  -7.161  -5.257
  629   2HB   MET  84          HB1       MET  84  13.949  -8.416  -4.600
  630   1HG   MET  84          HG2       MET  84  11.981  -9.782  -4.102
  631   2HG   MET  84          HG1       MET  84  10.945  -8.524  -4.793
  632   1HE   MET  84          HE1       MET  84  10.948 -11.614  -5.877
  633   2HE   MET  84          HE2       MET  84  10.829 -11.281  -7.604
  634   3HE   MET  84          HE3       MET  84   9.888 -10.332  -6.456
  635    H    VAL  85           H        VAL  85  11.763  -7.508  -0.960
  636    HA   VAL  85           HA       VAL  85  12.570 -10.208  -0.435
  637    HB   VAL  85           HB       VAL  85  13.068  -9.398   2.062
  638   1HG1  VAL  85          HG11      VAL  85  15.475  -9.243   1.528
  639   2HG1  VAL  85          HG12      VAL  85  15.055  -9.070  -0.183
  640   3HG1  VAL  85          HG13      VAL  85  14.692 -10.570   0.664
  641   1HG2  VAL  85          HG21      VAL  85  13.849  -6.959   0.440
  642   2HG2  VAL  85          HG22      VAL  85  14.256  -7.231   2.133
  643   3HG2  VAL  85          HG23      VAL  85  12.568  -7.018   1.652
  644    H    LYS  86           H        LYS  86  10.459 -11.041  -0.207
  645    HA   LYS  86           HA       LYS  86   8.951  -9.715   1.882
  646   1HB   LYS  86          HB2       LYS  86   8.147  -8.977  -0.487
  647   2HB   LYS  86          HB1       LYS  86   7.462 -10.614  -0.536
  648   1HG   LYS  86          HG2       LYS  86   5.797  -9.091   0.054
  649   2HG   LYS  86          HG1       LYS  86   6.150 -10.133   1.417
  650   1HD   LYS  86          HD2       LYS  86   7.344  -8.474   2.602
  651   2HD   LYS  86          HD1       LYS  86   7.594  -7.503   1.162
  652   1HE   LYS  86          HE2       LYS  86   5.377  -6.651   1.246
  653   2HE   LYS  86          HE1       LYS  86   4.866  -7.859   2.439
  654   1HZ   LYS  86          HZ1       LYS  86   6.431  -6.806   3.963
  655   2HZ   LYS  86          HZ2       LYS  86   5.257  -5.714   3.392
  656   3HZ   LYS  86          HZ3       LYS  86   6.856  -5.707   2.761
  657    H    ARG  87           H        ARG  87   8.443 -11.161   3.316
  658    HA   ARG  87           HA       ARG  87   8.577 -13.909   2.373
  659   1HB   ARG  87          HB2       ARG  87   9.302 -12.829   5.110
  660   2HB   ARG  87          HB1       ARG  87   9.352 -14.521   4.641
  661   1HG   ARG  87          HG2       ARG  87  11.608 -13.833   4.461
  662   2HG   ARG  87          HG1       ARG  87  10.992 -13.771   2.810
  663   1HD   ARG  87          HD2       ARG  87  12.331 -11.797   3.228
  664   2HD   ARG  87          HD1       ARG  87  10.644 -11.352   3.017
  665    HE   ARG  87           HE       ARG  87  11.377 -11.742   5.754
  666   1HH1  ARG  87          HH11      ARG  87  11.214  -9.248   3.165
  667   2HH1  ARG  87          HH12      ARG  87  11.373  -7.965   4.238
  668   1HH2  ARG  87          HH21      ARG  87  11.523  -9.921   7.190
  669   2HH2  ARG  87          HH22      ARG  87  11.566  -8.336   6.582
  670    H    ASN  88           H        ASN  88   7.149 -15.409   3.124
  671    HA   ASN  88           HA       ASN  88   5.189 -16.307   3.757
  672   1HB   ASN  88          HB2       ASN  88   5.904 -15.609   6.023
  673   2HB   ASN  88          HB1       ASN  88   5.115 -14.054   5.800
  674   1HD2  ASN  88          HD21      ASN  88   3.708 -17.186   4.816
  675   2HD2  ASN  88          HD22      ASN  88   2.439 -17.137   5.973
  676    H    ASN  89           H        ASN  89   5.261 -14.359   1.682
  677    HA   ASN  89           HA       ASN  89   2.401 -13.869   1.452
  678   1HB   ASN  89          HB2       ASN  89   4.454 -11.649   1.122
  679   2HB   ASN  89          HB1       ASN  89   2.830 -11.552   0.470
  680   1HD2  ASN  89          HD21      ASN  89   4.815 -11.416   3.302
  681   2HD2  ASN  89          HD22      ASN  89   3.570 -10.867   4.372
  682    H    GLN  90           H        GLN  90   4.935 -12.433  -0.458
  683    HA   GLN  90           HA       GLN  90   5.233 -14.465  -2.365
  684   1HB   GLN  90          HB2       GLN  90   4.464 -13.212  -4.251
  685   2HB   GLN  90          HB1       GLN  90   3.070 -13.404  -3.172
  686   1HG   GLN  90          HG2       GLN  90   4.726 -10.940  -3.144
  687   2HG   GLN  90          HG1       GLN  90   3.592 -11.180  -4.463
  688   1HE2  GLN  90          HE21      GLN  90   4.004 -10.396  -1.173
  689   2HE2  GLN  90          HE22      GLN  90   2.349 -10.019  -0.816
  690    H    THR  91           H        THR  91   6.875 -13.480  -3.955
  691    HA   THR  91           HA       THR  91   8.291 -11.520  -2.411
  692    HB   THR  91           HB       THR  91  10.184 -12.012  -4.064
  693    HG1  THR  91           HG1      THR  91   9.391 -14.539  -4.488
  694   1HG2  THR  91          HG21      THR  91  10.215 -12.774  -1.713
  695   2HG2  THR  91          HG22      THR  91  10.879 -14.013  -2.759
  696   3HG2  THR  91          HG23      THR  91   9.240 -14.166  -2.152
  697    H    ILE  92           H        ILE  92   8.092  -9.611  -2.759
  698    HA   ILE  92           HA       ILE  92   7.581  -8.476  -5.320
  699    HB   ILE  92           HB       ILE  92   5.988  -6.846  -4.115
  700   1HG1  ILE  92          HG12      ILE  92   4.664  -8.126  -2.287
  701   2HG1  ILE  92          HG11      ILE  92   6.152  -9.042  -2.161
  702   1HG2  ILE  92          HG21      ILE  92   5.154  -8.305  -5.784
  703   2HG2  ILE  92          HG22      ILE  92   4.041  -8.315  -4.408
  704   3HG2  ILE  92          HG23      ILE  92   5.155  -9.663  -4.663
  705   1HD1  ILE  92          HD11      ILE  92   7.441  -7.120  -1.647
  706   2HD1  ILE  92          HD12      ILE  92   6.061  -7.164  -0.558
  707   3HD1  ILE  92          HD13      ILE  92   6.080  -6.057  -1.927
  708    H    PHE  93           H        PHE  93   7.985  -6.070  -5.250
  709    HA   PHE  93           HA       PHE  93  10.673  -5.919  -4.133
  710   1HB   PHE  93          HB2       PHE  93   9.125  -4.106  -5.974
  711   2HB   PHE  93          HB1       PHE  93  10.815  -3.904  -5.583
  712    HD1  PHE  93           HD1      PHE  93  12.453  -5.419  -6.509
  713    HD2  PHE  93           HD2      PHE  93   8.340  -5.740  -7.534
  714    HE1  PHE  93           HE1      PHE  93  13.054  -6.810  -8.465
  715    HE2  PHE  93           HE2      PHE  93   8.922  -7.131  -9.478
  716    HZ   PHE  93           HZ       PHE  93  11.288  -7.666  -9.944
  717    H    GLU  94           H        GLU  94  11.009  -4.828  -2.286
  718    HA   GLU  94           HA       GLU  94   8.922  -3.132  -1.253
  719   1HB   GLU  94          HB2       GLU  94  11.446  -4.112   0.122
  720   2HB   GLU  94          HB1       GLU  94  10.080  -3.302   0.858
  721   1HG   GLU  94          HG2       GLU  94   8.819  -5.379  -0.168
  722   2HG   GLU  94          HG1       GLU  94  10.394  -6.132   0.123
  723    H    GLN  95           H        GLN  95   9.304  -1.046  -0.838
  724    HA   GLN  95           HA       GLN  95  11.755   0.033  -2.026
  725   1HB   GLN  95          HB2       GLN  95   9.455   0.266  -3.234
  726   2HB   GLN  95          HB1       GLN  95   9.109   1.469  -1.995
  727   1HG   GLN  95          HG2       GLN  95  10.960   2.789  -2.673
  728   2HG   GLN  95          HG1       GLN  95  11.513   1.524  -3.767
  729   1HE2  GLN  95          HE21      GLN  95   9.247   4.102  -3.233
  730   2HE2  GLN  95          HE22      GLN  95   8.684   4.180  -4.862
  731    H    THR  96           H        THR  96  13.001   0.927  -0.500
  732    HA   THR  96           HA       THR  96  11.764   1.990   1.982
  733    HB   THR  96           HB       THR  96  14.612   1.515   2.152
  734    HG1  THR  96           HG1      THR  96  12.931  -0.420   1.050
  735   1HG2  THR  96          HG21      THR  96  12.199   0.296   3.536
  736   2HG2  THR  96          HG22      THR  96  13.108   1.668   4.107
  737   3HG2  THR  96          HG23      THR  96  13.860   0.066   4.054
  738    H    ILE  97           H        ILE  97  12.925   3.858   2.962
  739    HA   ILE  97           HA       ILE  97  14.104   5.615   0.872
  740    HB   ILE  97           HB       ILE  97  12.985   6.592   3.517
  741   1HG1  ILE  97          HG12      ILE  97  11.400   6.536   0.997
  742   2HG1  ILE  97          HG11      ILE  97  11.395   5.100   2.005
  743   1HG2  ILE  97          HG21      ILE  97  12.736   8.633   2.265
  744   2HG2  ILE  97          HG22      ILE  97  13.166   7.836   0.756
  745   3HG2  ILE  97          HG23      ILE  97  14.380   8.064   2.005
  746   1HD1  ILE  97          HD11      ILE  97  10.639   6.716   3.860
  747   2HD1  ILE  97          HD12      ILE  97   9.565   6.145   2.625
  748   3HD1  ILE  97          HD13      ILE  97  10.182   7.789   2.500
  749    H    ASN  98           H        ASN  98  15.838   6.929   1.486
  750    HA   ASN  98           HA       ASN  98  17.576   5.690   3.482
  751   1HB   ASN  98          HB2       ASN  98  19.341   7.084   2.266
  752   2HB   ASN  98          HB1       ASN  98  18.635   5.754   1.347
  753   1HD2  ASN  98          HD21      ASN  98  17.079   8.922   1.920
  754   2HD2  ASN  98          HD22      ASN  98  17.105   9.398   0.301
  755    H    ASP  99           H        ASP  99  15.366   7.870   3.767
  756    HA   ASP  99           HA       ASP  99  16.916   9.660   5.494
  757   1HB   ASP  99          HB2       ASP  99  16.873  10.527   3.124
  758   2HB   ASP  99          HB1       ASP  99  15.163  10.738   3.329
  759    H    LEU 100           H        LEU 100  13.814   9.414   3.852
  760    HA   LEU 100           HA       LEU 100  12.226  10.361   6.063
  761   1HB   LEU 100          HB2       LEU 100  11.231   9.015   3.535
  762   2HB   LEU 100          HB1       LEU 100  10.438  10.158   4.577
  763    HG   LEU 100           HG       LEU 100  12.898  11.118   3.289
  764   1HD1  LEU 100          HD11      LEU 100  11.407  11.740   1.317
  765   2HD1  LEU 100          HD12      LEU 100  10.374  10.386   1.833
  766   3HD1  LEU 100          HD13      LEU 100  12.062  10.130   1.376
  767   1HD2  LEU 100          HD21      LEU 100  10.169  12.278   3.664
  768   2HD2  LEU 100          HD22      LEU 100  11.612  13.127   3.150
  769   3HD2  LEU 100          HD23      LEU 100  11.507  12.485   4.805
  770    H    THR 101           H        THR 101  13.827   7.838   6.103
  771    HA   THR 101           HA       THR 101  12.413   5.463   6.144
  772    HB   THR 101           HB       THR 101  14.690   6.196   7.961
  773    HG1  THR 101           HG1      THR 101  15.036   5.447   5.272
  774   1HG2  THR 101          HG21      THR 101  13.821   3.883   8.009
  775   2HG2  THR 101          HG22      THR 101  15.462   3.957   7.367
  776   3HG2  THR 101          HG23      THR 101  14.092   3.767   6.271
  777    H    PHE 102           H        PHE 102  12.711   8.065   8.490
  778    HA   PHE 102           HA       PHE 102  11.176   6.498  10.455
  779   1HB   PHE 102          HB2       PHE 102  13.043   8.818  10.942
  780   2HB   PHE 102          HB1       PHE 102  12.177   7.917  12.180
  781    HD1  PHE 102           HD1      PHE 102  15.090   8.070  10.084
  782    HD2  PHE 102           HD2      PHE 102  12.763   5.531  12.558
  783    HE1  PHE 102           HE1      PHE 102  16.975   6.512  10.237
  784    HE2  PHE 102           HE2      PHE 102  14.648   3.956  12.727
  785    HZ   PHE 102           HZ       PHE 102  16.757   4.447  11.562
  Start of MODEL    4
    1    HA   MET   1           HA       MET   1 -31.962  14.171   1.060
    2   1HB   MET   1          HB2       MET   1 -33.508  14.252   3.030
    3   2HB   MET   1          HB1       MET   1 -32.841  12.665   2.730
    4   1HG   MET   1          HG2       MET   1 -31.208  13.095   4.566
    5   2HG   MET   1          HG1       MET   1 -32.060  14.603   4.894
    6   1HE   MET   1          HE1       MET   1 -32.443  13.912   7.412
    7   2HE   MET   1          HE2       MET   1 -31.543  12.426   7.108
    8   3HE   MET   1          HE3       MET   1 -33.112  12.357   7.907
    9    H    ALA   2           H        ALA   2 -30.607  15.642   4.089
   10    HA   ALA   2           HA       ALA   2 -31.498  18.175   2.997
   11   1HB   ALA   2          HB1       ALA   2 -32.245  17.604   5.269
   12   2HB   ALA   2          HB2       ALA   2 -31.245  19.056   5.238
   13   3HB   ALA   2          HB3       ALA   2 -30.561  17.526   5.786
   14    H    HIS   3           H        HIS   3 -28.730  17.462   5.139
   15    HA   HIS   3           HA       HIS   3 -27.216  19.280   3.479
   16   1HB   HIS   3          HB2       HIS   3 -25.469  19.305   5.172
   17   2HB   HIS   3          HB1       HIS   3 -27.029  19.523   5.940
   18    HD1  HIS   3           HD1      HIS   3 -23.981  18.016   6.661
   19    HD2  HIS   3           HD2      HIS   3 -27.907  16.673   6.838
   20    HE1  HIS   3           HE1      HIS   3 -23.986  16.101   8.284
   21    H    HIS   4           H        HIS   4 -27.314  15.875   4.134
   22    HA   HIS   4           HA       HIS   4 -24.989  15.399   2.496
   23   1HB   HIS   4          HB2       HIS   4 -27.042  13.481   3.635
   24   2HB   HIS   4          HB1       HIS   4 -25.682  12.981   2.653
   25    HD1  HIS   4           HD1      HIS   4 -26.231  12.062   5.680
   26    HD2  HIS   4           HD2      HIS   4 -23.541  14.965   4.393
   27    HE1  HIS   4           HE1      HIS   4 -24.452  12.187   7.433
   28    H    HIS   5           H        HIS   5 -25.375  16.147   0.546
   29    HA   HIS   5           HA       HIS   5 -27.329  14.661  -0.983
   30   1HB   HIS   5          HB2       HIS   5 -28.071  16.716  -2.234
   31   2HB   HIS   5          HB1       HIS   5 -28.603  16.643  -0.565
   32    HD1  HIS   5           HD1      HIS   5 -28.146  18.719   0.823
   33    HD2  HIS   5           HD2      HIS   5 -25.875  18.590  -2.661
   34    HE1  HIS   5           HE1      HIS   5 -26.965  20.918   0.681
   35    H    HIS   6           H        HIS   6 -24.438  16.612  -0.926
   36    HA   HIS   6           HA       HIS   6 -23.846  15.705  -3.617
   37   1HB   HIS   6          HB2       HIS   6 -23.524  18.096  -3.271
   38   2HB   HIS   6          HB1       HIS   6 -22.506  17.794  -1.875
   39    HD1  HIS   6           HD1      HIS   6 -22.433  17.552  -5.671
   40    HD2  HIS   6           HD2      HIS   6 -19.857  17.356  -2.415
   41    HE1  HIS   6           HE1      HIS   6 -20.103  17.578  -6.615
   42    H    HIS   7           H        HIS   7 -23.314  13.601  -3.305
   43    HA   HIS   7           HA       HIS   7 -20.846  13.199  -1.803
   44   1HB   HIS   7          HB2       HIS   7 -23.054  11.210  -2.409
   45   2HB   HIS   7          HB1       HIS   7 -21.465  10.733  -1.843
   46    HD1  HIS   7           HD1      HIS   7 -21.430  10.307   0.616
   47    HD2  HIS   7           HD2      HIS   7 -24.210  13.222  -0.421
   48    HE1  HIS   7           HE1      HIS   7 -22.604  10.950   2.747
   49    H    HIS   8           H        HIS   8 -19.324  13.482  -3.209
   50    HA   HIS   8           HA       HIS   8 -19.639  12.516  -5.949
   51   1HB   HIS   8          HB2       HIS   8 -18.763  14.841  -5.448
   52   2HB   HIS   8          HB1       HIS   8 -17.343  14.087  -4.736
   53    HD1  HIS   8           HD1      HIS   8 -15.537  13.151  -6.417
   54    HD2  HIS   8           HD2      HIS   8 -18.946  14.700  -8.220
   55    HE1  HIS   8           HE1      HIS   8 -15.018  13.302  -8.851
   56    H    ASN   9           H        ASN   9 -18.428  11.642  -2.975
   57    HA   ASN   9           HA       ASN   9 -17.339   9.892  -2.134
   58   1HB   ASN   9          HB2       ASN   9 -16.716   9.031  -4.988
   59   2HB   ASN   9          HB1       ASN   9 -16.232   8.128  -3.557
   60   1HD2  ASN   9          HD21      ASN   9 -17.906   7.347  -5.784
   61   2HD2  ASN   9          HD22      ASN   9 -19.427   6.894  -5.101
   62    H    GLN  10           H        GLN  10 -15.709  10.436  -1.035
   63    HA   GLN  10           HA       GLN  10 -13.790  12.274  -2.073
   64   1HB   GLN  10          HB2       GLN  10 -13.717  10.776   0.550
   65   2HB   GLN  10          HB1       GLN  10 -12.791  12.211   0.145
   66   1HG   GLN  10          HG2       GLN  10 -15.783  12.043   0.433
   67   2HG   GLN  10          HG1       GLN  10 -14.664  12.741   1.594
   68   1HE2  GLN  10          HE21      GLN  10 -13.023  14.116  -0.438
   69   2HE2  GLN  10          HE22      GLN  10 -14.027  15.401  -1.003
   70    H    GLN  11           H        GLN  11 -13.978   8.912  -1.484
   71    HA   GLN  11           HA       GLN  11 -11.250   8.210  -1.605
   72   1HB   GLN  11          HB2       GLN  11 -13.561   6.447  -2.444
   73   2HB   GLN  11          HB1       GLN  11 -11.980   5.931  -1.901
   74   1HG   GLN  11          HG2       GLN  11 -13.386   5.468  -0.102
   75   2HG   GLN  11          HG1       GLN  11 -12.632   6.995   0.352
   76   1HE2  GLN  11          HE21      GLN  11 -15.571   5.460  -0.728
   77   2HE2  GLN  11          HE22      GLN  11 -16.623   6.759  -0.304
   78    H    ASN  12           H        ASN  12 -10.065   8.717  -3.324
   79    HA   ASN  12           HA       ASN  12 -11.126   8.707  -5.997
   80   1HB   ASN  12          HB2       ASN  12  -8.380   9.187  -4.872
   81   2HB   ASN  12          HB1       ASN  12  -8.647   9.082  -6.604
   82   1HD2  ASN  12          HD21      ASN  12  -9.159  10.907  -3.737
   83   2HD2  ASN  12          HD22      ASN  12  -9.711  12.358  -4.508
   84    H    LYS  13           H        LYS  13  -9.570   7.638  -7.680
   85    HA   LYS  13           HA       LYS  13  -9.497   4.794  -7.069
   86   1HB   LYS  13          HB2       LYS  13  -9.062   4.439  -9.446
   87   2HB   LYS  13          HB1       LYS  13 -10.440   5.503  -9.241
   88   1HG   LYS  13          HG2       LYS  13  -8.994   7.432  -9.753
   89   2HG   LYS  13          HG1       LYS  13  -7.648   6.321  -9.994
   90   1HD   LYS  13          HD2       LYS  13  -8.864   5.218 -11.796
   91   2HD   LYS  13          HD1       LYS  13 -10.232   6.304 -11.542
   92   1HE   LYS  13          HE2       LYS  13  -7.452   7.121 -12.376
   93   2HE   LYS  13          HE1       LYS  13  -8.853   7.009 -13.433
   94   1HZ   LYS  13          HZ1       LYS  13  -8.619   8.856 -11.112
   95   2HZ   LYS  13          HZ2       LYS  13  -9.913   8.783 -12.197
   96   3HZ   LYS  13          HZ3       LYS  13  -8.393   9.267 -12.719
   97    H    LYS  14           H        LYS  14  -7.579   7.314  -6.654
   98    HA   LYS  14           HA       LYS  14  -5.103   5.837  -7.041
   99   1HB   LYS  14          HB2       LYS  14  -5.776   8.718  -6.917
  100   2HB   LYS  14          HB1       LYS  14  -4.171   8.250  -6.381
  101   1HG   LYS  14          HG2       LYS  14  -5.349   7.546  -9.050
  102   2HG   LYS  14          HG1       LYS  14  -4.311   8.950  -8.754
  103   1HD   LYS  14          HD2       LYS  14  -3.457   6.174  -8.018
  104   2HD   LYS  14          HD1       LYS  14  -3.164   6.821  -9.653
  105   1HE   LYS  14          HE2       LYS  14  -2.202   7.911  -6.999
  106   2HE   LYS  14          HE1       LYS  14  -1.241   7.024  -8.170
  107   1HZ   LYS  14          HZ1       LYS  14  -1.527   8.831  -9.736
  108   2HZ   LYS  14          HZ2       LYS  14  -0.846   9.379  -8.287
  109   3HZ   LYS  14          HZ3       LYS  14  -2.447   9.709  -8.614
  110    H    VAL  15           H        VAL  15  -3.582   7.239  -5.122
  111    HA   VAL  15           HA       VAL  15  -4.610   5.828  -2.823
  112    HB   VAL  15           HB       VAL  15  -2.352   5.453  -4.020
  113   1HG1  VAL  15          HG11      VAL  15  -0.436   6.700  -3.071
  114   2HG1  VAL  15          HG12      VAL  15  -1.628   7.831  -2.399
  115   3HG1  VAL  15          HG13      VAL  15  -1.505   7.623  -4.143
  116   1HG2  VAL  15          HG21      VAL  15  -1.258   4.735  -1.912
  117   2HG2  VAL  15          HG22      VAL  15  -2.961   4.267  -1.993
  118   3HG2  VAL  15          HG23      VAL  15  -2.467   5.642  -1.014
  119    H    GLU  16           H        GLU  16  -5.072   6.955  -0.952
  120    HA   GLU  16           HA       GLU  16  -5.225   9.809  -1.367
  121   1HB   GLU  16          HB2       GLU  16  -6.633   8.083   0.646
  122   2HB   GLU  16          HB1       GLU  16  -6.977   9.781   0.303
  123   1HG   GLU  16          HG2       GLU  16  -7.068   7.632  -1.741
  124   2HG   GLU  16          HG1       GLU  16  -8.502   8.089  -0.800
  125    H    GLY  17           H        GLY  17  -5.059   8.166   1.776
  126   1HA   GLY  17          HA2       GLY  17  -2.470   9.420   2.205
  127   2HA   GLY  17          HA1       GLY  17  -3.787   9.970   3.249
  128    H    GLY  18           H        GLY  18  -4.322   6.814   2.598
  129   1HA   GLY  18          HA2       GLY  18  -2.893   6.045   5.038
  130   2HA   GLY  18          HA1       GLY  18  -4.441   5.381   4.514
  131    H    TYR  19           H        TYR  19  -3.701   3.292   4.664
  132    HA   TYR  19           HA       TYR  19  -1.687   2.443   2.653
  133   1HB   TYR  19          HB2       TYR  19  -2.570   0.928   5.067
  134   2HB   TYR  19          HB1       TYR  19  -1.118   0.683   4.098
  135    HD1  TYR  19           HD1      TYR  19   0.353   3.049   4.040
  136    HD2  TYR  19           HD2      TYR  19  -2.170   1.663   7.163
  137    HE1  TYR  19           HE1      TYR  19   1.550   4.479   5.644
  138    HE2  TYR  19           HE2      TYR  19  -1.016   3.042   8.751
  139    HH   TYR  19           HH       TYR  19   0.893   5.564   7.852
  140    H    GLU  20           H        GLU  20  -2.387   1.767   1.059
  141    HA   GLU  20           HA       GLU  20  -4.973   0.511   0.933
  142   1HB   GLU  20          HB2       GLU  20  -4.347   2.068  -0.843
  143   2HB   GLU  20          HB1       GLU  20  -2.877   1.156  -1.149
  144   1HG   GLU  20          HG2       GLU  20  -4.304  -0.814  -1.728
  145   2HG   GLU  20          HG1       GLU  20  -5.702   0.249  -1.624
  146    H    CYS  21           H        CYS  21  -5.116  -1.533   0.452
  147    HA   CYS  21           HA       CYS  21  -2.798  -3.316   0.645
  148   1HB   CYS  21          HB2       CYS  21  -5.684  -3.990   0.151
  149   2HB   CYS  21          HB1       CYS  21  -4.398  -5.146   0.421
  150    H    LYS  22           H        LYS  22  -1.845  -4.108  -1.102
  151    HA   LYS  22           HA       LYS  22  -2.428  -3.680  -3.811
  152   1HB   LYS  22          HB2       LYS  22  -0.230  -4.276  -3.201
  153   2HB   LYS  22          HB1       LYS  22  -0.796  -5.636  -2.253
  154   1HG   LYS  22          HG2       LYS  22  -1.171  -5.756  -5.182
  155   2HG   LYS  22          HG1       LYS  22   0.469  -5.925  -4.550
  156   1HD   LYS  22          HD2       LYS  22  -0.318  -7.718  -3.050
  157   2HD   LYS  22          HD1       LYS  22  -1.938  -7.551  -3.743
  158   1HE   LYS  22          HE2       LYS  22  -1.106  -8.150  -5.884
  159   2HE   LYS  22          HE1       LYS  22   0.542  -8.241  -5.267
  160   1HZ   LYS  22          HZ1       LYS  22  -1.735  -9.982  -4.493
  161   2HZ   LYS  22          HZ2       LYS  22  -0.172 -10.095  -3.818
  162   3HZ   LYS  22          HZ3       LYS  22  -0.426 -10.441  -5.446
  163    H    TYR  23           H        TYR  23  -3.932  -5.689  -1.617
  164    HA   TYR  23           HA       TYR  23  -5.122  -7.320  -3.701
  165   1HB   TYR  23          HB2       TYR  23  -5.567  -8.747  -1.399
  166   2HB   TYR  23          HB1       TYR  23  -4.241  -9.036  -2.516
  167    HD1  TYR  23           HD1      TYR  23  -1.977  -8.493  -1.914
  168    HD2  TYR  23           HD2      TYR  23  -5.152  -7.499   0.697
  169    HE1  TYR  23           HE1      TYR  23  -0.349  -8.002  -0.147
  170    HE2  TYR  23           HE2      TYR  23  -3.529  -7.006   2.474
  171    HH   TYR  23           HH       TYR  23  -1.178  -7.756   3.026
  172    H    CYS  24           H        CYS  24  -5.878  -4.637  -2.096
  173    HA   CYS  24           HA       CYS  24  -8.583  -4.929  -2.651
  174   1HB   CYS  24          HB2       CYS  24  -9.653  -4.889  -0.481
  175   2HB   CYS  24          HB1       CYS  24  -8.489  -6.212  -0.507
  176    H    THR  25           H        THR  25  -9.163  -2.942  -3.320
  177    HA   THR  25           HA       THR  25  -7.571  -0.786  -2.333
  178    HB   THR  25           HB       THR  25  -9.832  -0.650  -4.375
  179    HG1  THR  25           HG1      THR  25  -6.997  -0.709  -4.609
  180   1HG2  THR  25          HG21      THR  25  -7.651   1.352  -3.691
  181   2HG2  THR  25          HG22      THR  25  -9.360   1.543  -3.302
  182   3HG2  THR  25          HG23      THR  25  -8.833   1.527  -4.985
  183    H    PHE  26           H        PHE  26  -8.322  -1.437  -0.289
  184    HA   PHE  26           HA       PHE  26 -10.401   0.359   0.687
  185   1HB   PHE  26          HB2       PHE  26 -11.164  -2.021   0.937
  186   2HB   PHE  26          HB1       PHE  26  -9.669  -2.393   1.783
  187    HD1  PHE  26           HD1      PHE  26  -9.423  -1.930   4.105
  188    HD2  PHE  26           HD2      PHE  26 -12.824  -0.482   1.986
  189    HE1  PHE  26           HE1      PHE  26 -10.480  -1.313   6.235
  190    HE2  PHE  26           HE2      PHE  26 -13.889   0.139   4.117
  191    HZ   PHE  26           HZ       PHE  26 -12.715  -0.275   6.245
  192    H    GLN  27           H        GLN  27  -9.309   1.869   1.674
  193    HA   GLN  27           HA       GLN  27  -6.606   1.232   2.515
  194   1HB   GLN  27          HB2       GLN  27  -6.495   2.648   0.668
  195   2HB   GLN  27          HB1       GLN  27  -7.810   3.665   1.249
  196   1HG   GLN  27          HG2       GLN  27  -6.394   4.551   2.978
  197   2HG   GLN  27          HG1       GLN  27  -5.168   3.354   2.540
  198   1HE2  GLN  27          HE21      GLN  27  -3.847   3.781   1.109
  199   2HE2  GLN  27          HE22      GLN  27  -3.720   5.203   0.125
  200    H    THR  28           H        THR  28  -5.849   1.919   4.430
  201    HA   THR  28           HA       THR  28  -7.440   3.714   5.975
  202    HB   THR  28           HB       THR  28  -8.336   1.552   6.720
  203    HG1  THR  28           HG1      THR  28  -8.097   1.880   8.850
  204   1HG2  THR  28          HG21      THR  28  -6.387   0.129   6.180
  205   2HG2  THR  28          HG22      THR  28  -6.936  -0.113   7.839
  206   3HG2  THR  28          HG23      THR  28  -5.506   0.849   7.529
  207    HA   PRO  29           HA       PRO  29  -3.210   5.096   6.742
  208   1HB   PRO  29          HB2       PRO  29  -3.927   7.203   8.333
  209   2HB   PRO  29          HB1       PRO  29  -3.986   7.239   6.566
  210   1HG   PRO  29          HG2       PRO  29  -6.193   6.734   8.515
  211   2HG   PRO  29          HG1       PRO  29  -6.189   7.749   7.061
  212   1HD   PRO  29          HD2       PRO  29  -7.284   5.310   7.036
  213   2HD   PRO  29          HD1       PRO  29  -6.392   5.914   5.626
  214    H    ASP  30           H        ASP  30  -5.361   3.708   8.896
  215    HA   ASP  30           HA       ASP  30  -3.584   4.004  11.168
  216   1HB   ASP  30          HB2       ASP  30  -6.205   2.512  10.838
  217   2HB   ASP  30          HB1       ASP  30  -5.282   2.586  12.331
  218    H    LEU  31           H        LEU  31  -1.775   2.837  10.821
  219    HA   LEU  31           HA       LEU  31  -1.360   0.689   9.229
  220   1HB   LEU  31          HB2       LEU  31   0.216   2.179  10.678
  221   2HB   LEU  31          HB1       LEU  31   0.033   0.920  11.873
  222    HG   LEU  31           HG       LEU  31   2.113   0.573  10.716
  223   1HD1  LEU  31          HD11      LEU  31   0.997  -1.474  11.293
  224   2HD1  LEU  31          HD12      LEU  31   1.827  -1.663   9.735
  225   3HD1  LEU  31          HD13      LEU  31   0.077  -1.386   9.794
  226   1HD2  LEU  31          HD21      LEU  31   0.508   0.535   8.196
  227   2HD2  LEU  31          HD22      LEU  31   2.253   0.245   8.315
  228   3HD2  LEU  31          HD23      LEU  31   1.565   1.826   8.738
  229    H    ASN  32           H        ASN  32  -2.271   0.633  12.691
  230    HA   ASN  32           HA       ASN  32  -2.203  -2.093  13.084
  231   1HB   ASN  32          HB2       ASN  32  -2.604  -0.404  14.933
  232   2HB   ASN  32          HB1       ASN  32  -4.223  -0.215  14.244
  233   1HD2  ASN  32          HD21      ASN  32  -2.842  -3.355  14.255
  234   2HD2  ASN  32          HD22      ASN  32  -3.873  -3.931  15.490
  235    H    MET  33           H        MET  33  -4.796  -0.044  11.877
  236    HA   MET  33           HA       MET  33  -6.622  -2.205  11.829
  237   1HB   MET  33          HB2       MET  33  -6.874   0.430  10.363
  238   2HB   MET  33          HB1       MET  33  -8.180  -0.676  10.763
  239   1HG   MET  33          HG2       MET  33  -6.469   0.802  12.704
  240   2HG   MET  33          HG1       MET  33  -8.103   1.269  12.240
  241   1HE   MET  33          HE1       MET  33  -6.951   0.774  15.263
  242   2HE   MET  33          HE2       MET  33  -8.337  -0.034  16.001
  243   3HE   MET  33          HE3       MET  33  -8.587   1.345  14.931
  244    H    PHE  34           H        PHE  34  -4.377  -0.727   9.646
  245    HA   PHE  34           HA       PHE  34  -5.232  -1.917   7.252
  246   1HB   PHE  34          HB2       PHE  34  -3.650  -0.096   7.147
  247   2HB   PHE  34          HB1       PHE  34  -2.526  -0.926   8.182
  248    HD1  PHE  34           HD1      PHE  34  -4.231  -1.393   4.873
  249    HD2  PHE  34           HD2      PHE  34  -0.745  -2.034   7.243
  250    HE1  PHE  34           HE1      PHE  34  -3.081  -2.336   2.927
  251    HE2  PHE  34           HE2      PHE  34   0.408  -2.980   5.288
  252    HZ   PHE  34           HZ       PHE  34  -0.764  -3.136   3.125
  253    H    THR  35           H        THR  35  -2.704  -2.892   9.522
  254    HA   THR  35           HA       THR  35  -2.312  -5.327   8.114
  255    HB   THR  35           HB       THR  35  -0.385  -4.412   9.228
  256    HG1  THR  35           HG1      THR  35  -0.782  -6.588  10.911
  257   1HG2  THR  35          HG21      THR  35  -1.907  -4.744  11.810
  258   2HG2  THR  35          HG22      THR  35  -1.406  -3.231  11.055
  259   3HG2  THR  35          HG23      THR  35  -0.194  -4.340  11.698
  260    H    PHE  36           H        PHE  36  -4.298  -4.399  10.776
  261    HA   PHE  36           HA       PHE  36  -4.939  -6.989  11.657
  262   1HB   PHE  36          HB2       PHE  36  -5.523  -5.301  13.159
  263   2HB   PHE  36          HB1       PHE  36  -6.307  -4.324  11.929
  264    HD1  PHE  36           HD1      PHE  36  -6.642  -7.752  13.408
  265    HD2  PHE  36           HD2      PHE  36  -8.588  -4.235  12.043
  266    HE1  PHE  36           HE1      PHE  36  -8.810  -8.705  14.071
  267    HE2  PHE  36           HE2      PHE  36 -10.763  -5.179  12.694
  268    HZ   PHE  36           HZ       PHE  36 -10.871  -7.420  13.709
  269    H    HIS  37           H        HIS  37  -6.597  -4.812   9.351
  270    HA   HIS  37           HA       HIS  37  -8.483  -6.820   8.809
  271   1HB   HIS  37          HB2       HIS  37  -9.550  -5.357   7.330
  272   2HB   HIS  37          HB1       HIS  37  -8.660  -4.238   8.350
  273    HD1  HIS  37           HD1      HIS  37  -7.137  -2.622   7.138
  274    HD2  HIS  37           HD2      HIS  37  -8.415  -5.767   4.758
  275    HE1  HIS  37           HE1      HIS  37  -6.484  -2.005   4.758
  276    H    VAL  38           H        VAL  38  -5.350  -6.166   7.611
  277    HA   VAL  38           HA       VAL  38  -5.480  -7.835   5.342
  278    HB   VAL  38           HB       VAL  38  -3.147  -7.021   7.067
  279   1HG1  VAL  38          HG11      VAL  38  -1.662  -7.919   5.285
  280   2HG1  VAL  38          HG12      VAL  38  -3.084  -8.561   4.457
  281   3HG1  VAL  38          HG13      VAL  38  -2.630  -9.189   6.041
  282   1HG2  VAL  38          HG21      VAL  38  -4.071  -5.222   5.762
  283   2HG2  VAL  38          HG22      VAL  38  -4.005  -6.194   4.298
  284   3HG2  VAL  38          HG23      VAL  38  -2.511  -5.675   5.077
  285    H    ASP  39           H        ASP  39  -4.303  -8.468   8.639
  286    HA   ASP  39           HA       ASP  39  -3.783 -11.216   8.267
  287   1HB   ASP  39          HB2       ASP  39  -2.896  -9.875  10.160
  288   2HB   ASP  39          HB1       ASP  39  -4.517  -9.760  10.816
  289    H    SER  40           H        SER  40  -6.635  -9.510   8.861
  290    HA   SER  40           HA       SER  40  -8.181 -11.799   9.688
  291   1HB   SER  40          HB2       SER  40  -8.650  -9.592  10.646
  292   2HB   SER  40          HB1       SER  40  -8.991  -8.961   9.047
  293    HG   SER  40           HG       SER  40 -10.756  -9.772  10.571
  294    H    GLU  41           H        GLU  41  -8.018  -9.696   6.824
  295    HA   GLU  41           HA       GLU  41 -10.105 -11.339   5.611
  296   1HB   GLU  41          HB2       GLU  41  -8.995  -8.669   4.769
  297   2HB   GLU  41          HB1       GLU  41 -10.278  -9.525   3.928
  298   1HG   GLU  41          HG2       GLU  41 -11.688  -9.409   5.895
  299   2HG   GLU  41          HG1       GLU  41 -10.373  -8.643   6.788
  300    H    HIS  42           H        HIS  42  -6.776 -10.338   4.991
  301    HA   HIS  42           HA       HIS  42  -6.620 -12.383   2.943
  302   1HB   HIS  42          HB2       HIS  42  -4.928 -10.295   2.087
  303   2HB   HIS  42          HB1       HIS  42  -6.341 -10.882   1.239
  304    HD1  HIS  42           HD1      HIS  42  -8.500  -9.349   1.441
  305    HD2  HIS  42           HD2      HIS  42  -5.157  -7.853   3.406
  306    HE1  HIS  42           HE1      HIS  42  -9.045  -6.963   1.998
  307    HA   PRO  43           HA       PRO  43  -3.210 -12.352   6.097
  308   1HB   PRO  43          HB2       PRO  43  -3.423 -14.941   6.914
  309   2HB   PRO  43          HB1       PRO  43  -4.382 -13.630   7.612
  310   1HG   PRO  43          HG2       PRO  43  -5.132 -15.589   5.480
  311   2HG   PRO  43          HG1       PRO  43  -6.076 -15.084   6.901
  312   1HD   PRO  43          HD2       PRO  43  -6.507 -14.078   4.430
  313   2HD   PRO  43          HD1       PRO  43  -6.706 -13.097   5.898
  314    H    ASN  44           H        ASN  44  -4.103 -14.248   3.395
  315    HA   ASN  44           HA       ASN  44  -1.335 -14.827   2.742
  316   1HB   ASN  44          HB2       ASN  44  -3.583 -16.860   2.583
  317   2HB   ASN  44          HB1       ASN  44  -2.069 -17.036   1.711
  318   1HD2  ASN  44          HD21      ASN  44  -3.665 -17.312   4.736
  319   2HD2  ASN  44          HD22      ASN  44  -2.343 -17.947   5.625
  320    H    VAL  45           H        VAL  45  -0.880 -14.483   0.630
  321    HA   VAL  45           HA       VAL  45  -3.104 -13.878  -1.188
  322    HB   VAL  45           HB       VAL  45  -0.568 -12.246  -1.264
  323   1HG1  VAL  45          HG11      VAL  45  -1.946 -10.547  -2.283
  324   2HG1  VAL  45          HG12      VAL  45  -3.379 -11.521  -2.025
  325   3HG1  VAL  45          HG13      VAL  45  -2.128 -12.073  -3.154
  326   1HG2  VAL  45          HG21      VAL  45  -1.569 -10.516   0.117
  327   2HG2  VAL  45          HG22      VAL  45  -1.315 -12.055   0.969
  328   3HG2  VAL  45          HG23      VAL  45  -2.938 -11.602   0.447
  329    H    VAL  46           H        VAL  46  -2.135 -13.791  -3.504
  330    HA   VAL  46           HA       VAL  46  -0.224 -15.910  -3.567
  331    HB   VAL  46           HB       VAL  46  -0.907 -16.358  -5.937
  332   1HG1  VAL  46          HG11      VAL  46  -3.105 -17.296  -5.396
  333   2HG1  VAL  46          HG12      VAL  46  -3.139 -16.336  -3.914
  334   3HG1  VAL  46          HG13      VAL  46  -1.923 -17.597  -4.123
  335   1HG2  VAL  46          HG21      VAL  46  -2.935 -15.291  -6.808
  336   2HG2  VAL  46          HG22      VAL  46  -1.650 -14.114  -6.522
  337   3HG2  VAL  46          HG23      VAL  46  -2.989 -14.247  -5.385
  338    H    LEU  47           H        LEU  47   1.224 -15.931  -5.620
  339    HA   LEU  47           HA       LEU  47   3.002 -13.721  -5.398
  340   1HB   LEU  47          HB2       LEU  47   3.036 -16.017  -7.350
  341   2HB   LEU  47          HB1       LEU  47   4.349 -14.903  -7.067
  342    HG   LEU  47           HG       LEU  47   3.279 -16.872  -5.038
  343   1HD1  LEU  47          HD11      LEU  47   5.378 -18.056  -5.422
  344   2HD1  LEU  47          HD12      LEU  47   5.792 -16.907  -6.695
  345   3HD1  LEU  47          HD13      LEU  47   4.404 -17.979  -6.889
  346   1HD2  LEU  47          HD21      LEU  47   5.677 -15.043  -4.961
  347   2HD2  LEU  47          HD22      LEU  47   5.307 -16.299  -3.784
  348   3HD2  LEU  47          HD23      LEU  47   4.224 -14.920  -3.963
  349    H    ASN  48           H        ASN  48   3.658 -12.210  -6.894
  350    HA   ASN  48           HA       ASN  48   3.124 -12.037  -9.574
  351   1HB   ASN  48          HB2       ASN  48   1.423 -10.300  -9.767
  352   2HB   ASN  48          HB1       ASN  48   0.732 -11.559  -8.766
  353   1HD2  ASN  48          HD21      ASN  48   0.299  -8.625  -9.072
  354   2HD2  ASN  48          HD22      ASN  48   0.388  -7.973  -7.481
  355    H    SER  49           H        SER  49   3.428  -9.399 -10.078
  356    HA   SER  49           HA       SER  49   5.669  -8.602  -8.390
  357   1HB   SER  49          HB2       SER  49   6.137  -7.049 -10.311
  358   2HB   SER  49          HB1       SER  49   6.170  -8.758 -10.757
  359    HG   SER  49           HG       SER  49   3.844  -7.182 -10.994
  360    H    SER  50           H        SER  50   5.266  -6.994  -6.841
  361    HA   SER  50           HA       SER  50   3.614  -4.783  -7.551
  362   1HB   SER  50          HB2       SER  50   3.140  -6.512  -5.121
  363   2HB   SER  50          HB1       SER  50   2.421  -4.934  -5.431
  364    HG   SER  50           HG       SER  50   2.125  -6.578  -7.532
  365    H    TYR  51           H        TYR  51   3.760  -3.190  -5.607
  366    HA   TYR  51           HA       TYR  51   6.518  -3.183  -4.623
  367   1HB   TYR  51          HB2       TYR  51   4.958  -1.117  -6.065
  368   2HB   TYR  51          HB1       TYR  51   6.007  -0.596  -4.769
  369    HD1  TYR  51           HD1      TYR  51   7.472   0.691  -6.025
  370    HD2  TYR  51           HD2      TYR  51   6.801  -3.350  -7.147
  371    HE1  TYR  51           HE1      TYR  51   9.354   0.825  -7.592
  372    HE2  TYR  51           HE2      TYR  51   8.685  -3.224  -8.728
  373    HH   TYR  51           HH       TYR  51  10.848  -0.517  -8.758
  374    H    VAL  52           H        VAL  52   6.827  -2.516  -2.612
  375    HA   VAL  52           HA       VAL  52   4.517  -1.653  -1.005
  376    HB   VAL  52           HB       VAL  52   4.888  -4.065  -0.653
  377   1HG1  VAL  52          HG11      VAL  52   7.205  -4.122  -1.267
  378   2HG1  VAL  52          HG12      VAL  52   6.883  -4.898   0.284
  379   3HG1  VAL  52          HG13      VAL  52   7.601  -3.289   0.245
  380   1HG2  VAL  52          HG21      VAL  52   4.168  -2.852   1.302
  381   2HG2  VAL  52          HG22      VAL  52   5.843  -2.471   1.706
  382   3HG2  VAL  52          HG23      VAL  52   5.277  -4.144   1.757
  383    H    CYS  53           H        CYS  53   4.999  -0.136   0.499
  384    HA   CYS  53           HA       CYS  53   7.652   1.108   0.494
  385   1HB   CYS  53          HB2       CYS  53   5.695   2.531   0.608
  386   2HB   CYS  53          HB1       CYS  53   5.079   1.662   1.994
  387    H    VAL  54           H        VAL  54   9.104  -0.240   1.520
  388    HA   VAL  54           HA       VAL  54   8.594  -2.076   3.521
  389    HB   VAL  54           HB       VAL  54  11.123  -0.791   3.989
  390   1HG1  VAL  54          HG11      VAL  54  10.409  -3.358   2.773
  391   2HG1  VAL  54          HG12      VAL  54  10.595  -3.075   4.524
  392   3HG1  VAL  54          HG13      VAL  54  11.995  -2.947   3.419
  393   1HG2  VAL  54          HG21      VAL  54  10.447  -1.388   1.135
  394   2HG2  VAL  54          HG22      VAL  54  12.089  -1.398   1.751
  395   3HG2  VAL  54          HG23      VAL  54  11.123   0.071   1.833
  396    H    GLU  55           H        GLU  55   9.127   1.307   3.672
  397    HA   GLU  55           HA       GLU  55   9.791   1.656   6.342
  398   1HB   GLU  55          HB2       GLU  55   8.163   3.586   4.706
  399   2HB   GLU  55          HB1       GLU  55   9.263   3.956   6.024
  400   1HG   GLU  55          HG2       GLU  55  10.105   2.825   3.362
  401   2HG   GLU  55          HG1       GLU  55  10.127   4.529   3.780
  402    H    CYS  56           H        CYS  56   6.775   1.489   4.670
  403    HA   CYS  56           HA       CYS  56   5.240   1.850   7.195
  404   1HB   CYS  56          HB2       CYS  56   4.218   1.713   4.385
  405   2HB   CYS  56          HB1       CYS  56   3.353   2.312   5.795
  406    H    ASN  57           H        ASN  57   6.328  -0.493   5.063
  407    HA   ASN  57           HA       ASN  57   5.705  -2.487   4.291
  408   1HB   ASN  57          HB2       ASN  57   4.910  -2.521   7.122
  409   2HB   ASN  57          HB1       ASN  57   4.668  -4.001   6.146
  410   1HD2  ASN  57          HD21      ASN  57   7.165  -3.561   4.643
  411   2HD2  ASN  57          HD22      ASN  57   8.393  -3.931   5.782
  412    H    PHE  58           H        PHE  58   4.246  -1.166   2.954
  413    HA   PHE  58           HA       PHE  58   1.574  -2.262   3.238
  414   1HB   PHE  58          HB2       PHE  58   0.414  -0.312   3.358
  415   2HB   PHE  58          HB1       PHE  58   1.918   0.379   3.937
  416    HD1  PHE  58           HD1      PHE  58   3.198   1.856   2.481
  417    HD2  PHE  58           HD2      PHE  58  -0.429   0.129   1.164
  418    HE1  PHE  58           HE1      PHE  58   3.077   3.512   0.583
  419    HE2  PHE  58           HE2      PHE  58  -0.556   1.756  -0.690
  420    HZ   PHE  58           HZ       PHE  58   1.217   3.424  -0.978
  421    H    LEU  59           H        LEU  59   0.919  -3.109   1.472
  422    HA   LEU  59           HA       LEU  59   2.584  -2.843  -0.884
  423   1HB   LEU  59          HB2       LEU  59   0.972  -4.938   0.332
  424   2HB   LEU  59          HB1       LEU  59   0.731  -4.781  -1.389
  425    HG   LEU  59           HG       LEU  59   3.422  -5.176  -0.125
  426   1HD1  LEU  59          HD11      LEU  59   3.195  -7.496  -0.801
  427   2HD1  LEU  59          HD12      LEU  59   1.625  -7.156  -1.524
  428   3HD1  LEU  59          HD13      LEU  59   1.819  -7.084   0.225
  429   1HD2  LEU  59          HD21      LEU  59   3.500  -4.135  -2.349
  430   2HD2  LEU  59          HD22      LEU  59   2.425  -5.369  -2.983
  431   3HD2  LEU  59          HD23      LEU  59   4.037  -5.808  -2.454
  432    H    THR  60           H        THR  60   1.813  -1.940  -2.684
  433    HA   THR  60           HA       THR  60  -1.055  -1.537  -2.883
  434    HB   THR  60           HB       THR  60  -0.289   0.601  -2.264
  435    HG1  THR  60           HG1      THR  60  -1.682   0.759  -3.996
  436   1HG2  THR  60          HG21      THR  60   1.903   0.389  -4.334
  437   2HG2  THR  60          HG22      THR  60   2.098   0.151  -2.606
  438   3HG2  THR  60          HG23      THR  60   1.659   1.732  -3.205
  439    H    LYS  61           H        LYS  61  -1.777  -1.274  -5.077
  440    HA   LYS  61           HA       LYS  61  -0.255  -3.165  -6.711
  441   1HB   LYS  61          HB2       LYS  61  -2.411  -3.716  -7.743
  442   2HB   LYS  61          HB1       LYS  61  -2.406  -3.979  -6.006
  443   1HG   LYS  61          HG2       LYS  61  -3.492  -1.646  -5.860
  444   2HG   LYS  61          HG1       LYS  61  -3.773  -1.820  -7.585
  445   1HD   LYS  61          HD2       LYS  61  -4.778  -3.708  -5.439
  446   2HD   LYS  61          HD1       LYS  61  -5.737  -2.459  -6.211
  447   1HE   LYS  61          HE2       LYS  61  -6.350  -4.500  -7.245
  448   2HE   LYS  61          HE1       LYS  61  -5.311  -3.673  -8.398
  449   1HZ   LYS  61          HZ1       LYS  61  -3.516  -5.165  -7.846
  450   2HZ   LYS  61          HZ2       LYS  61  -4.882  -6.109  -8.131
  451   3HZ   LYS  61          HZ3       LYS  61  -4.386  -5.821  -6.562
  452    H    ARG  62           H        ARG  62  -0.793   0.097  -6.657
  453    HA   ARG  62           HA       ARG  62  -1.038   0.246  -9.590
  454   1HB   ARG  62          HB2       ARG  62  -1.637   2.557  -9.374
  455   2HB   ARG  62          HB1       ARG  62  -2.681   1.542  -8.394
  456   1HG   ARG  62          HG2       ARG  62  -1.452   2.188  -6.399
  457   2HG   ARG  62          HG1       ARG  62  -0.375   3.189  -7.382
  458   1HD   ARG  62          HD2       ARG  62  -2.195   4.463  -6.272
  459   2HD   ARG  62          HD1       ARG  62  -2.186   4.605  -8.030
  460    HE   ARG  62           HE       ARG  62  -4.144   3.415  -8.136
  461   1HH1  ARG  62          HH11      ARG  62  -3.043   3.597  -4.744
  462   2HH1  ARG  62          HH12      ARG  62  -4.363   2.607  -4.246
  463   1HH2  ARG  62          HH21      ARG  62  -5.941   2.132  -7.222
  464   2HH2  ARG  62          HH22      ARG  62  -5.904   1.852  -5.518
  465    H    TYR  63           H        TYR  63   1.404   0.388  -7.379
  466    HA   TYR  63           HA       TYR  63   3.595   0.909  -7.497
  467   1HB   TYR  63          HB2       TYR  63   2.961   1.313 -10.408
  468   2HB   TYR  63          HB1       TYR  63   4.575   1.606  -9.775
  469    HD1  TYR  63           HD1      TYR  63   1.966  -1.096  -9.450
  470    HD2  TYR  63           HD2      TYR  63   6.046  -0.095 -10.136
  471    HE1  TYR  63           HE1      TYR  63   2.508  -3.479  -9.694
  472    HE2  TYR  63           HE2      TYR  63   6.589  -2.475 -10.376
  473    HH   TYR  63           HH       TYR  63   4.196  -4.847 -10.703
  474    H    ASP  64           H        ASP  64   1.709   3.468  -9.079
  475    HA   ASP  64           HA       ASP  64   3.448   5.665  -8.661
  476   1HB   ASP  64          HB2       ASP  64   0.434   5.675  -8.500
  477   2HB   ASP  64          HB1       ASP  64   1.434   7.113  -8.531
  478    H    ALA  65           H        ALA  65   1.429   4.047  -6.404
  479    HA   ALA  65           HA       ALA  65   1.169   6.116  -4.539
  480   1HB   ALA  65          HB1       ALA  65  -0.316   4.263  -4.558
  481   2HB   ALA  65          HB2       ALA  65   0.516   4.271  -2.986
  482   3HB   ALA  65          HB3       ALA  65   0.999   3.148  -4.263
  483    H    LEU  66           H        LEU  66   3.798   3.974  -5.167
  484    HA   LEU  66           HA       LEU  66   5.118   4.444  -2.636
  485   1HB   LEU  66          HB2       LEU  66   6.213   3.303  -5.163
  486   2HB   LEU  66          HB1       LEU  66   7.020   3.283  -3.602
  487    HG   LEU  66           HG       LEU  66   6.247   1.135  -3.833
  488   1HD1  LEU  66          HD11      LEU  66   4.481   0.826  -2.193
  489   2HD1  LEU  66          HD12      LEU  66   4.067   2.530  -2.345
  490   3HD1  LEU  66          HD13      LEU  66   5.638   2.063  -1.668
  491   1HD2  LEU  66          HD21      LEU  66   3.635   2.225  -4.817
  492   2HD2  LEU  66          HD22      LEU  66   4.012   0.510  -4.599
  493   3HD2  LEU  66          HD23      LEU  66   4.888   1.476  -5.795
  494    H    SER  67           H        SER  67   5.114   5.684  -5.826
  495    HA   SER  67           HA       SER  67   7.549   7.188  -5.719
  496   1HB   SER  67          HB2       SER  67   5.116   7.002  -7.347
  497   2HB   SER  67          HB1       SER  67   6.305   8.246  -7.750
  498    HG   SER  67           HG       SER  67   6.351   6.024  -8.815
  499    H    GLU  68           H        GLU  68   4.124   7.920  -5.586
  500    HA   GLU  68           HA       GLU  68   4.465  10.641  -4.898
  501   1HB   GLU  68          HB2       GLU  68   1.969   9.307  -4.074
  502   2HB   GLU  68          HB1       GLU  68   2.267  10.823  -4.929
  503   1HG   GLU  68          HG2       GLU  68   2.872   9.433  -6.939
  504   2HG   GLU  68          HG1       GLU  68   2.324   8.083  -6.029
  505    H    HIS  69           H        HIS  69   4.575   7.777  -3.229
  506    HA   HIS  69           HA       HIS  69   3.599   8.237  -0.703
  507   1HB   HIS  69          HB2       HIS  69   4.764   6.185  -1.694
  508   2HB   HIS  69          HB1       HIS  69   6.229   6.936  -1.000
  509    HD1  HIS  69           HD1      HIS  69   2.742   5.967   0.173
  510    HD2  HIS  69           HD2      HIS  69   6.663   6.099   1.411
  511    HE1  HIS  69           HE1      HIS  69   2.741   5.030   2.506
  512    H    ASN  70           H        ASN  70   7.014   8.912  -1.597
  513    HA   ASN  70           HA       ASN  70   7.419  10.421   0.820
  514   1HB   ASN  70          HB2       ASN  70   9.581  11.157  -0.144
  515   2HB   ASN  70          HB1       ASN  70   9.342   9.409  -0.123
  516   1HD2  ASN  70          HD21      ASN  70  11.099   9.620  -1.503
  517   2HD2  ASN  70          HD22      ASN  70  10.791   9.699  -3.239
  518    H    LEU  71           H        LEU  71   5.918  11.195  -1.958
  519    HA   LEU  71           HA       LEU  71   6.393  14.033  -1.923
  520   1HB   LEU  71          HB2       LEU  71   5.844  13.274  -4.056
  521   2HB   LEU  71          HB1       LEU  71   4.703  12.108  -3.448
  522    HG   LEU  71           HG       LEU  71   3.073  13.820  -3.122
  523   1HD1  LEU  71          HD11      LEU  71   5.134  15.670  -4.415
  524   2HD1  LEU  71          HD12      LEU  71   4.589  15.772  -2.742
  525   3HD1  LEU  71          HD13      LEU  71   3.466  16.121  -4.057
  526   1HD2  LEU  71          HD21      LEU  71   3.110  12.652  -5.213
  527   2HD2  LEU  71          HD22      LEU  71   4.281  13.787  -5.877
  528   3HD2  LEU  71          HD23      LEU  71   2.645  14.326  -5.500
  529    H    LYS  72           H        LYS  72   3.748  11.899  -1.006
  530    HA   LYS  72           HA       LYS  72   2.575  14.130   0.457
  531   1HB   LYS  72          HB2       LYS  72   0.528  12.316   0.282
  532   2HB   LYS  72          HB1       LYS  72   0.727  13.719  -0.778
  533   1HG   LYS  72          HG2       LYS  72   2.105  12.109  -2.226
  534   2HG   LYS  72          HG1       LYS  72   1.429  10.822  -1.275
  535   1HD   LYS  72          HD2       LYS  72  -0.104  12.835  -2.916
  536   2HD   LYS  72          HD1       LYS  72   0.130  11.127  -3.290
  537   1HE   LYS  72          HE2       LYS  72  -1.158  10.549  -1.259
  538   2HE   LYS  72          HE1       LYS  72  -1.391  12.260  -0.953
  539   1HZ   LYS  72          HZ1       LYS  72  -3.305  11.267  -2.033
  540   2HZ   LYS  72          HZ2       LYS  72  -2.407  10.798  -3.346
  541   3HZ   LYS  72          HZ3       LYS  72  -2.635  12.447  -3.007
  542    H    TYR  73           H        TYR  73   3.315  10.791   0.761
  543    HA   TYR  73           HA       TYR  73   2.251  10.570   3.447
  544   1HB   TYR  73          HB2       TYR  73   3.781   8.697   1.695
  545   2HB   TYR  73          HB1       TYR  73   3.231   8.256   3.315
  546    HD1  TYR  73           HD1      TYR  73   1.849   9.718   0.143
  547    HD2  TYR  73           HD2      TYR  73   1.284   7.052   3.405
  548    HE1  TYR  73           HE1      TYR  73  -0.234   8.995  -0.823
  549    HE2  TYR  73           HE2      TYR  73  -0.839   6.328   2.432
  550    HH   TYR  73           HH       TYR  73  -2.508   7.337   0.965
  551    H    HIS  74           H        HIS  74   5.514  10.240   2.016
  552    HA   HIS  74           HA       HIS  74   6.638  10.967   4.698
  553   1HB   HIS  74          HB2       HIS  74   7.937   9.380   2.460
  554   2HB   HIS  74          HB1       HIS  74   8.798   9.925   3.885
  555    HD1  HIS  74           HD1      HIS  74   8.951   8.164   5.711
  556    HD2  HIS  74           HD2      HIS  74   5.924   7.470   2.987
  557    HE1  HIS  74           HE1      HIS  74   8.155   5.834   6.178
  558    HA   PRO  75           HA       PRO  75   7.562  14.281   1.569
  559   1HB   PRO  75          HB2       PRO  75   6.753  16.393   2.971
  560   2HB   PRO  75          HB1       PRO  75   5.606  15.361   2.100
  561   1HG   PRO  75          HG2       PRO  75   6.357  15.279   5.015
  562   2HG   PRO  75          HG1       PRO  75   4.731  15.267   4.292
  563   1HD   PRO  75          HD2       PRO  75   5.947  12.991   5.076
  564   2HD   PRO  75          HD1       PRO  75   4.899  13.088   3.647
  565    H    GLY  76           H        GLY  76   9.324  15.502   1.411
  566   1HA   GLY  76          HA2       GLY  76  10.691  17.014   3.098
  567   2HA   GLY  76          HA1       GLY  76  11.221  15.415   3.601
  568    H    GLU  77           H        GLU  77  11.204  14.214   0.991
  569    HA   GLU  77           HA       GLU  77  12.863  15.630  -0.806
  570   1HB   GLU  77          HB2       GLU  77  14.888  14.231  -0.522
  571   2HB   GLU  77          HB1       GLU  77  14.586  15.194   0.911
  572   1HG   GLU  77          HG2       GLU  77  14.964  13.246   2.015
  573   2HG   GLU  77          HG1       GLU  77  13.310  12.890   1.517
  574    H    GLU  78           H        GLU  78  13.675  13.872  -2.471
  575    HA   GLU  78           HA       GLU  78  11.639  11.767  -2.507
  576   1HB   GLU  78          HB2       GLU  78  10.974  13.715  -3.926
  577   2HB   GLU  78          HB1       GLU  78  12.457  13.429  -4.838
  578   1HG   GLU  78          HG2       GLU  78  11.679  11.224  -5.437
  579   2HG   GLU  78          HG1       GLU  78  10.179  11.490  -4.550
  580    H    ASN  79           H        ASN  79  13.238  10.299  -1.922
  581    HA   ASN  79           HA       ASN  79  14.920   9.356  -4.122
  582   1HB   ASN  79          HB2       ASN  79  15.878  10.054  -1.366
  583   2HB   ASN  79          HB1       ASN  79  16.876   9.149  -2.520
  584   1HD2  ASN  79          HD21      ASN  79  15.556  12.112  -1.588
  585   2HD2  ASN  79          HD22      ASN  79  16.300  13.202  -2.708
  586    H    PHE  80           H        PHE  80  13.689   7.545  -4.220
  587    HA   PHE  80           HA       PHE  80  13.503   5.856  -1.830
  588   1HB   PHE  80          HB2       PHE  80  11.722   6.416  -4.052
  589   2HB   PHE  80          HB1       PHE  80  11.960   4.696  -3.792
  590    HD1  PHE  80           HD1      PHE  80  11.619   3.888  -1.349
  591    HD2  PHE  80           HD2      PHE  80  10.120   7.551  -2.871
  592    HE1  PHE  80           HE1      PHE  80   9.847   3.856   0.334
  593    HE2  PHE  80           HE2      PHE  80   8.361   7.550  -1.139
  594    HZ   PHE  80           HZ       PHE  80   8.220   5.680   0.444
  595    H    LYS  81           H        LYS  81  14.168   3.743  -1.942
  596    HA   LYS  81           HA       LYS  81  15.827   3.018  -4.265
  597   1HB   LYS  81          HB2       LYS  81  17.424   2.215  -2.776
  598   2HB   LYS  81          HB1       LYS  81  16.608   3.358  -1.699
  599   1HG   LYS  81          HG2       LYS  81  15.293   1.671  -0.718
  600   2HG   LYS  81          HG1       LYS  81  15.831   0.479  -1.888
  601   1HD   LYS  81          HD2       LYS  81  18.195   0.995  -0.991
  602   2HD   LYS  81          HD1       LYS  81  17.302   1.690   0.380
  603   1HE   LYS  81          HE2       LYS  81  16.148  -0.400   0.748
  604   2HE   LYS  81          HE1       LYS  81  16.913  -1.089  -0.684
  605   1HZ   LYS  81          HZ1       LYS  81  18.369  -0.236   1.780
  606   2HZ   LYS  81          HZ2       LYS  81  19.050  -0.942   0.408
  607   3HZ   LYS  81          HZ3       LYS  81  18.004  -1.829   1.369
  608    H    LEU  82           H        LEU  82  15.784   0.527  -4.530
  609    HA   LEU  82           HA       LEU  82  13.291  -0.554  -3.505
  610   1HB   LEU  82          HB2       LEU  82  12.819  -1.696  -5.626
  611   2HB   LEU  82          HB1       LEU  82  12.753   0.041  -5.784
  612    HG   LEU  82           HG       LEU  82  15.198  -1.487  -6.554
  613   1HD1  LEU  82          HD11      LEU  82  12.764  -0.864  -8.267
  614   2HD1  LEU  82          HD12      LEU  82  13.289  -2.477  -7.781
  615   3HD1  LEU  82          HD13      LEU  82  14.284  -1.516  -8.877
  616   1HD2  LEU  82          HD21      LEU  82  15.564   0.412  -8.051
  617   2HD2  LEU  82          HD22      LEU  82  15.348   0.967  -6.388
  618   3HD2  LEU  82          HD23      LEU  82  14.030   1.116  -7.546
  619    H    THR  83           H        THR  83  13.346  -2.545  -2.821
  620    HA   THR  83           HA       THR  83  15.651  -4.182  -3.376
  621    HB   THR  83           HB       THR  83  16.276  -3.084  -1.353
  622    HG1  THR  83           HG1      THR  83  16.338  -5.500  -1.477
  623   1HG2  THR  83          HG21      THR  83  14.092  -2.213  -0.655
  624   2HG2  THR  83          HG22      THR  83  14.909  -3.005   0.693
  625   3HG2  THR  83          HG23      THR  83  13.601  -3.833  -0.159
  626    H    MET  84           H        MET  84  14.829  -6.289  -3.820
  627    HA   MET  84           HA       MET  84  11.954  -6.520  -3.194
  628   1HB   MET  84          HB2       MET  84  12.671  -6.830  -5.543
  629   2HB   MET  84          HB1       MET  84  13.715  -8.133  -4.993
  630   1HG   MET  84          HG2       MET  84  11.790  -9.453  -4.358
  631   2HG   MET  84          HG1       MET  84  10.708  -8.146  -4.843
  632   1HE   MET  84          HE1       MET  84  10.537 -11.168  -5.968
  633   2HE   MET  84          HE2       MET  84  10.205 -10.854  -7.668
  634   3HE   MET  84          HE3       MET  84   9.400  -9.897  -6.417
  635    H    VAL  85           H        VAL  85  11.807  -7.271  -1.211
  636    HA   VAL  85           HA       VAL  85  12.622  -9.988  -0.821
  637    HB   VAL  85           HB       VAL  85  13.252  -9.244   1.665
  638   1HG1  VAL  85          HG11      VAL  85  14.741 -10.454   0.154
  639   2HG1  VAL  85          HG12      VAL  85  15.625  -9.181   0.999
  640   3HG1  VAL  85          HG13      VAL  85  15.115  -8.950  -0.680
  641   1HG2  VAL  85          HG21      VAL  85  12.805  -6.833   1.286
  642   2HG2  VAL  85          HG22      VAL  85  14.056  -6.797   0.047
  643   3HG2  VAL  85          HG23      VAL  85  14.491  -7.114   1.722
  644    H    LYS  86           H        LYS  86  10.525 -10.792  -0.548
  645    HA   LYS  86           HA       LYS  86   9.216  -9.620   1.749
  646   1HB   LYS  86          HB2       LYS  86   8.235  -8.760  -0.518
  647   2HB   LYS  86          HB1       LYS  86   7.536 -10.380  -0.611
  648   1HG   LYS  86          HG2       LYS  86   5.926  -8.864   0.202
  649   2HG   LYS  86          HG1       LYS  86   6.375  -9.975   1.489
  650   1HD   LYS  86          HD2       LYS  86   7.607  -8.385   2.668
  651   2HD   LYS  86          HD1       LYS  86   7.874  -7.396   1.242
  652   1HE   LYS  86          HE2       LYS  86   5.710  -6.414   1.412
  653   2HE   LYS  86          HE1       LYS  86   5.142  -7.629   2.557
  654   1HZ   LYS  86          HZ1       LYS  86   7.262  -5.603   2.970
  655   2HZ   LYS  86          HZ2       LYS  86   6.804  -6.760   4.112
  656   3HZ   LYS  86          HZ3       LYS  86   5.696  -5.585   3.652
  657    H    ARG  87           H        ARG  87   8.851 -11.173   3.134
  658    HA   ARG  87           HA       ARG  87   8.836 -13.879   2.041
  659   1HB   ARG  87          HB2       ARG  87  10.033 -12.972   4.675
  660   2HB   ARG  87          HB1       ARG  87   9.987 -14.624   4.091
  661   1HG   ARG  87          HG2       ARG  87  12.183 -13.935   3.621
  662   2HG   ARG  87          HG1       ARG  87  11.339 -13.752   2.088
  663   1HD   ARG  87          HD2       ARG  87  12.709 -11.798   2.418
  664   2HD   ARG  87          HD1       ARG  87  11.022 -11.352   2.574
  665    HE   ARG  87           HE       ARG  87  12.187 -11.997   5.088
  666   1HH1  ARG  87          HH11      ARG  87  11.633  -9.282   2.819
  667   2HH1  ARG  87          HH12      ARG  87  12.095  -8.102   3.927
  668   1HH2  ARG  87          HH21      ARG  87  12.759 -10.341   6.594
  669   2HH2  ARG  87          HH22      ARG  87  12.765  -8.699   6.159
  670    H    ASN  88           H        ASN  88   7.490 -15.331   2.958
  671    HA   ASN  88           HA       ASN  88   5.701 -16.212   4.013
  672   1HB   ASN  88          HB2       ASN  88   6.013 -13.886   5.931
  673   2HB   ASN  88          HB1       ASN  88   4.807 -15.142   6.131
  674   1HD2  ASN  88          HD21      ASN  88   5.593 -15.801   8.034
  675   2HD2  ASN  88          HD22      ASN  88   7.099 -16.617   8.265
  676    H    ASN  89           H        ASN  89   5.542 -14.154   1.920
  677    HA   ASN  89           HA       ASN  89   2.696 -13.632   2.176
  678   1HB   ASN  89          HB2       ASN  89   4.699 -11.453   1.538
  679   2HB   ASN  89          HB1       ASN  89   2.973 -11.299   1.268
  680   1HD2  ASN  89          HD21      ASN  89   5.538 -11.217   3.554
  681   2HD2  ASN  89          HD22      ASN  89   4.580 -10.738   4.904
  682    H    GLN  90           H        GLN  90   4.964 -12.235  -0.089
  683    HA   GLN  90           HA       GLN  90   4.877 -14.202  -2.039
  684   1HB   GLN  90          HB2       GLN  90   3.853 -12.897  -3.807
  685   2HB   GLN  90          HB1       GLN  90   2.662 -13.120  -2.517
  686   1HG   GLN  90          HG2       GLN  90   4.291 -10.655  -2.674
  687   2HG   GLN  90          HG1       GLN  90   2.979 -10.858  -3.825
  688   1HE2  GLN  90          HE21      GLN  90   3.826 -10.196  -0.567
  689   2HE2  GLN  90          HE22      GLN  90   2.238  -9.859   0.029
  690    H    THR  91           H        THR  91   6.276 -13.260  -3.848
  691    HA   THR  91           HA       THR  91   8.145 -11.499  -2.514
  692    HB   THR  91           HB       THR  91   9.599 -12.154  -4.571
  693    HG1  THR  91           HG1      THR  91   8.098 -13.181  -5.817
  694   1HG2  THR  91          HG21      THR  91  10.365 -14.187  -3.376
  695   2HG2  THR  91          HG22      THR  91   8.887 -14.164  -2.415
  696   3HG2  THR  91          HG23      THR  91  10.059 -12.869  -2.244
  697    H    ILE  92           H        ILE  92   7.985  -9.523  -2.800
  698    HA   ILE  92           HA       ILE  92   7.307  -8.338  -5.298
  699    HB   ILE  92           HB       ILE  92   5.831  -6.696  -4.000
  700   1HG1  ILE  92          HG12      ILE  92   4.617  -7.947  -2.101
  701   2HG1  ILE  92          HG11      ILE  92   6.105  -8.873  -2.037
  702   1HG2  ILE  92          HG21      ILE  92   4.905  -9.526  -4.418
  703   2HG2  ILE  92          HG22      ILE  92   4.848  -8.206  -5.590
  704   3HG2  ILE  92          HG23      ILE  92   3.841  -8.154  -4.138
  705   1HD1  ILE  92          HD11      ILE  92   7.429  -6.920  -1.636
  706   2HD1  ILE  92          HD12      ILE  92   6.130  -6.979  -0.452
  707   3HD1  ILE  92          HD13      ILE  92   6.033  -5.879  -1.821
  708    H    PHE  93           H        PHE  93   7.794  -5.943  -5.254
  709    HA   PHE  93           HA       PHE  93  10.521  -5.818  -4.227
  710   1HB   PHE  93          HB2       PHE  93   8.958  -3.950  -5.998
  711   2HB   PHE  93          HB1       PHE  93  10.662  -3.808  -5.642
  712    HD1  PHE  93           HD1      PHE  93  12.236  -5.105  -6.781
  713    HD2  PHE  93           HD2      PHE  93   8.086  -5.746  -7.413
  714    HE1  PHE  93           HE1      PHE  93  12.753  -6.444  -8.805
  715    HE2  PHE  93           HE2      PHE  93   8.576  -7.086  -9.411
  716    HZ   PHE  93           HZ       PHE  93  10.915  -7.435 -10.112
  717    H    GLU  94           H        GLU  94  10.981  -4.645  -2.442
  718    HA   GLU  94           HA       GLU  94   8.927  -2.955  -1.335
  719   1HB   GLU  94          HB2       GLU  94  11.524  -3.861  -0.046
  720   2HB   GLU  94          HB1       GLU  94  10.140  -3.107   0.721
  721   1HG   GLU  94          HG2       GLU  94   8.910  -5.221  -0.206
  722   2HG   GLU  94          HG1       GLU  94  10.522  -5.926  -0.044
  723    H    GLN  95           H        GLN  95   9.369  -0.849  -0.897
  724    HA   GLN  95           HA       GLN  95  11.781   0.243  -2.197
  725   1HB   GLN  95          HB2       GLN  95   9.457   0.457  -3.376
  726   2HB   GLN  95          HB1       GLN  95   9.121   1.657  -2.131
  727   1HG   GLN  95          HG2       GLN  95  10.942   2.996  -2.836
  728   2HG   GLN  95          HG1       GLN  95  11.507   1.737  -3.926
  729   1HE2  GLN  95          HE21      GLN  95   9.217   4.307  -3.395
  730   2HE2  GLN  95          HE22      GLN  95   8.688   4.371  -5.038
  731    H    THR  96           H        THR  96  13.077   1.108  -0.691
  732    HA   THR  96           HA       THR  96  11.898   2.225   1.767
  733    HB   THR  96           HB       THR  96  14.740   1.881   1.918
  734    HG1  THR  96           HG1      THR  96  13.840  -0.660   1.778
  735   1HG2  THR  96          HG21      THR  96  14.131   0.414   3.820
  736   2HG2  THR  96          HG22      THR  96  12.451   0.427   3.279
  737   3HG2  THR  96          HG23      THR  96  13.185   1.899   3.834
  738    H    ILE  97           H        ILE  97  12.986   4.140   2.633
  739    HA   ILE  97           HA       ILE  97  14.070   5.870   0.478
  740    HB   ILE  97           HB       ILE  97  13.080   6.799   3.196
  741   1HG1  ILE  97          HG12      ILE  97  11.392   6.895   0.752
  742   2HG1  ILE  97          HG11      ILE  97  11.373   5.408   1.649
  743   1HG2  ILE  97          HG21      ILE  97  14.455   8.273   1.656
  744   2HG2  ILE  97          HG22      ILE  97  12.885   8.893   2.081
  745   3HG2  ILE  97          HG23      ILE  97  13.139   8.167   0.485
  746   1HD1  ILE  97          HD11      ILE  97  10.747   6.908   3.648
  747   2HD1  ILE  97          HD12      ILE  97   9.579   6.493   2.430
  748   3HD1  ILE  97          HD13      ILE  97  10.311   8.093   2.387
  749    H    ASN  98           H        ASN  98  15.831   7.108   0.978
  750    HA   ASN  98           HA       ASN  98  17.640   5.836   2.876
  751   1HB   ASN  98          HB2       ASN  98  19.365   7.207   1.595
  752   2HB   ASN  98          HB1       ASN  98  18.582   5.907   0.694
  753   1HD2  ASN  98          HD21      ASN  98  17.224   9.145   1.404
  754   2HD2  ASN  98          HD22      ASN  98  17.136   9.622  -0.218
  755    H    ASP  99           H        ASP  99  15.466   8.005   3.357
  756    HA   ASP  99           HA       ASP  99  17.115   9.731   5.040
  757   1HB   ASP  99          HB2       ASP  99  17.068  10.594   2.639
  758   2HB   ASP  99          HB1       ASP  99  15.406  11.010   2.957
  759    H    LEU 100           H        LEU 100  13.927   9.556   3.510
  760    HA   LEU 100           HA       LEU 100  12.482  10.623   5.813
  761   1HB   LEU 100          HB2       LEU 100  11.283   9.355   3.336
  762   2HB   LEU 100          HB1       LEU 100  10.623  10.538   4.426
  763    HG   LEU 100           HG       LEU 100  13.016  11.428   2.996
  764   1HD1  LEU 100          HD11      LEU 100  11.999  10.240   1.176
  765   2HD1  LEU 100          HD12      LEU 100  11.527  11.917   1.010
  766   3HD1  LEU 100          HD13      LEU 100  10.397  10.740   1.696
  767   1HD2  LEU 100          HD21      LEU 100  10.279  12.544   3.343
  768   2HD2  LEU 100          HD22      LEU 100  11.706  13.394   2.800
  769   3HD2  LEU 100          HD23      LEU 100  11.601  12.823   4.487
  770    H    THR 101           H        THR 101  13.926   8.012   5.820
  771    HA   THR 101           HA       THR 101  12.387   5.750   5.701
  772    HB   THR 101           HB       THR 101  14.633   6.352   7.625
  773    HG1  THR 101           HG1      THR 101  14.777   5.409   4.955
  774   1HG2  THR 101          HG21      THR 101  13.832   3.812   6.186
  775   2HG2  THR 101          HG22      THR 101  13.574   4.128   7.906
  776   3HG2  THR 101          HG23      THR 101  15.212   3.992   7.267
  777    H    PHE 102           H        PHE 102  12.620   8.135   8.309
  778    HA   PHE 102           HA       PHE 102  10.433   6.769   9.673
  779   1HB   PHE 102          HB2       PHE 102  12.956   7.756  10.968
  780   2HB   PHE 102          HB1       PHE 102  11.515   7.299  11.876
  781    HD1  PHE 102           HD1      PHE 102  10.715   4.897  11.673
  782    HD2  PHE 102           HD2      PHE 102  14.553   6.153  10.342
  783    HE1  PHE 102           HE1      PHE 102  11.491   2.574  11.734
  784    HE2  PHE 102           HE2      PHE 102  15.336   3.823  10.397
  785    HZ   PHE 102           HZ       PHE 102  13.808   2.029  11.091
  Start of MODEL    5
    1    HA   MET   1           HA       MET   1 -14.744  16.464  -2.517
    2   1HB   MET   1          HB2       MET   1 -12.914  17.909  -1.856
    3   2HB   MET   1          HB1       MET   1 -13.310  19.054  -3.123
    4   1HG   MET   1          HG2       MET   1 -14.011  19.841  -0.906
    5   2HG   MET   1          HG1       MET   1 -15.371  19.648  -2.006
    6   1HE   MET   1          HE1       MET   1 -13.432  16.816   0.000
    7   2HE   MET   1          HE2       MET   1 -14.393  16.761   1.478
    8   3HE   MET   1          HE3       MET   1 -13.444  18.199   1.095
    9    H    ALA   2           H        ALA   2 -14.707  19.040  -5.033
   10    HA   ALA   2           HA       ALA   2 -17.509  19.475  -4.584
   11   1HB   ALA   2          HB1       ALA   2 -16.020  21.372  -4.961
   12   2HB   ALA   2          HB2       ALA   2 -17.253  21.278  -6.222
   13   3HB   ALA   2          HB3       ALA   2 -15.608  20.737  -6.551
   14    H    HIS   3           H        HIS   3 -19.077  18.622  -5.632
   15    HA   HIS   3           HA       HIS   3 -20.369  17.600  -7.092
   16   1HB   HIS   3          HB2       HIS   3 -19.600  19.003  -8.919
   17   2HB   HIS   3          HB1       HIS   3 -18.141  18.041  -9.110
   18    HD1  HIS   3           HD1      HIS   3 -21.919  17.705  -9.602
   19    HD2  HIS   3           HD2      HIS   3 -18.365  15.954 -10.852
   20    HE1  HIS   3           HE1      HIS   3 -22.546  16.042 -11.373
   21    H    HIS   4           H        HIS   4 -20.934  15.625  -7.024
   22    HA   HIS   4           HA       HIS   4 -18.877  13.564  -7.279
   23   1HB   HIS   4          HB2       HIS   4 -19.507  13.957  -4.875
   24   2HB   HIS   4          HB1       HIS   4 -21.163  13.548  -5.283
   25    HD1  HIS   4           HD1      HIS   4 -17.871  12.026  -4.447
   26    HD2  HIS   4           HD2      HIS   4 -21.579  10.792  -5.862
   27    HE1  HIS   4           HE1      HIS   4 -17.965   9.542  -4.085
   28    H    HIS   5           H        HIS   5 -22.367  13.877  -6.840
   29    HA   HIS   5           HA       HIS   5 -24.193  13.127  -7.827
   30   1HB   HIS   5          HB2       HIS   5 -23.353  14.456  -9.775
   31   2HB   HIS   5          HB1       HIS   5 -22.578  13.002 -10.395
   32    HD1  HIS   5           HD1      HIS   5 -23.973  11.731 -12.055
   33    HD2  HIS   5           HD2      HIS   5 -26.291  14.075  -9.529
   34    HE1  HIS   5           HE1      HIS   5 -26.345  11.491 -12.859
   35    H    HIS   6           H        HIS   6 -21.626  11.264  -9.310
   36    HA   HIS   6           HA       HIS   6 -22.263   8.917  -7.914
   37   1HB   HIS   6          HB2       HIS   6 -24.082   8.667  -9.556
   38   2HB   HIS   6          HB1       HIS   6 -22.967   8.971 -10.880
   39    HD1  HIS   6           HD1      HIS   6 -22.894   6.775 -12.107
   40    HD2  HIS   6           HD2      HIS   6 -22.574   6.276  -7.995
   41    HE1  HIS   6           HE1      HIS   6 -22.386   4.331 -11.732
   42    H    HIS   7           H        HIS   7 -20.137   9.097  -7.366
   43    HA   HIS   7           HA       HIS   7 -18.197   8.986  -9.521
   44   1HB   HIS   7          HB2       HIS   7 -17.681  10.513  -7.654
   45   2HB   HIS   7          HB1       HIS   7 -17.824   9.190  -6.515
   46    HD1  HIS   7           HD1      HIS   7 -15.323  11.024  -8.457
   47    HD2  HIS   7           HD2      HIS   7 -15.682   7.203  -6.858
   48    HE1  HIS   7           HE1      HIS   7 -13.003  10.077  -8.377
   49    H    HIS   8           H        HIS   8 -18.279   7.043 -10.359
   50    HA   HIS   8           HA       HIS   8 -18.310   4.730  -8.616
   51   1HB   HIS   8          HB2       HIS   8 -19.655   5.010 -10.842
   52   2HB   HIS   8          HB1       HIS   8 -18.108   4.688 -11.621
   53    HD1  HIS   8           HD1      HIS   8 -20.816   3.037  -9.646
   54    HD2  HIS   8           HD2      HIS   8 -17.203   2.061 -11.440
   55    HE1  HIS   8           HE1      HIS   8 -20.691   0.532  -9.621
   56    H    ASN   9           H        ASN   9 -16.386   3.973  -7.951
   57    HA   ASN   9           HA       ASN   9 -13.995   5.008  -9.280
   58   1HB   ASN   9          HB2       ASN   9 -12.786   4.570  -7.266
   59   2HB   ASN   9          HB1       ASN   9 -14.308   5.298  -6.786
   60   1HD2  ASN   9          HD21      ASN   9 -12.540   3.763  -5.212
   61   2HD2  ASN   9          HD22      ASN   9 -13.387   2.393  -4.604
   62    H    GLN  10           H        GLN  10 -15.841   2.519  -9.758
   63    HA   GLN  10           HA       GLN  10 -15.741   0.411 -10.469
   64   1HB   GLN  10          HB2       GLN  10 -13.987  -0.169 -12.164
   65   2HB   GLN  10          HB1       GLN  10 -14.787   1.354 -12.473
   66   1HG   GLN  10          HG2       GLN  10 -12.839   2.559 -11.661
   67   2HG   GLN  10          HG1       GLN  10 -12.057   1.036 -11.250
   68   1HE2  GLN  10          HE21      GLN  10 -13.081   3.116 -13.823
   69   2HE2  GLN  10          HE22      GLN  10 -12.167   2.379 -15.071
   70    H    GLN  11           H        GLN  11 -14.864   0.782  -7.912
   71    HA   GLN  11           HA       GLN  11 -14.127  -0.369  -6.155
   72   1HB   GLN  11          HB2       GLN  11 -13.715  -2.620  -8.137
   73   2HB   GLN  11          HB1       GLN  11 -13.583  -2.797  -6.393
   74   1HG   GLN  11          HG2       GLN  11 -16.057  -2.034  -7.935
   75   2HG   GLN  11          HG1       GLN  11 -15.745  -3.579  -7.149
   76   1HE2  GLN  11          HE21      GLN  11 -16.606  -0.240  -6.677
   77   2HE2  GLN  11          HE22      GLN  11 -17.062  -0.382  -5.031
   78    H    ASN  12           H        ASN  12 -12.359   1.236  -7.814
   79    HA   ASN  12           HA       ASN  12  -9.855   0.330  -6.603
   80   1HB   ASN  12          HB2       ASN  12  -9.654   0.081  -9.046
   81   2HB   ASN  12          HB1       ASN  12 -10.208   1.736  -9.270
   82   1HD2  ASN  12          HD21      ASN  12  -8.358   2.318 -10.347
   83   2HD2  ASN  12          HD22      ASN  12  -6.830   2.516  -9.576
   84    H    LYS  13           H        LYS  13  -9.779   1.601  -4.903
   85    HA   LYS  13           HA       LYS  13 -10.767   4.304  -4.872
   86   1HB   LYS  13          HB2       LYS  13 -10.811   2.841  -2.865
   87   2HB   LYS  13          HB1       LYS  13  -9.059   2.796  -2.886
   88   1HG   LYS  13          HG2       LYS  13  -9.041   5.256  -2.560
   89   2HG   LYS  13          HG1       LYS  13 -10.796   5.197  -2.389
   90   1HD   LYS  13          HD2       LYS  13 -10.535   3.646  -0.487
   91   2HD   LYS  13          HD1       LYS  13  -8.783   3.777  -0.655
   92   1HE   LYS  13          HE2       LYS  13  -9.509   5.256   1.107
   93   2HE   LYS  13          HE1       LYS  13  -8.977   6.218  -0.269
   94   1HZ   LYS  13          HZ1       LYS  13 -11.018   7.106   0.593
   95   2HZ   LYS  13          HZ2       LYS  13 -11.763   5.597   0.484
   96   3HZ   LYS  13          HZ3       LYS  13 -11.332   6.419  -0.919
   97    H    LYS  14           H        LYS  14  -7.659   2.680  -4.630
   98    HA   LYS  14           HA       LYS  14  -5.606   3.196  -5.051
   99   1HB   LYS  14          HB2       LYS  14  -6.375   3.798  -7.331
  100   2HB   LYS  14          HB1       LYS  14  -6.691   5.437  -6.805
  101   1HG   LYS  14          HG2       LYS  14  -3.928   4.245  -6.688
  102   2HG   LYS  14          HG1       LYS  14  -4.549   4.987  -8.156
  103   1HD   LYS  14          HD2       LYS  14  -4.847   7.084  -7.021
  104   2HD   LYS  14          HD1       LYS  14  -4.413   6.360  -5.479
  105   1HE   LYS  14          HE2       LYS  14  -2.160   5.918  -6.336
  106   2HE   LYS  14          HE1       LYS  14  -2.603   6.662  -7.865
  107   1HZ   LYS  14          HZ1       LYS  14  -2.679   8.088  -5.258
  108   2HZ   LYS  14          HZ2       LYS  14  -2.954   8.772  -6.767
  109   3HZ   LYS  14          HZ3       LYS  14  -1.423   8.218  -6.361
  110    H    VAL  15           H        VAL  15  -4.198   3.900  -3.862
  111    HA   VAL  15           HA       VAL  15  -4.264   5.180  -1.643
  112    HB   VAL  15           HB       VAL  15  -2.128   4.469  -3.378
  113   1HG1  VAL  15          HG11      VAL  15  -1.584   6.835  -3.675
  114   2HG1  VAL  15          HG12      VAL  15  -0.360   6.037  -2.679
  115   3HG1  VAL  15          HG13      VAL  15  -1.587   7.060  -1.928
  116   1HG2  VAL  15          HG21      VAL  15  -2.247   5.114  -0.473
  117   2HG2  VAL  15          HG22      VAL  15  -0.965   4.168  -1.242
  118   3HG2  VAL  15          HG23      VAL  15  -2.632   3.551  -1.189
  119    H    GLU  16           H        GLU  16  -4.971   6.932  -0.854
  120    HA   GLU  16           HA       GLU  16  -4.310   9.408  -2.187
  121   1HB   GLU  16          HB2       GLU  16  -6.492  10.343  -1.414
  122   2HB   GLU  16          HB1       GLU  16  -6.623   9.079  -2.626
  123   1HG   GLU  16          HG2       GLU  16  -7.136   7.472  -0.879
  124   2HG   GLU  16          HG1       GLU  16  -7.031   8.747   0.325
  125    H    GLY  17           H        GLY  17  -4.847   7.784   0.926
  126   1HA   GLY  17          HA2       GLY  17  -2.946   9.667   1.936
  127   2HA   GLY  17          HA1       GLY  17  -4.523   9.790   2.731
  128    H    GLY  18           H        GLY  18  -5.023   6.994   2.864
  129   1HA   GLY  18          HA2       GLY  18  -3.125   6.327   4.983
  130   2HA   GLY  18          HA1       GLY  18  -4.679   5.557   4.656
  131    H    TYR  19           H        TYR  19  -3.858   3.486   4.788
  132    HA   TYR  19           HA       TYR  19  -1.873   2.753   2.737
  133   1HB   TYR  19          HB2       TYR  19  -2.710   1.170   5.142
  134   2HB   TYR  19          HB1       TYR  19  -1.275   0.932   4.141
  135    HD1  TYR  19           HD1      TYR  19  -2.280   1.952   7.236
  136    HD2  TYR  19           HD2      TYR  19   0.182   3.285   4.038
  137    HE1  TYR  19           HE1      TYR  19  -1.114   3.354   8.775
  138    HE2  TYR  19           HE2      TYR  19   1.419   4.732   5.590
  139    HH   TYR  19           HH       TYR  19   1.027   5.822   7.683
  140    H    GLU  20           H        GLU  20  -2.678   1.875   1.080
  141    HA   GLU  20           HA       GLU  20  -5.234   0.480   1.291
  142   1HB   GLU  20          HB2       GLU  20  -5.055   2.387  -0.336
  143   2HB   GLU  20          HB1       GLU  20  -3.771   1.501  -1.133
  144   1HG   GLU  20          HG2       GLU  20  -5.416  -0.377  -1.483
  145   2HG   GLU  20          HG1       GLU  20  -6.672   0.747  -0.958
  146    H    CYS  21           H        CYS  21  -5.050  -1.557   1.194
  147    HA   CYS  21           HA       CYS  21  -2.629  -3.016   0.831
  148   1HB   CYS  21          HB2       CYS  21  -5.428  -4.067   0.522
  149   2HB   CYS  21          HB1       CYS  21  -3.981  -5.021   0.828
  150    H    LYS  22           H        LYS  22  -1.986  -4.283  -0.905
  151    HA   LYS  22           HA       LYS  22  -2.675  -3.497  -3.509
  152   1HB   LYS  22          HB2       LYS  22  -0.475  -4.413  -2.952
  153   2HB   LYS  22          HB1       LYS  22  -1.188  -5.944  -2.484
  154   1HG   LYS  22          HG2       LYS  22  -1.409  -4.897  -5.285
  155   2HG   LYS  22          HG1       LYS  22   0.031  -5.769  -4.754
  156   1HD   LYS  22          HD2       LYS  22  -1.305  -7.666  -4.210
  157   2HD   LYS  22          HD1       LYS  22  -2.791  -6.804  -4.597
  158   1HE   LYS  22          HE2       LYS  22  -1.966  -6.556  -6.944
  159   2HE   LYS  22          HE1       LYS  22  -0.591  -7.581  -6.523
  160   1HZ   LYS  22          HZ1       LYS  22  -2.372  -8.849  -7.583
  161   2HZ   LYS  22          HZ2       LYS  22  -3.442  -8.384  -6.380
  162   3HZ   LYS  22          HZ3       LYS  22  -2.153  -9.360  -5.994
  163    H    TYR  23           H        TYR  23  -3.919  -5.907  -1.335
  164    HA   TYR  23           HA       TYR  23  -5.307  -7.217  -3.510
  165   1HB   TYR  23          HB2       TYR  23  -5.743  -8.633  -1.088
  166   2HB   TYR  23          HB1       TYR  23  -4.814  -9.128  -2.491
  167    HD1  TYR  23           HD1      TYR  23  -2.358  -8.505  -2.579
  168    HD2  TYR  23           HD2      TYR  23  -4.686  -8.117   0.950
  169    HE1  TYR  23           HE1      TYR  23  -0.309  -8.460  -1.249
  170    HE2  TYR  23           HE2      TYR  23  -2.647  -8.068   2.301
  171    HH   TYR  23           HH       TYR  23  -0.284  -8.859   2.088
  172    H    CYS  24           H        CYS  24  -5.949  -4.830  -1.406
  173    HA   CYS  24           HA       CYS  24  -8.719  -5.139  -1.954
  174   1HB   CYS  24          HB2       CYS  24  -9.554  -4.971   0.321
  175   2HB   CYS  24          HB1       CYS  24  -8.368  -6.266   0.260
  176    H    THR  25           H        THR  25  -9.575  -3.187  -2.357
  177    HA   THR  25           HA       THR  25  -7.686  -1.034  -2.435
  178    HB   THR  25           HB       THR  25  -9.310  -1.702  -4.317
  179    HG1  THR  25           HG1      THR  25  -8.131   0.398  -3.875
  180   1HG2  THR  25          HG21      THR  25 -11.535  -0.643  -4.254
  181   2HG2  THR  25          HG22      THR  25 -11.235  -0.118  -2.597
  182   3HG2  THR  25          HG23      THR  25 -11.364  -1.837  -2.965
  183    H    PHE  26           H        PHE  26  -9.549  -2.172  -0.112
  184    HA   PHE  26           HA       PHE  26 -10.660   0.236   0.935
  185   1HB   PHE  26          HB2       PHE  26 -10.265  -2.486   2.212
  186   2HB   PHE  26          HB1       PHE  26 -11.174  -1.159   2.932
  187    HD1  PHE  26           HD1      PHE  26 -13.245  -0.343   1.815
  188    HD2  PHE  26           HD2      PHE  26 -11.244  -3.874   0.557
  189    HE1  PHE  26           HE1      PHE  26 -15.258  -1.045   0.595
  190    HE2  PHE  26           HE2      PHE  26 -13.258  -4.583  -0.664
  191    HZ   PHE  26           HZ       PHE  26 -15.258  -3.172  -0.653
  192    H    GLN  27           H        GLN  27  -9.568   1.696   1.847
  193    HA   GLN  27           HA       GLN  27  -6.832   1.142   2.695
  194   1HB   GLN  27          HB2       GLN  27  -6.708   2.538   0.857
  195   2HB   GLN  27          HB1       GLN  27  -8.135   3.459   1.328
  196   1HG   GLN  27          HG2       GLN  27  -6.879   4.585   3.027
  197   2HG   GLN  27          HG1       GLN  27  -5.529   3.477   2.757
  198   1HE2  GLN  27          HE21      GLN  27  -4.189   3.890   1.312
  199   2HE2  GLN  27          HE22      GLN  27  -4.072   5.253   0.269
  200    H    THR  28           H        THR  28  -6.075   1.918   4.575
  201    HA   THR  28           HA       THR  28  -7.771   3.625   6.140
  202    HB   THR  28           HB       THR  28  -8.397   1.351   6.833
  203    HG1  THR  28           HG1      THR  28  -8.042   1.580   9.008
  204   1HG2  THR  28          HG21      THR  28  -6.791  -0.140   7.959
  205   2HG2  THR  28          HG22      THR  28  -5.503   1.000   7.629
  206   3HG2  THR  28          HG23      THR  28  -6.307   0.177   6.294
  207    HA   PRO  29           HA       PRO  29  -3.669   5.383   6.688
  208   1HB   PRO  29          HB2       PRO  29  -4.476   7.438   8.306
  209   2HB   PRO  29          HB1       PRO  29  -4.616   7.445   6.542
  210   1HG   PRO  29          HG2       PRO  29  -6.690   6.827   8.597
  211   2HG   PRO  29          HG1       PRO  29  -6.840   7.773   7.107
  212   1HD   PRO  29          HD2       PRO  29  -7.711   5.221   7.278
  213   2HD   PRO  29          HD1       PRO  29  -7.003   5.864   5.774
  214    H    ASP  30           H        ASP  30  -5.518   3.827   8.945
  215    HA   ASP  30           HA       ASP  30  -3.629   4.277  11.127
  216   1HB   ASP  30          HB2       ASP  30  -6.203   2.704  10.985
  217   2HB   ASP  30          HB1       ASP  30  -5.159   2.739  12.400
  218    H    LEU  31           H        LEU  31  -1.858   3.086  11.013
  219    HA   LEU  31           HA       LEU  31  -1.401   0.890   9.428
  220   1HB   LEU  31          HB2       LEU  31   0.148   2.465  10.854
  221   2HB   LEU  31          HB1       LEU  31  -0.006   1.211  12.063
  222    HG   LEU  31           HG       LEU  31   2.063   0.866  10.897
  223   1HD1  LEU  31          HD11      LEU  31   0.897  -1.199  11.400
  224   2HD1  LEU  31          HD12      LEU  31   1.789  -1.342   9.870
  225   3HD1  LEU  31          HD13      LEU  31   0.041  -1.057   9.865
  226   1HD2  LEU  31          HD21      LEU  31   0.455   0.906   8.377
  227   2HD2  LEU  31          HD22      LEU  31   2.198   0.596   8.481
  228   3HD2  LEU  31          HD23      LEU  31   1.529   2.175   8.942
  229    H    ASN  32           H        ASN  32  -2.413   1.060  12.854
  230    HA   ASN  32           HA       ASN  32  -2.296  -1.600  13.563
  231   1HB   ASN  32          HB2       ASN  32  -2.872   0.547  14.944
  232   2HB   ASN  32          HB1       ASN  32  -4.509   0.201  14.369
  233   1HD2  ASN  32          HD21      ASN  32  -4.121  -2.758  14.550
  234   2HD2  ASN  32          HD22      ASN  32  -4.185  -3.057  16.223
  235    H    MET  33           H        MET  33  -4.904   0.268  12.058
  236    HA   MET  33           HA       MET  33  -6.711  -1.954  11.995
  237   1HB   MET  33          HB2       MET  33  -6.838   0.621  10.433
  238   2HB   MET  33          HB1       MET  33  -8.147  -0.533  10.627
  239   1HG   MET  33          HG2       MET  33  -6.820   1.032  12.769
  240   2HG   MET  33          HG1       MET  33  -8.411   1.397  12.085
  241   1HE   MET  33          HE1       MET  33  -9.593  -1.647  11.800
  242   2HE   MET  33          HE2       MET  33 -10.532  -0.270  12.370
  243   3HE   MET  33          HE3       MET  33 -10.488  -1.757  13.315
  244    H    PHE  34           H        PHE  34  -4.404  -0.520   9.869
  245    HA   PHE  34           HA       PHE  34  -5.097  -1.857   7.507
  246   1HB   PHE  34          HB2       PHE  34  -3.582   0.018   7.397
  247   2HB   PHE  34          HB1       PHE  34  -2.454  -0.745   8.482
  248    HD1  PHE  34           HD1      PHE  34  -0.683  -1.956   7.659
  249    HD2  PHE  34           HD2      PHE  34  -4.002  -1.182   5.100
  250    HE1  PHE  34           HE1      PHE  34   0.563  -2.897   5.744
  251    HE2  PHE  34           HE2      PHE  34  -2.766  -2.116   3.207
  252    HZ   PHE  34           HZ       PHE  34  -0.485  -2.978   3.520
  253    H    THR  35           H        THR  35  -2.627  -2.683   9.894
  254    HA   THR  35           HA       THR  35  -2.084  -5.181   8.651
  255    HB   THR  35           HB       THR  35  -0.287  -4.258   9.949
  256    HG1  THR  35           HG1      THR  35  -0.365  -6.501  10.019
  257   1HG2  THR  35          HG21      THR  35  -2.117  -4.404  12.340
  258   2HG2  THR  35          HG22      THR  35  -1.546  -2.946  11.520
  259   3HG2  THR  35          HG23      THR  35  -0.401  -3.969  12.395
  260    H    PHE  36           H        PHE  36  -4.290  -4.174  11.101
  261    HA   PHE  36           HA       PHE  36  -4.945  -6.724  12.070
  262   1HB   PHE  36          HB2       PHE  36  -5.625  -4.976  13.451
  263   2HB   PHE  36          HB1       PHE  36  -6.396  -4.079  12.156
  264    HD1  PHE  36           HD1      PHE  36  -6.646  -7.509  13.606
  265    HD2  PHE  36           HD2      PHE  36  -8.681  -4.006  12.350
  266    HE1  PHE  36           HE1      PHE  36  -8.798  -8.538  14.247
  267    HE2  PHE  36           HE2      PHE  36 -10.838  -5.016  12.978
  268    HZ   PHE  36           HZ       PHE  36 -10.896  -7.290  13.925
  269    H    HIS  37           H        HIS  37  -6.588  -4.700   9.636
  270    HA   HIS  37           HA       HIS  37  -8.439  -6.754   9.103
  271   1HB   HIS  37          HB2       HIS  37  -9.439  -5.338   7.517
  272   2HB   HIS  37          HB1       HIS  37  -8.651  -4.223   8.628
  273    HD1  HIS  37           HD1      HIS  37  -7.179  -2.492   7.556
  274    HD2  HIS  37           HD2      HIS  37  -7.997  -5.682   5.053
  275    HE1  HIS  37           HE1      HIS  37  -6.316  -1.813   5.263
  276    H    VAL  38           H        VAL  38  -5.289  -6.071   7.951
  277    HA   VAL  38           HA       VAL  38  -5.368  -7.717   5.662
  278    HB   VAL  38           HB       VAL  38  -3.074  -6.748   7.354
  279   1HG1  VAL  38          HG11      VAL  38  -1.536  -7.652   5.607
  280   2HG1  VAL  38          HG12      VAL  38  -2.921  -8.397   4.803
  281   3HG1  VAL  38          HG13      VAL  38  -2.440  -8.938   6.412
  282   1HG2  VAL  38          HG21      VAL  38  -2.509  -5.452   5.342
  283   2HG2  VAL  38          HG22      VAL  38  -4.128  -5.092   5.948
  284   3HG2  VAL  38          HG23      VAL  38  -3.927  -6.123   4.534
  285    H    ASP  39           H        ASP  39  -4.074  -8.346   8.941
  286    HA   ASP  39           HA       ASP  39  -3.427 -11.031   8.309
  287   1HB   ASP  39          HB2       ASP  39  -2.444  -9.641  10.174
  288   2HB   ASP  39          HB1       ASP  39  -3.941  -9.907  11.060
  289    H    SER  40           H        SER  40  -6.307  -9.490   9.236
  290    HA   SER  40           HA       SER  40  -7.585 -11.873  10.238
  291   1HB   SER  40          HB2       SER  40  -8.014  -9.581  11.151
  292   2HB   SER  40          HB1       SER  40  -8.773  -9.166   9.623
  293    HG   SER  40           HG       SER  40 -10.447  -9.798  10.722
  294    H    GLU  41           H        GLU  41  -7.654  -9.906   7.295
  295    HA   GLU  41           HA       GLU  41  -9.740 -11.692   6.226
  296   1HB   GLU  41          HB2       GLU  41  -8.852  -8.972   5.323
  297   2HB   GLU  41          HB1       GLU  41 -10.100  -9.935   4.538
  298   1HG   GLU  41          HG2       GLU  41 -11.496  -9.834   6.455
  299   2HG   GLU  41          HG1       GLU  41 -10.208  -9.117   7.418
  300    H    HIS  42           H        HIS  42  -6.646 -10.275   5.321
  301    HA   HIS  42           HA       HIS  42  -6.291 -12.382   3.368
  302   1HB   HIS  42          HB2       HIS  42  -4.966 -10.330   2.240
  303   2HB   HIS  42          HB1       HIS  42  -6.559 -10.811   1.682
  304    HD1  HIS  42           HD1      HIS  42  -8.544  -9.134   2.547
  305    HD2  HIS  42           HD2      HIS  42  -4.662  -7.818   3.298
  306    HE1  HIS  42           HE1      HIS  42  -8.757  -6.730   3.131
  307    HA   PRO  43           HA       PRO  43  -2.812 -11.787   6.481
  308   1HB   PRO  43          HB2       PRO  43  -2.443 -14.479   6.904
  309   2HB   PRO  43          HB1       PRO  43  -3.495 -13.459   7.891
  310   1HG   PRO  43          HG2       PRO  43  -4.194 -15.298   5.645
  311   2HG   PRO  43          HG1       PRO  43  -5.044 -15.024   7.176
  312   1HD   PRO  43          HD2       PRO  43  -5.901 -13.928   4.876
  313   2HD   PRO  43          HD1       PRO  43  -6.022 -13.073   6.431
  314    H    ASN  44           H        ASN  44  -3.155 -14.196   3.959
  315    HA   ASN  44           HA       ASN  44  -0.607 -13.424   2.847
  316   1HB   ASN  44          HB2       ASN  44  -0.276 -15.350   4.553
  317   2HB   ASN  44          HB1       ASN  44  -1.151 -16.344   3.391
  318   1HD2  ASN  44          HD21      ASN  44   1.570 -16.514   4.360
  319   2HD2  ASN  44          HD22      ASN  44   2.588 -16.413   2.974
  320    H    VAL  45           H        VAL  45  -0.710 -13.661   0.638
  321    HA   VAL  45           HA       VAL  45  -3.152 -14.816  -0.476
  322    HB   VAL  45           HB       VAL  45  -3.236 -12.643  -1.945
  323   1HG1  VAL  45          HG11      VAL  45  -4.688 -11.577  -0.311
  324   2HG1  VAL  45          HG12      VAL  45  -4.024 -12.619   0.958
  325   3HG1  VAL  45          HG13      VAL  45  -4.962 -13.325  -0.374
  326   1HG2  VAL  45          HG21      VAL  45  -1.155 -11.707  -1.144
  327   2HG2  VAL  45          HG22      VAL  45  -1.797 -11.707   0.504
  328   3HG2  VAL  45          HG23      VAL  45  -2.528 -10.674  -0.718
  329    H    VAL  46           H        VAL  46  -3.031 -14.194  -3.012
  330    HA   VAL  46           HA       VAL  46  -0.415 -15.072  -3.818
  331    HB   VAL  46           HB       VAL  46  -1.484 -16.309  -5.738
  332   1HG1  VAL  46          HG11      VAL  46  -0.792 -17.511  -3.742
  333   2HG1  VAL  46          HG12      VAL  46  -2.268 -18.212  -4.407
  334   3HG1  VAL  46          HG13      VAL  46  -2.348 -17.173  -2.983
  335   1HG2  VAL  46          HG21      VAL  46  -3.890 -16.838  -5.608
  336   2HG2  VAL  46          HG22      VAL  46  -3.616 -15.110  -5.836
  337   3HG2  VAL  46          HG23      VAL  46  -4.052 -15.731  -4.243
  338    H    LEU  47           H        LEU  47   0.525 -14.061  -5.542
  339    HA   LEU  47           HA       LEU  47  -0.833 -12.351  -7.339
  340   1HB   LEU  47          HB2       LEU  47   0.316 -10.220  -6.676
  341   2HB   LEU  47          HB1       LEU  47  -0.954 -10.724  -5.592
  342    HG   LEU  47           HG       LEU  47   1.937 -11.284  -4.958
  343   1HD1  LEU  47          HD11      LEU  47   1.944  -9.192  -3.684
  344   2HD1  LEU  47          HD12      LEU  47   0.336  -8.811  -4.294
  345   3HD1  LEU  47          HD13      LEU  47   1.708  -8.868  -5.401
  346   1HD2  LEU  47          HD21      LEU  47   1.095 -11.234  -2.664
  347   2HD2  LEU  47          HD22      LEU  47   0.210 -12.416  -3.631
  348   3HD2  LEU  47          HD23      LEU  47  -0.521 -10.855  -3.262
  349    H    ASN  48           H        ASN  48   0.721 -11.163  -8.734
  350    HA   ASN  48           HA       ASN  48   2.904 -12.930  -9.424
  351   1HB   ASN  48          HB2       ASN  48   1.495 -11.945 -11.197
  352   2HB   ASN  48          HB1       ASN  48   2.019 -10.336 -10.722
  353   1HD2  ASN  48          HD21      ASN  48   3.013  -9.770 -12.603
  354   2HD2  ASN  48          HD22      ASN  48   4.411 -10.565 -13.209
  355    H    SER  49           H        SER  49   2.877  -9.350  -9.241
  356    HA   SER  49           HA       SER  49   5.017  -9.302  -7.380
  357   1HB   SER  49          HB2       SER  49   6.557  -8.009  -8.873
  358   2HB   SER  49          HB1       SER  49   6.338  -9.670  -9.411
  359    HG   SER  49           HG       SER  49   4.514  -8.473 -10.715
  360    H    SER  50           H        SER  50   5.254  -7.153  -6.468
  361    HA   SER  50           HA       SER  50   3.662  -5.017  -7.392
  362   1HB   SER  50          HB2       SER  50   3.066  -6.548  -4.864
  363   2HB   SER  50          HB1       SER  50   2.443  -4.945  -5.228
  364    HG   SER  50           HG       SER  50   1.951  -6.545  -7.297
  365    H    TYR  51           H        TYR  51   3.904  -3.295  -5.568
  366    HA   TYR  51           HA       TYR  51   6.641  -3.443  -4.520
  367   1HB   TYR  51          HB2       TYR  51   5.059  -1.201  -5.696
  368   2HB   TYR  51          HB1       TYR  51   6.319  -0.878  -4.522
  369    HD1  TYR  51           HD1      TYR  51   7.738   0.372  -5.824
  370    HD2  TYR  51           HD2      TYR  51   6.474  -3.427  -7.244
  371    HE1  TYR  51           HE1      TYR  51   9.397   0.502  -7.655
  372    HE2  TYR  51           HE2      TYR  51   8.104  -3.303  -9.073
  373    HH   TYR  51           HH       TYR  51   9.229  -1.436 -10.315
  374    H    VAL  52           H        VAL  52   6.980  -2.726  -2.476
  375    HA   VAL  52           HA       VAL  52   4.648  -1.927  -0.885
  376    HB   VAL  52           HB       VAL  52   5.139  -4.358  -0.497
  377   1HG1  VAL  52          HG11      VAL  52   7.107  -5.019   0.684
  378   2HG1  VAL  52          HG12      VAL  52   7.703  -3.383   0.640
  379   3HG1  VAL  52          HG13      VAL  52   7.510  -4.305  -0.878
  380   1HG2  VAL  52          HG21      VAL  52   5.767  -2.646   1.877
  381   2HG2  VAL  52          HG22      VAL  52   5.324  -4.354   1.925
  382   3HG2  VAL  52          HG23      VAL  52   4.171  -3.160   1.333
  383    H    CYS  53           H        CYS  53   5.053  -0.284   0.454
  384    HA   CYS  53           HA       CYS  53   7.674   1.001   0.443
  385   1HB   CYS  53          HB2       CYS  53   5.678   2.387   0.507
  386   2HB   CYS  53          HB1       CYS  53   5.078   1.538   1.915
  387    H    VAL  54           H        VAL  54   9.136  -0.334   1.529
  388    HA   VAL  54           HA       VAL  54   8.599  -2.085   3.598
  389    HB   VAL  54           HB       VAL  54  11.150  -0.819   4.047
  390   1HG1  VAL  54          HG11      VAL  54  12.017  -2.955   3.551
  391   2HG1  VAL  54          HG12      VAL  54  10.484  -3.393   2.809
  392   3HG1  VAL  54          HG13      VAL  54  10.564  -3.137   4.577
  393   1HG2  VAL  54          HG21      VAL  54  10.497  -1.481   1.201
  394   2HG2  VAL  54          HG22      VAL  54  12.136  -1.434   1.827
  395   3HG2  VAL  54          HG23      VAL  54  11.131   0.013   1.862
  396    H    GLU  55           H        GLU  55   9.194   1.288   3.630
  397    HA   GLU  55           HA       GLU  55   9.738   1.830   6.291
  398   1HB   GLU  55          HB2       GLU  55   8.173   3.558   4.381
  399   2HB   GLU  55          HB1       GLU  55   9.083   4.114   5.768
  400   1HG   GLU  55          HG2       GLU  55  10.321   2.777   3.367
  401   2HG   GLU  55          HG1       GLU  55  10.164   4.518   3.557
  402    H    CYS  56           H        CYS  56   6.743   1.513   4.600
  403    HA   CYS  56           HA       CYS  56   5.167   1.927   7.122
  404   1HB   CYS  56          HB2       CYS  56   4.168   1.596   4.325
  405   2HB   CYS  56          HB1       CYS  56   3.253   2.219   5.691
  406    H    ASN  57           H        ASN  57   6.278  -0.334   5.004
  407    HA   ASN  57           HA       ASN  57   5.845  -2.335   4.264
  408   1HB   ASN  57          HB2       ASN  57   6.230  -2.567   6.866
  409   2HB   ASN  57          HB1       ASN  57   4.650  -3.283   6.801
  410   1HD2  ASN  57          HD21      ASN  57   7.662  -3.387   5.476
  411   2HD2  ASN  57          HD22      ASN  57   7.694  -5.099   5.204
  412    H    PHE  58           H        PHE  58   4.366  -1.292   2.960
  413    HA   PHE  58           HA       PHE  58   1.781  -2.428   3.379
  414   1HB   PHE  58          HB2       PHE  58   0.491  -0.507   3.391
  415   2HB   PHE  58          HB1       PHE  58   1.991   0.234   3.919
  416    HD1  PHE  58           HD1      PHE  58  -0.381  -0.140   1.192
  417    HD2  PHE  58           HD2      PHE  58   3.232   1.664   2.399
  418    HE1  PHE  58           HE1      PHE  58  -0.511   1.426  -0.769
  419    HE2  PHE  58           HE2      PHE  58   3.115   3.221   0.435
  420    HZ   PHE  58           HZ       PHE  58   1.255   3.076  -1.117
  421    H    LEU  59           H        LEU  59   1.032  -3.343   1.518
  422    HA   LEU  59           HA       LEU  59   2.636  -3.046  -0.888
  423   1HB   LEU  59          HB2       LEU  59   0.932  -5.165   0.264
  424   2HB   LEU  59          HB1       LEU  59   0.866  -5.056  -1.476
  425    HG   LEU  59           HG       LEU  59   3.458  -5.350   0.026
  426   1HD1  LEU  59          HD11      LEU  59   1.730  -7.433  -1.314
  427   2HD1  LEU  59          HD12      LEU  59   1.917  -7.256   0.432
  428   3HD1  LEU  59          HD13      LEU  59   3.304  -7.714  -0.559
  429   1HD2  LEU  59          HD21      LEU  59   3.633  -4.431  -2.228
  430   2HD2  LEU  59          HD22      LEU  59   2.635  -5.731  -2.855
  431   3HD2  LEU  59          HD23      LEU  59   4.224  -6.088  -2.199
  432    H    THR  60           H        THR  60   1.795  -2.293  -2.756
  433    HA   THR  60           HA       THR  60  -1.026  -1.534  -2.787
  434    HB   THR  60           HB       THR  60  -0.133   0.571  -2.466
  435    HG1  THR  60           HG1      THR  60   0.415   0.977  -5.060
  436   1HG2  THR  60          HG21      THR  60   1.985   1.394  -3.451
  437   2HG2  THR  60          HG22      THR  60   2.205  -0.191  -4.191
  438   3HG2  THR  60          HG23      THR  60   2.180  -0.027  -2.432
  439    H    LYS  61           H        LYS  61  -1.978  -1.340  -4.880
  440    HA   LYS  61           HA       LYS  61  -1.053  -3.506  -6.563
  441   1HB   LYS  61          HB2       LYS  61  -3.427  -3.197  -5.681
  442   2HB   LYS  61          HB1       LYS  61  -3.586  -1.886  -6.833
  443   1HG   LYS  61          HG2       LYS  61  -3.365  -3.403  -8.678
  444   2HG   LYS  61          HG1       LYS  61  -2.947  -4.734  -7.596
  445   1HD   LYS  61          HD2       LYS  61  -5.172  -4.494  -6.519
  446   2HD   LYS  61          HD1       LYS  61  -5.591  -3.279  -7.727
  447   1HE   LYS  61          HE2       LYS  61  -5.348  -4.934  -9.495
  448   2HE   LYS  61          HE1       LYS  61  -4.823  -6.137  -8.321
  449   1HZ   LYS  61          HZ1       LYS  61  -7.029  -5.981  -7.267
  450   2HZ   LYS  61          HZ2       LYS  61  -7.136  -6.451  -8.872
  451   3HZ   LYS  61          HZ3       LYS  61  -7.499  -4.859  -8.437
  452    H    ARG  62           H        ARG  62  -0.376  -0.327  -6.506
  453    HA   ARG  62           HA       ARG  62   0.448  -0.487  -9.273
  454   1HB   ARG  62          HB2       ARG  62  -0.408   1.603 -10.034
  455   2HB   ARG  62          HB1       ARG  62  -1.755   0.808  -9.252
  456   1HG   ARG  62          HG2       ARG  62  -0.066   2.988  -8.044
  457   2HG   ARG  62          HG1       ARG  62  -1.617   3.253  -8.802
  458   1HD   ARG  62          HD2       ARG  62  -1.048   1.650  -6.322
  459   2HD   ARG  62          HD1       ARG  62  -1.784   3.251  -6.419
  460    HE   ARG  62           HE       ARG  62  -3.372   1.544  -7.921
  461   1HH1  ARG  62          HH11      ARG  62  -2.213   1.534  -4.583
  462   2HH1  ARG  62          HH12      ARG  62  -3.793   1.307  -3.949
  463   1HH2  ARG  62          HH21      ARG  62  -5.495   1.008  -6.986
  464   2HH2  ARG  62          HH22      ARG  62  -5.620   0.895  -5.289
  465    H    TYR  63           H        TYR  63   2.240   0.784  -9.805
  466    HA   TYR  63           HA       TYR  63   4.094   0.866  -7.672
  467   1HB   TYR  63          HB2       TYR  63   5.740   1.547  -9.406
  468   2HB   TYR  63          HB1       TYR  63   4.836   0.100  -9.818
  469    HD1  TYR  63           HD1      TYR  63   3.292   0.094 -11.696
  470    HD2  TYR  63           HD2      TYR  63   5.381   3.645 -10.644
  471    HE1  TYR  63           HE1      TYR  63   2.679   1.092 -13.853
  472    HE2  TYR  63           HE2      TYR  63   4.769   4.654 -12.798
  473    HH   TYR  63           HH       TYR  63   2.428   3.278 -14.866
  474    H    ASP  64           H        ASP  64   2.223   3.381  -9.201
  475    HA   ASP  64           HA       ASP  64   3.953   5.483  -8.531
  476   1HB   ASP  64          HB2       ASP  64   1.902   6.921  -8.765
  477   2HB   ASP  64          HB1       ASP  64   2.471   6.054 -10.208
  478    H    ALA  65           H        ALA  65   1.562   3.905  -6.643
  479    HA   ALA  65           HA       ALA  65   1.178   5.869  -4.659
  480   1HB   ALA  65          HB1       ALA  65   1.151   2.868  -4.367
  481   2HB   ALA  65          HB2       ALA  65  -0.234   3.901  -4.719
  482   3HB   ALA  65          HB3       ALA  65   0.548   3.985  -3.154
  483    H    LEU  66           H        LEU  66   3.888   3.834  -5.244
  484    HA   LEU  66           HA       LEU  66   5.174   4.318  -2.702
  485   1HB   LEU  66          HB2       LEU  66   6.320   3.189  -5.224
  486   2HB   LEU  66          HB1       LEU  66   7.087   3.175  -3.652
  487    HG   LEU  66           HG       LEU  66   6.337   1.040  -3.903
  488   1HD1  LEU  66          HD11      LEU  66   5.642   1.934  -1.741
  489   2HD1  LEU  66          HD12      LEU  66   4.511   0.701  -2.323
  490   3HD1  LEU  66          HD13      LEU  66   4.101   2.410  -2.474
  491   1HD2  LEU  66          HD21      LEU  66   5.048   1.324  -5.897
  492   2HD2  LEU  66          HD22      LEU  66   3.770   2.129  -5.002
  493   3HD2  LEU  66          HD23      LEU  66   4.101   0.411  -4.714
  494    H    SER  67           H        SER  67   5.189   5.621  -5.846
  495    HA   SER  67           HA       SER  67   7.622   7.134  -5.604
  496   1HB   SER  67          HB2       SER  67   5.414   6.830  -7.482
  497   2HB   SER  67          HB1       SER  67   6.462   8.235  -7.673
  498    HG   SER  67           HG       SER  67   8.182   6.486  -7.505
  499    H    GLU  68           H        GLU  68   4.246   7.808  -5.492
  500    HA   GLU  68           HA       GLU  68   4.590  10.573  -4.849
  501   1HB   GLU  68          HB2       GLU  68   2.047   9.239  -4.140
  502   2HB   GLU  68          HB1       GLU  68   2.387  10.782  -4.924
  503   1HG   GLU  68          HG2       GLU  68   3.117   9.465  -6.950
  504   2HG   GLU  68          HG1       GLU  68   2.528   8.079  -6.122
  505    H    HIS  69           H        HIS  69   4.615   7.687  -3.225
  506    HA   HIS  69           HA       HIS  69   3.595   8.154  -0.724
  507   1HB   HIS  69          HB2       HIS  69   4.660   6.061  -1.705
  508   2HB   HIS  69          HB1       HIS  69   6.183   6.741  -1.085
  509    HD1  HIS  69           HD1      HIS  69   2.891   5.368   0.021
  510    HD2  HIS  69           HD2      HIS  69   6.535   6.564   1.472
  511    HE1  HIS  69           HE1      HIS  69   2.919   4.610   2.425
  512    H    ASN  70           H        ASN  70   7.069   8.694  -1.555
  513    HA   ASN  70           HA       ASN  70   7.578  10.174   0.828
  514   1HB   ASN  70          HB2       ASN  70   9.732  10.744  -0.249
  515   2HB   ASN  70          HB1       ASN  70   9.411   9.018  -0.144
  516   1HD2  ASN  70          HD21      ASN  70  11.233  10.106  -1.722
  517   2HD2  ASN  70          HD22      ASN  70  10.823   9.856  -3.401
  518    H    LEU  71           H        LEU  71   5.978  11.017  -1.862
  519    HA   LEU  71           HA       LEU  71   6.565  13.834  -1.735
  520   1HB   LEU  71          HB2       LEU  71   5.966  13.277  -3.890
  521   2HB   LEU  71          HB1       LEU  71   4.869  12.022  -3.381
  522    HG   LEU  71           HG       LEU  71   3.185  13.669  -2.910
  523   1HD1  LEU  71          HD11      LEU  71   5.188  15.661  -4.050
  524   2HD1  LEU  71          HD12      LEU  71   4.630  15.620  -2.376
  525   3HD1  LEU  71          HD13      LEU  71   3.509  16.040  -3.674
  526   1HD2  LEU  71          HD21      LEU  71   4.370  13.890  -5.664
  527   2HD2  LEU  71          HD22      LEU  71   2.722  14.339  -5.233
  528   3HD2  LEU  71          HD23      LEU  71   3.244  12.663  -5.084
  529    H    LYS  72           H        LYS  72   3.865  11.724  -0.872
  530    HA   LYS  72           HA       LYS  72   2.829  13.913   0.770
  531   1HB   LYS  72          HB2       LYS  72   0.708  12.275   0.561
  532   2HB   LYS  72          HB1       LYS  72   0.973  13.703  -0.466
  533   1HG   LYS  72          HG2       LYS  72   2.169  12.062  -1.996
  534   2HG   LYS  72          HG1       LYS  72   1.476  10.779  -1.057
  535   1HD   LYS  72          HD2       LYS  72  -0.013  12.932  -2.557
  536   2HD   LYS  72          HD1       LYS  72   0.067  11.210  -2.941
  537   1HE   LYS  72          HE2       LYS  72  -1.170  10.687  -0.889
  538   2HE   LYS  72          HE1       LYS  72  -1.180  12.388  -0.454
  539   1HZ   LYS  72          HZ1       LYS  72  -2.533  12.857  -2.374
  540   2HZ   LYS  72          HZ2       LYS  72  -3.278  11.691  -1.409
  541   3HZ   LYS  72          HZ3       LYS  72  -2.510  11.239  -2.852
  542    H    TYR  73           H        TYR  73   3.442  10.568   0.899
  543    HA   TYR  73           HA       TYR  73   2.393  10.230   3.567
  544   1HB   TYR  73          HB2       TYR  73   3.851   8.424   1.692
  545   2HB   TYR  73          HB1       TYR  73   3.354   7.896   3.296
  546    HD1  TYR  73           HD1      TYR  73   1.840   9.645   0.365
  547    HD2  TYR  73           HD2      TYR  73   1.447   6.617   3.303
  548    HE1  TYR  73           HE1      TYR  73  -0.271   9.027  -0.595
  549    HE2  TYR  73           HE2      TYR  73  -0.723   5.974   2.337
  550    HH   TYR  73           HH       TYR  73  -2.351   6.850   1.128
  551    H    HIS  74           H        HIS  74   5.606   9.963   2.076
  552    HA   HIS  74           HA       HIS  74   6.762  10.663   4.723
  553   1HB   HIS  74          HB2       HIS  74   8.021   9.029   2.508
  554   2HB   HIS  74          HB1       HIS  74   8.871   9.511   3.973
  555    HD1  HIS  74           HD1      HIS  74   6.783   8.584   6.088
  556    HD2  HIS  74           HD2      HIS  74   7.888   6.421   2.740
  557    HE1  HIS  74           HE1      HIS  74   6.136   6.183   6.565
  558    HA   PRO  75           HA       PRO  75   7.608  13.888   1.501
  559   1HB   PRO  75          HB2       PRO  75   6.765  16.028   2.815
  560   2HB   PRO  75          HB1       PRO  75   5.617  14.929   2.032
  561   1HG   PRO  75          HG2       PRO  75   6.445  15.003   4.927
  562   2HG   PRO  75          HG1       PRO  75   4.801  14.906   4.250
  563   1HD   PRO  75          HD2       PRO  75   6.171  12.726   5.127
  564   2HD   PRO  75          HD1       PRO  75   5.026  12.681   3.771
  565    H    GLY  76           H        GLY  76   9.129  15.417   1.292
  566   1HA   GLY  76          HA2       GLY  76  10.584  16.948   2.803
  567   2HA   GLY  76          HA1       GLY  76  11.207  15.397   3.354
  568    H    GLU  77           H        GLU  77  11.371  13.958   1.054
  569    HA   GLU  77           HA       GLU  77  12.854  15.425  -0.928
  570   1HB   GLU  77          HB2       GLU  77  14.931  14.131  -0.610
  571   2HB   GLU  77          HB1       GLU  77  14.578  15.156   0.771
  572   1HG   GLU  77          HG2       GLU  77  14.987  13.338   2.017
  573   2HG   GLU  77          HG1       GLU  77  13.414  12.768   1.441
  574    H    GLU  78           H        GLU  78  13.760  13.745  -2.540
  575    HA   GLU  78           HA       GLU  78  11.829  11.555  -2.633
  576   1HB   GLU  78          HB2       GLU  78  11.071  13.418  -4.057
  577   2HB   GLU  78          HB1       GLU  78  12.640  13.305  -4.866
  578   1HG   GLU  78          HG2       GLU  78  12.100  11.117  -5.720
  579   2HG   GLU  78          HG1       GLU  78  10.577  11.104  -4.833
  580    H    ASN  79           H        ASN  79  13.410  10.133  -2.011
  581    HA   ASN  79           HA       ASN  79  15.146   9.218  -4.165
  582   1HB   ASN  79          HB2       ASN  79  16.042   9.873  -1.362
  583   2HB   ASN  79          HB1       ASN  79  17.053   9.004  -2.527
  584   1HD2  ASN  79          HD21      ASN  79  15.626  11.954  -1.616
  585   2HD2  ASN  79          HD22      ASN  79  16.466  13.070  -2.630
  586    H    PHE  80           H        PHE  80  13.793   7.446  -4.241
  587    HA   PHE  80           HA       PHE  80  13.658   5.746  -1.860
  588   1HB   PHE  80          HB2       PHE  80  11.854   6.236  -4.113
  589   2HB   PHE  80          HB1       PHE  80  12.136   4.531  -3.816
  590    HD1  PHE  80           HD1      PHE  80  10.272   7.409  -2.902
  591    HD2  PHE  80           HD2      PHE  80  11.724   3.719  -1.422
  592    HE1  PHE  80           HE1      PHE  80   8.486   7.388  -1.184
  593    HE2  PHE  80           HE2      PHE  80   9.951   3.681   0.261
  594    HZ   PHE  80           HZ       PHE  80   8.324   5.520   0.381
  595    H    LYS  81           H        LYS  81  14.290   3.593  -1.988
  596    HA   LYS  81           HA       LYS  81  16.048   2.894  -4.245
  597   1HB   LYS  81          HB2       LYS  81  17.557   2.012  -2.701
  598   2HB   LYS  81          HB1       LYS  81  16.729   3.159  -1.649
  599   1HG   LYS  81          HG2       LYS  81  15.335   1.483  -0.738
  600   2HG   LYS  81          HG1       LYS  81  15.898   0.297  -1.907
  601   1HD   LYS  81          HD2       LYS  81  18.210   0.678  -0.907
  602   2HD   LYS  81          HD1       LYS  81  17.333   1.497   0.402
  603   1HE   LYS  81          HE2       LYS  81  15.948  -0.510   0.707
  604   2HE   LYS  81          HE1       LYS  81  16.869  -1.300  -0.564
  605   1HZ   LYS  81          HZ1       LYS  81  18.024  -0.343   2.018
  606   2HZ   LYS  81          HZ2       LYS  81  18.839  -1.238   0.830
  607   3HZ   LYS  81          HZ3       LYS  81  17.592  -1.933   1.700
  608    H    LEU  82           H        LEU  82  16.036   0.363  -4.519
  609    HA   LEU  82           HA       LEU  82  13.421  -0.678  -3.816
  610   1HB   LEU  82          HB2       LEU  82  13.207  -1.788  -6.005
  611   2HB   LEU  82          HB1       LEU  82  13.183  -0.050  -6.144
  612    HG   LEU  82           HG       LEU  82  15.696  -1.601  -6.641
  613   1HD1  LEU  82          HD11      LEU  82  13.505  -0.938  -8.639
  614   2HD1  LEU  82          HD12      LEU  82  13.938  -2.559  -8.094
  615   3HD1  LEU  82          HD13      LEU  82  15.081  -1.618  -9.049
  616   1HD2  LEU  82          HD21      LEU  82  15.880   0.836  -6.435
  617   2HD2  LEU  82          HD22      LEU  82  14.684   1.038  -7.716
  618   3HD2  LEU  82          HD23      LEU  82  16.246   0.303  -8.073
  619    H    THR  83           H        THR  83  13.452  -2.627  -2.989
  620    HA   THR  83           HA       THR  83  15.746  -4.344  -3.400
  621    HB   THR  83           HB       THR  83  16.321  -3.128  -1.385
  622    HG1  THR  83           HG1      THR  83  16.166  -4.865   0.198
  623   1HG2  THR  83          HG21      THR  83  14.910  -3.042   0.623
  624   2HG2  THR  83          HG22      THR  83  13.658  -3.946  -0.223
  625   3HG2  THR  83          HG23      THR  83  14.074  -2.318  -0.759
  626    H    MET  84           H        MET  84  14.833  -6.429  -3.908
  627    HA   MET  84           HA       MET  84  12.015  -6.660  -3.076
  628   1HB   MET  84          HB2       MET  84  12.436  -7.093  -5.461
  629   2HB   MET  84          HB1       MET  84  13.622  -8.315  -4.993
  630   1HG   MET  84          HG2       MET  84  11.896  -9.693  -4.017
  631   2HG   MET  84          HG1       MET  84  10.681  -8.469  -4.360
  632   1HE   MET  84          HE1       MET  84  13.185 -11.091  -5.898
  633   2HE   MET  84          HE2       MET  84  13.654  -9.607  -6.728
  634   3HE   MET  84          HE3       MET  84  12.876 -10.908  -7.623
  635    H    VAL  85           H        VAL  85  11.990  -7.361  -1.098
  636    HA   VAL  85           HA       VAL  85  12.844 -10.063  -0.718
  637    HB   VAL  85           HB       VAL  85  13.594  -9.284   1.722
  638   1HG1  VAL  85          HG11      VAL  85  15.304  -8.918  -0.735
  639   2HG1  VAL  85          HG12      VAL  85  15.047 -10.432   0.130
  640   3HG1  VAL  85          HG13      VAL  85  15.930  -9.109   0.904
  641   1HG2  VAL  85          HG21      VAL  85  14.197  -6.841   0.039
  642   2HG2  VAL  85          HG22      VAL  85  14.773  -7.111   1.686
  643   3HG2  VAL  85          HG23      VAL  85  13.044  -6.897   1.374
  644    H    LYS  86           H        LYS  86  10.816 -10.899  -0.326
  645    HA   LYS  86           HA       LYS  86   9.462  -9.647   1.901
  646   1HB   LYS  86          HB2       LYS  86   8.464  -8.873  -0.376
  647   2HB   LYS  86          HB1       LYS  86   7.819 -10.515  -0.461
  648   1HG   LYS  86          HG2       LYS  86   6.149  -9.055   0.313
  649   2HG   LYS  86          HG1       LYS  86   6.622 -10.122   1.626
  650   1HD   LYS  86          HD2       LYS  86   7.797  -8.476   2.765
  651   2HD   LYS  86          HD1       LYS  86   8.016  -7.495   1.328
  652   1HE   LYS  86          HE2       LYS  86   5.789  -6.587   1.510
  653   2HE   LYS  86          HE1       LYS  86   5.306  -7.822   2.673
  654   1HZ   LYS  86          HZ1       LYS  86   7.374  -5.757   3.005
  655   2HZ   LYS  86          HZ2       LYS  86   7.001  -6.947   4.120
  656   3HZ   LYS  86          HZ3       LYS  86   5.854  -5.767   3.802
  657    H    ARG  87           H        ARG  87   9.161 -11.159   3.335
  658    HA   ARG  87           HA       ARG  87   9.215 -13.821   2.231
  659   1HB   ARG  87          HB2       ARG  87  10.381 -12.866   4.849
  660   2HB   ARG  87          HB1       ARG  87  10.228 -14.566   4.422
  661   1HG   ARG  87          HG2       ARG  87  12.450 -14.081   3.787
  662   2HG   ARG  87          HG1       ARG  87  11.535 -13.921   2.287
  663   1HD   ARG  87          HD2       ARG  87  13.003 -12.081   2.320
  664   2HD   ARG  87          HD1       ARG  87  11.415 -11.450   2.724
  665    HE   ARG  87           HE       ARG  87  13.134 -12.119   4.958
  666   1HH1  ARG  87          HH11      ARG  87  11.801  -9.465   2.941
  667   2HH1  ARG  87          HH12      ARG  87  12.504  -8.260   3.883
  668   1HH2  ARG  87          HH21      ARG  87  14.109 -10.401   6.181
  669   2HH2  ARG  87          HH22      ARG  87  13.883  -8.774   5.726
  670    H    ASN  88           H        ASN  88   8.205 -15.498   3.521
  671    HA   ASN  88           HA       ASN  88   6.427 -16.493   4.391
  672   1HB   ASN  88          HB2       ASN  88   6.608 -15.155   6.417
  673   2HB   ASN  88          HB1       ASN  88   5.786 -13.806   5.649
  674   1HD2  ASN  88          HD21      ASN  88   5.399 -17.011   6.983
  675   2HD2  ASN  88          HD22      ASN  88   3.689 -16.927   7.171
  676    H    ASN  89           H        ASN  89   5.547 -13.387   3.119
  677    HA   ASN  89           HA       ASN  89   2.923 -14.252   2.283
  678   1HB   ASN  89          HB2       ASN  89   4.356 -11.716   1.481
  679   2HB   ASN  89          HB1       ASN  89   2.635 -12.033   1.378
  680   1HD2  ASN  89          HD21      ASN  89   5.307 -11.208   3.445
  681   2HD2  ASN  89          HD22      ASN  89   4.343 -10.785   4.805
  682    H    GLN  90           H        GLN  90   5.323 -12.599   0.214
  683    HA   GLN  90           HA       GLN  90   5.400 -14.607  -1.810
  684   1HB   GLN  90          HB2       GLN  90   4.246 -13.365  -3.516
  685   2HB   GLN  90          HB1       GLN  90   3.156 -13.433  -2.120
  686   1HG   GLN  90          HG2       GLN  90   4.889 -11.109  -2.756
  687   2HG   GLN  90          HG1       GLN  90   3.247 -11.257  -3.389
  688   1HE2  GLN  90          HE21      GLN  90   5.260 -10.528  -0.741
  689   2HE2  GLN  90          HE22      GLN  90   3.956 -10.016   0.315
  690    H    THR  91           H        THR  91   6.680 -13.478  -3.711
  691    HA   THR  91           HA       THR  91   8.524 -11.657  -2.432
  692    HB   THR  91           HB       THR  91   9.925 -12.149  -4.557
  693    HG1  THR  91           HG1      THR  91   8.416 -13.239  -5.773
  694   1HG2  THR  91          HG21      THR  91   9.458 -14.330  -2.502
  695   2HG2  THR  91          HG22      THR  91  10.421 -12.911  -2.218
  696   3HG2  THR  91          HG23      THR  91  10.932 -14.079  -3.431
  697    H    ILE  92           H        ILE  92   8.245  -9.657  -2.656
  698    HA   ILE  92           HA       ILE  92   7.463  -8.502  -5.136
  699    HB   ILE  92           HB       ILE  92   5.983  -6.880  -3.836
  700   1HG1  ILE  92          HG12      ILE  92   4.848  -8.145  -1.853
  701   2HG1  ILE  92          HG11      ILE  92   6.371  -8.997  -1.828
  702   1HG2  ILE  92          HG21      ILE  92   5.037  -8.431  -5.382
  703   2HG2  ILE  92          HG22      ILE  92   4.003  -8.313  -3.964
  704   3HG2  ILE  92          HG23      ILE  92   5.056  -9.717  -4.181
  705   1HD1  ILE  92          HD11      ILE  92   6.369  -7.096  -0.293
  706   2HD1  ILE  92          HD12      ILE  92   6.190  -6.011  -1.673
  707   3HD1  ILE  92          HD13      ILE  92   7.624  -7.014  -1.516
  708    H    PHE  93           H        PHE  93   7.865  -6.100  -5.126
  709    HA   PHE  93           HA       PHE  93  10.631  -5.874  -4.236
  710   1HB   PHE  93          HB2       PHE  93   8.852  -4.208  -6.001
  711   2HB   PHE  93          HB1       PHE  93  10.530  -3.830  -5.732
  712    HD1  PHE  93           HD1      PHE  93  12.253  -5.251  -6.705
  713    HD2  PHE  93           HD2      PHE  93   8.127  -5.958  -7.445
  714    HE1  PHE  93           HE1      PHE  93  12.845  -6.665  -8.642
  715    HE2  PHE  93           HE2      PHE  93   8.704  -7.374  -9.375
  716    HZ   PHE  93           HZ       PHE  93  11.064  -7.726  -9.973
  717    H    GLU  94           H        GLU  94  11.085  -4.736  -2.395
  718    HA   GLU  94           HA       GLU  94   9.046  -3.056  -1.270
  719   1HB   GLU  94          HB2       GLU  94  11.688  -3.904  -0.030
  720   2HB   GLU  94          HB1       GLU  94  10.280  -3.225   0.764
  721   1HG   GLU  94          HG2       GLU  94   9.110  -5.351  -0.108
  722   2HG   GLU  94          HG1       GLU  94  10.750  -6.014  -0.124
  723    H    GLN  95           H        GLN  95   9.463  -0.948  -0.889
  724    HA   GLN  95           HA       GLN  95  11.851   0.145  -2.231
  725   1HB   GLN  95          HB2       GLN  95   9.458   0.329  -3.311
  726   2HB   GLN  95          HB1       GLN  95   9.210   1.580  -2.104
  727   1HG   GLN  95          HG2       GLN  95  11.084   2.822  -2.971
  728   2HG   GLN  95          HG1       GLN  95  11.438   1.522  -4.102
  729   1HE2  GLN  95          HE21      GLN  95   9.373   4.205  -3.350
  730   2HE2  GLN  95          HE22      GLN  95   8.616   4.302  -4.888
  731    H    THR  96           H        THR  96  13.151   1.007  -0.681
  732    HA   THR  96           HA       THR  96  11.919   2.210   1.711
  733    HB   THR  96           HB       THR  96  14.752   1.812   1.978
  734    HG1  THR  96           HG1      THR  96  14.241  -0.672   1.995
  735   1HG2  THR  96          HG21      THR  96  12.414   0.450   3.348
  736   2HG2  THR  96          HG22      THR  96  13.115   1.975   3.834
  737   3HG2  THR  96          HG23      THR  96  14.072   0.492   3.944
  738    H    ILE  97           H        ILE  97  13.135   4.034   2.593
  739    HA   ILE  97           HA       ILE  97  14.230   5.740   0.456
  740    HB   ILE  97           HB       ILE  97  13.229   6.644   3.172
  741   1HG1  ILE  97          HG12      ILE  97  11.589   6.639   0.682
  742   2HG1  ILE  97          HG11      ILE  97  11.591   5.219   1.702
  743   1HG2  ILE  97          HG21      ILE  97  13.291   8.010   0.458
  744   2HG2  ILE  97          HG22      ILE  97  14.613   8.098   1.600
  745   3HG2  ILE  97          HG23      ILE  97  13.045   8.749   2.052
  746   1HD1  ILE  97          HD11      ILE  97   9.752   6.368   2.311
  747   2HD1  ILE  97          HD12      ILE  97  10.504   7.935   2.177
  748   3HD1  ILE  97          HD13      ILE  97  10.894   6.862   3.559
  749    H    ASN  98           H        ASN  98  16.003   6.995   1.034
  750    HA   ASN  98           HA       ASN  98  17.819   5.620   2.834
  751   1HB   ASN  98          HB2       ASN  98  19.482   7.201   1.702
  752   2HB   ASN  98          HB1       ASN  98  18.768   5.953   0.679
  753   1HD2  ASN  98          HD21      ASN  98  17.185   9.012   1.681
  754   2HD2  ASN  98          HD22      ASN  98  17.112   9.658   0.108
  755    H    ASP  99           H        ASP  99  15.570   7.827   3.324
  756    HA   ASP  99           HA       ASP  99  17.167   9.439   5.182
  757   1HB   ASP  99          HB2       ASP  99  17.269  10.421   2.905
  758   2HB   ASP  99          HB1       ASP  99  15.564  10.730   3.038
  759    H    LEU 100           H        LEU 100  14.004   9.246   3.571
  760    HA   LEU 100           HA       LEU 100  12.580  10.434   5.779
  761   1HB   LEU 100          HB2       LEU 100  11.442   9.084   3.307
  762   2HB   LEU 100          HB1       LEU 100  10.696  10.243   4.369
  763    HG   LEU 100           HG       LEU 100  13.138  11.177   3.003
  764   1HD1  LEU 100          HD11      LEU 100  11.657  11.763   1.045
  765   2HD1  LEU 100          HD12      LEU 100  10.543  10.514   1.645
  766   3HD1  LEU 100          HD13      LEU 100  12.182  10.101   1.149
  767   1HD2  LEU 100          HD21      LEU 100  11.898  13.203   2.918
  768   2HD2  LEU 100          HD22      LEU 100  11.713  12.543   4.554
  769   3HD2  LEU 100          HD23      LEU 100  10.421  12.372   3.346
  770    H    THR 101           H        THR 101  14.004   7.838   5.885
  771    HA   THR 101           HA       THR 101  12.267   5.679   6.335
  772    HB   THR 101           HB       THR 101  15.016   6.181   7.484
  773    HG1  THR 101           HG1      THR 101  14.235   5.199   4.956
  774   1HG2  THR 101          HG21      THR 101  15.317   3.772   7.208
  775   2HG2  THR 101          HG22      THR 101  13.769   3.637   6.413
  776   3HG2  THR 101          HG23      THR 101  13.835   4.031   8.142
  777    H    PHE 102           H        PHE 102  13.147   8.487   8.146
  778    HA   PHE 102           HA       PHE 102  11.651   7.556  10.477
  779   1HB   PHE 102          HB2       PHE 102  14.264   9.080  10.533
  780   2HB   PHE 102          HB1       PHE 102  13.239   8.829  11.938
  781    HD1  PHE 102           HD1      PHE 102  15.685   7.356   9.681
  782    HD2  PHE 102           HD2      PHE 102  13.041   6.593  12.927
  783    HE1  PHE 102           HE1      PHE 102  16.863   5.256  10.142
  784    HE2  PHE 102           HE2      PHE 102  14.221   4.489  13.395
  785    HZ   PHE 102           HZ       PHE 102  16.135   3.818  12.004
  Start of MODEL    6
    1    HA   MET   1           HA       MET   1  12.789  -5.936 -26.559
    2   1HB   MET   1          HB2       MET   1  10.937  -7.277 -27.462
    3   2HB   MET   1          HB1       MET   1  12.109  -6.908 -28.716
    4   1HG   MET   1          HG2       MET   1  13.008  -9.171 -28.560
    5   2HG   MET   1          HG1       MET   1  11.891  -9.536 -27.255
    6   1HE   MET   1          HE1       MET   1  11.160  -7.439 -30.540
    7   2HE   MET   1          HE2       MET   1  10.619  -8.727 -31.620
    8   3HE   MET   1          HE3       MET   1  12.286  -8.699 -31.044
    9    H    ALA   2           H        ALA   2  11.871  -6.113 -24.602
   10    HA   ALA   2           HA       ALA   2  11.826  -8.714 -23.278
   11   1HB   ALA   2          HB1       ALA   2  12.979  -6.168 -22.110
   12   2HB   ALA   2          HB2       ALA   2  13.898  -7.606 -22.556
   13   3HB   ALA   2          HB3       ALA   2  12.734  -7.680 -21.231
   14    H    HIS   3           H        HIS   3   9.833  -7.185 -24.560
   15    HA   HIS   3           HA       HIS   3   8.497  -5.500 -22.653
   16   1HB   HIS   3          HB2       HIS   3   8.456  -5.006 -25.096
   17   2HB   HIS   3          HB1       HIS   3   7.511  -6.466 -25.351
   18    HD1  HIS   3           HD1      HIS   3   5.154  -5.713 -25.862
   19    HD2  HIS   3           HD2      HIS   3   6.915  -3.483 -22.829
   20    HE1  HIS   3           HE1      HIS   3   3.402  -4.092 -25.076
   21    H    HIS   4           H        HIS   4   6.890  -5.996 -21.354
   22    HA   HIS   4           HA       HIS   4   5.861  -8.732 -21.447
   23   1HB   HIS   4          HB2       HIS   4   6.317  -6.925 -19.058
   24   2HB   HIS   4          HB1       HIS   4   5.462  -8.460 -18.982
   25    HD1  HIS   4           HD1      HIS   4   8.840  -7.018 -18.789
   26    HD2  HIS   4           HD2      HIS   4   7.149 -10.725 -19.610
   27    HE1  HIS   4           HE1      HIS   4  10.684  -8.696 -18.515
   28    H    HIS   5           H        HIS   5   3.691  -8.907 -20.400
   29    HA   HIS   5           HA       HIS   5   1.981  -6.764 -21.409
   30   1HB   HIS   5          HB2       HIS   5   1.224  -9.526 -20.387
   31   2HB   HIS   5          HB1       HIS   5   0.126  -8.368 -21.118
   32    HD1  HIS   5           HD1      HIS   5   0.542  -7.938 -23.780
   33    HD2  HIS   5           HD2      HIS   5   2.494 -11.185 -22.098
   34    HE1  HIS   5           HE1      HIS   5   1.278  -9.382 -25.705
   35    H    HIS   6           H        HIS   6   0.537  -5.693 -20.019
   36    HA   HIS   6           HA       HIS   6   1.196  -6.071 -17.204
   37   1HB   HIS   6          HB2       HIS   6   0.353  -3.800 -16.772
   38   2HB   HIS   6          HB1       HIS   6   1.588  -3.763 -18.015
   39    HD1  HIS   6           HD1      HIS   6  -1.740  -2.514 -17.275
   40    HD2  HIS   6           HD2      HIS   6   0.383  -3.503 -20.709
   41    HE1  HIS   6           HE1      HIS   6  -2.914  -1.365 -19.179
   42    H    HIS   7           H        HIS   7  -0.268  -6.753 -15.796
   43    HA   HIS   7           HA       HIS   7  -2.808  -7.533 -16.918
   44   1HB   HIS   7          HB2       HIS   7  -3.098  -8.879 -14.785
   45   2HB   HIS   7          HB1       HIS   7  -1.766  -9.366 -15.815
   46    HD1  HIS   7           HD1      HIS   7   0.569  -9.356 -14.748
   47    HD2  HIS   7           HD2      HIS   7  -2.334  -7.635 -12.337
   48    HE1  HIS   7           HE1      HIS   7   1.634  -9.044 -12.492
   49    H    HIS   8           H        HIS   8  -4.437  -6.303 -16.797
   50    HA   HIS   8           HA       HIS   8  -4.507  -4.142 -14.883
   51   1HB   HIS   8          HB2       HIS   8  -5.144  -3.659 -17.190
   52   2HB   HIS   8          HB1       HIS   8  -6.408  -4.880 -17.131
   53    HD1  HIS   8           HD1      HIS   8  -5.803  -1.294 -16.456
   54    HD2  HIS   8           HD2      HIS   8  -8.630  -4.152 -15.422
   55    HE1  HIS   8           HE1      HIS   8  -7.793  -0.042 -15.580
   56    H    ASN   9           H        ASN   9  -5.497  -4.238 -13.031
   57    HA   ASN   9           HA       ASN   9  -8.035  -5.417 -12.792
   58   1HB   ASN   9          HB2       ASN   9  -7.571  -6.951 -10.856
   59   2HB   ASN   9          HB1       ASN   9  -6.850  -7.508 -12.346
   60   1HD2  ASN   9          HD21      ASN   9  -4.580  -7.503 -12.513
   61   2HD2  ASN   9          HD22      ASN   9  -3.568  -7.396 -11.118
   62    H    GLN  10           H        GLN  10  -8.227  -3.107 -12.608
   63    HA   GLN  10           HA       GLN  10  -7.278  -2.045 -10.154
   64   1HB   GLN  10          HB2       GLN  10  -8.500   0.065 -10.719
   65   2HB   GLN  10          HB1       GLN  10  -7.394  -0.453 -11.967
   66   1HG   GLN  10          HG2       GLN  10  -9.214   0.282 -13.172
   67   2HG   GLN  10          HG1       GLN  10  -9.505  -1.448 -13.082
   68   1HE2  GLN  10          HE21      GLN  10 -11.676  -1.187 -13.423
   69   2HE2  GLN  10          HE22      GLN  10 -12.750  -0.543 -12.241
   70    H    GLN  11           H        GLN  11  -7.961  -2.497  -8.374
   71    HA   GLN  11           HA       GLN  11 -10.730  -3.429  -8.009
   72   1HB   GLN  11          HB2       GLN  11  -8.636  -4.821  -7.458
   73   2HB   GLN  11          HB1       GLN  11  -8.405  -3.718  -6.114
   74   1HG   GLN  11          HG2       GLN  11 -10.607  -4.409  -5.246
   75   2HG   GLN  11          HG1       GLN  11 -10.722  -5.572  -6.573
   76   1HE2  GLN  11          HE21      GLN  11 -10.723  -6.182  -3.818
   77   2HE2  GLN  11          HE22      GLN  11  -9.331  -7.148  -3.474
   78    H    ASN  12           H        ASN  12  -8.741  -0.835  -7.694
   79    HA   ASN  12           HA       ASN  12 -10.401   0.581  -5.901
   80   1HB   ASN  12          HB2       ASN  12  -8.332   1.284  -4.506
   81   2HB   ASN  12          HB1       ASN  12  -9.038  -0.282  -4.158
   82   1HD2  ASN  12          HD21      ASN  12  -7.204  -1.174  -3.300
   83   2HD2  ASN  12          HD22      ASN  12  -5.767  -1.455  -4.189
   84    H    LYS  13           H        LYS  13  -9.926   2.861  -6.022
   85    HA   LYS  13           HA       LYS  13  -9.234   3.404  -8.757
   86   1HB   LYS  13          HB2       LYS  13 -10.508   5.123  -6.652
   87   2HB   LYS  13          HB1       LYS  13  -9.938   5.815  -8.157
   88   1HG   LYS  13          HG2       LYS  13 -12.280   5.390  -8.370
   89   2HG   LYS  13          HG1       LYS  13 -11.423   4.243  -9.385
   90   1HD   LYS  13          HD2       LYS  13 -13.194   3.067  -8.312
   91   2HD   LYS  13          HD1       LYS  13 -11.694   2.561  -7.538
   92   1HE   LYS  13          HE2       LYS  13 -12.127   4.094  -5.677
   93   2HE   LYS  13          HE1       LYS  13 -13.608   4.633  -6.457
   94   1HZ   LYS  13          HZ1       LYS  13 -14.477   2.381  -6.279
   95   2HZ   LYS  13          HZ2       LYS  13 -14.074   2.975  -4.759
   96   3HZ   LYS  13          HZ3       LYS  13 -13.064   1.868  -5.521
   97    H    LYS  14           H        LYS  14  -7.978   4.695  -5.660
   98    HA   LYS  14           HA       LYS  14  -5.383   4.878  -6.754
   99   1HB   LYS  14          HB2       LYS  14  -6.442   6.878  -7.866
  100   2HB   LYS  14          HB1       LYS  14  -6.809   7.520  -6.277
  101   1HG   LYS  14          HG2       LYS  14  -4.858   8.642  -7.159
  102   2HG   LYS  14          HG1       LYS  14  -4.377   7.637  -5.795
  103   1HD   LYS  14          HD2       LYS  14  -3.652   5.878  -7.402
  104   2HD   LYS  14          HD1       LYS  14  -4.047   6.976  -8.726
  105   1HE   LYS  14          HE2       LYS  14  -1.995   7.472  -6.562
  106   2HE   LYS  14          HE1       LYS  14  -1.644   6.948  -8.199
  107   1HZ   LYS  14          HZ1       LYS  14  -2.513   9.057  -9.023
  108   2HZ   LYS  14          HZ2       LYS  14  -1.295   9.323  -7.882
  109   3HZ   LYS  14          HZ3       LYS  14  -2.897   9.545  -7.455
  110    H    VAL  15           H        VAL  15  -3.889   5.481  -5.177
  111    HA   VAL  15           HA       VAL  15  -4.677   4.992  -2.507
  112    HB   VAL  15           HB       VAL  15  -2.456   4.487  -3.778
  113   1HG1  VAL  15          HG11      VAL  15  -1.855   6.622  -4.539
  114   2HG1  VAL  15          HG12      VAL  15  -0.623   6.087  -3.379
  115   3HG1  VAL  15          HG13      VAL  15  -1.859   7.256  -2.897
  116   1HG2  VAL  15          HG21      VAL  15  -2.765   3.833  -1.498
  117   2HG2  VAL  15          HG22      VAL  15  -2.407   5.466  -0.948
  118   3HG2  VAL  15          HG23      VAL  15  -1.140   4.488  -1.692
  119    H    GLU  16           H        GLU  16  -5.374   6.535  -1.055
  120    HA   GLU  16           HA       GLU  16  -5.297   9.324  -1.945
  121   1HB   GLU  16          HB2       GLU  16  -6.859   8.104   0.331
  122   2HB   GLU  16          HB1       GLU  16  -7.084   9.693  -0.390
  123   1HG   GLU  16          HG2       GLU  16  -7.851   8.687  -2.441
  124   2HG   GLU  16          HG1       GLU  16  -7.491   7.087  -1.791
  125    H    GLY  17           H        GLY  17  -5.352   8.091   1.369
  126   1HA   GLY  17          HA2       GLY  17  -2.760   9.389   1.701
  127   2HA   GLY  17          HA1       GLY  17  -4.106   9.909   2.718
  128    H    GLY  18           H        GLY  18  -4.495   6.706   2.185
  129   1HA   GLY  18          HA2       GLY  18  -2.929   6.088   4.598
  130   2HA   GLY  18          HA1       GLY  18  -4.514   5.378   4.276
  131    H    TYR  19           H        TYR  19  -3.746   3.280   4.411
  132    HA   TYR  19           HA       TYR  19  -1.706   2.553   2.437
  133   1HB   TYR  19          HB2       TYR  19  -2.653   0.901   4.777
  134   2HB   TYR  19          HB1       TYR  19  -1.197   0.679   3.811
  135    HD1  TYR  19           HD1      TYR  19   0.277   3.047   3.793
  136    HD2  TYR  19           HD2      TYR  19  -2.230   1.617   6.928
  137    HE1  TYR  19           HE1      TYR  19   1.506   4.429   5.420
  138    HE2  TYR  19           HE2      TYR  19  -1.037   2.979   8.517
  139    HH   TYR  19           HH       TYR  19   1.008   5.461   7.698
  140    H    GLU  20           H        GLU  20  -2.446   1.971   0.696
  141    HA   GLU  20           HA       GLU  20  -5.071   0.862   0.322
  142   1HB   GLU  20          HB2       GLU  20  -4.087   2.397  -1.318
  143   2HB   GLU  20          HB1       GLU  20  -2.718   1.314  -1.549
  144   1HG   GLU  20          HG2       GLU  20  -4.531  -0.396  -2.236
  145   2HG   GLU  20          HG1       GLU  20  -5.558   1.015  -2.418
  146    H    CYS  21           H        CYS  21  -5.342  -1.273   0.632
  147    HA   CYS  21           HA       CYS  21  -3.153  -3.122   0.642
  148   1HB   CYS  21          HB2       CYS  21  -6.091  -3.656   0.277
  149   2HB   CYS  21          HB1       CYS  21  -4.868  -4.884   0.514
  150    H    LYS  22           H        LYS  22  -2.373  -4.274  -1.054
  151    HA   LYS  22           HA       LYS  22  -3.087  -3.705  -3.720
  152   1HB   LYS  22          HB2       LYS  22  -0.872  -4.448  -3.004
  153   2HB   LYS  22          HB1       LYS  22  -1.545  -5.998  -2.519
  154   1HG   LYS  22          HG2       LYS  22  -2.191  -6.350  -4.919
  155   2HG   LYS  22          HG1       LYS  22  -1.282  -4.888  -5.299
  156   1HD   LYS  22          HD2       LYS  22   0.148  -6.733  -5.693
  157   2HD   LYS  22          HD1       LYS  22   0.693  -5.937  -4.220
  158   1HE   LYS  22          HE2       LYS  22  -0.484  -7.645  -2.880
  159   2HE   LYS  22          HE1       LYS  22  -0.980  -8.446  -4.374
  160   1HZ   LYS  22          HZ1       LYS  22   1.777  -8.025  -3.419
  161   2HZ   LYS  22          HZ2       LYS  22   1.384  -8.693  -4.904
  162   3HZ   LYS  22          HZ3       LYS  22   0.965  -9.508  -3.453
  163    H    TYR  23           H        TYR  23  -4.582  -5.462  -1.390
  164    HA   TYR  23           HA       TYR  23  -5.606  -7.491  -3.200
  165   1HB   TYR  23          HB2       TYR  23  -5.875  -8.361  -0.495
  166   2HB   TYR  23          HB1       TYR  23  -4.888  -9.056  -1.776
  167    HD1  TYR  23           HD1      TYR  23  -2.499  -8.449  -1.979
  168    HD2  TYR  23           HD2      TYR  23  -4.870  -6.953   1.207
  169    HE1  TYR  23           HE1      TYR  23  -0.461  -7.783  -0.772
  170    HE2  TYR  23           HE2      TYR  23  -2.841  -6.284   2.417
  171    HH   TYR  23           HH       TYR  23  -0.468  -6.863   2.492
  172    H    CYS  24           H        CYS  24  -6.593  -4.713  -1.785
  173    HA   CYS  24           HA       CYS  24  -9.286  -5.601  -2.066
  174   1HB   CYS  24          HB2       CYS  24 -10.143  -4.956   0.131
  175   2HB   CYS  24          HB1       CYS  24  -8.944  -6.250   0.206
  176    H    THR  25           H        THR  25 -10.907  -3.896  -1.609
  177    HA   THR  25           HA       THR  25 -10.122  -1.513  -3.008
  178    HB   THR  25           HB       THR  25 -12.820  -2.409  -1.931
  179    HG1  THR  25           HG1      THR  25 -11.786  -2.703  -4.564
  180   1HG2  THR  25          HG21      THR  25 -12.764  -0.023  -2.559
  181   2HG2  THR  25          HG22      THR  25 -13.748  -0.939  -3.700
  182   3HG2  THR  25          HG23      THR  25 -12.106  -0.456  -4.136
  183    H    PHE  26           H        PHE  26  -9.961  -2.428   0.177
  184    HA   PHE  26           HA       PHE  26 -10.928   0.125   1.209
  185   1HB   PHE  26          HB2       PHE  26 -11.951  -1.814   2.271
  186   2HB   PHE  26          HB1       PHE  26 -10.366  -2.458   2.678
  187    HD1  PHE  26           HD1      PHE  26 -12.524   0.525   3.229
  188    HD2  PHE  26           HD2      PHE  26  -9.449  -1.987   4.764
  189    HE1  PHE  26           HE1      PHE  26 -12.599   1.740   5.364
  190    HE2  PHE  26           HE2      PHE  26  -9.520  -0.777   6.902
  191    HZ   PHE  26           HZ       PHE  26 -11.094   1.089   7.205
  192    H    GLN  27           H        GLN  27  -9.566   1.623   1.701
  193    HA   GLN  27           HA       GLN  27  -6.800   0.945   2.334
  194   1HB   GLN  27          HB2       GLN  27  -6.644   2.368   0.509
  195   2HB   GLN  27          HB1       GLN  27  -8.086   3.281   0.980
  196   1HG   GLN  27          HG2       GLN  27  -6.865   4.455   2.641
  197   2HG   GLN  27          HG1       GLN  27  -5.484   3.384   2.468
  198   1HE2  GLN  27          HE21      GLN  27  -4.124   3.730   0.951
  199   2HE2  GLN  27          HE22      GLN  27  -4.045   5.089  -0.110
  200    H    THR  28           H        THR  28  -5.974   1.679   4.214
  201    HA   THR  28           HA       THR  28  -7.557   3.516   5.787
  202    HB   THR  28           HB       THR  28  -8.268   1.379   6.706
  203    HG1  THR  28           HG1      THR  28  -8.169   2.662   8.384
  204   1HG2  THR  28          HG21      THR  28  -6.309   0.011   6.023
  205   2HG2  THR  28          HG22      THR  28  -6.696  -0.200   7.733
  206   3HG2  THR  28          HG23      THR  28  -5.349   0.820   7.264
  207    HA   PRO  29           HA       PRO  29  -3.460   5.220   6.293
  208   1HB   PRO  29          HB2       PRO  29  -4.218   7.310   7.879
  209   2HB   PRO  29          HB1       PRO  29  -4.387   7.292   6.116
  210   1HG   PRO  29          HG2       PRO  29  -6.439   6.737   8.215
  211   2HG   PRO  29          HG1       PRO  29  -6.604   7.663   6.713
  212   1HD   PRO  29          HD2       PRO  29  -7.493   5.118   6.955
  213   2HD   PRO  29          HD1       PRO  29  -6.841   5.740   5.417
  214    H    ASP  30           H        ASP  30  -5.385   3.762   8.622
  215    HA   ASP  30           HA       ASP  30  -3.451   4.234  10.740
  216   1HB   ASP  30          HB2       ASP  30  -6.134   2.862  10.720
  217   2HB   ASP  30          HB1       ASP  30  -5.062   2.849  12.117
  218    H    LEU  31           H        LEU  31  -1.734   3.008  10.645
  219    HA   LEU  31           HA       LEU  31  -1.340   0.711   9.227
  220   1HB   LEU  31          HB2       LEU  31   0.244   2.315  10.577
  221   2HB   LEU  31          HB1       LEU  31   0.038   1.134  11.849
  222    HG   LEU  31           HG       LEU  31   2.113   0.671  10.733
  223   1HD1  LEU  31          HD11      LEU  31   0.073  -1.271   9.773
  224   2HD1  LEU  31          HD12      LEU  31   0.898  -1.328  11.338
  225   3HD1  LEU  31          HD13      LEU  31   1.808  -1.576   9.832
  226   1HD2  LEU  31          HD21      LEU  31   2.277   0.251   8.344
  227   2HD2  LEU  31          HD22      LEU  31   1.648   1.876   8.694
  228   3HD2  LEU  31          HD23      LEU  31   0.552   0.603   8.185
  229    H    ASN  32           H        ASN  32  -2.405   1.100  12.622
  230    HA   ASN  32           HA       ASN  32  -2.317  -1.522  13.456
  231   1HB   ASN  32          HB2       ASN  32  -2.890   0.698  14.738
  232   2HB   ASN  32          HB1       ASN  32  -4.522   0.322  14.179
  233   1HD2  ASN  32          HD21      ASN  32  -4.292  -2.577  14.487
  234   2HD2  ASN  32          HD22      ASN  32  -4.310  -2.805  16.189
  235    H    MET  33           H        MET  33  -4.862   0.260  11.786
  236    HA   MET  33           HA       MET  33  -6.690  -1.964  11.811
  237   1HB   MET  33          HB2       MET  33  -6.772   0.546  10.127
  238   2HB   MET  33          HB1       MET  33  -8.092  -0.595  10.354
  239   1HG   MET  33          HG2       MET  33  -6.808   1.051  12.468
  240   2HG   MET  33          HG1       MET  33  -8.341   1.448  11.686
  241   1HE   MET  33          HE1       MET  33  -9.532   1.624  14.090
  242   2HE   MET  33          HE2       MET  33  -7.997   1.241  14.874
  243   3HE   MET  33          HE3       MET  33  -9.455   0.351  15.309
  244    H    PHE  34           H        PHE  34  -4.367  -0.597   9.646
  245    HA   PHE  34           HA       PHE  34  -5.061  -2.073   7.357
  246   1HB   PHE  34          HB2       PHE  34  -3.580  -0.194   7.123
  247   2HB   PHE  34          HB1       PHE  34  -2.430  -0.880   8.248
  248    HD1  PHE  34           HD1      PHE  34  -3.945  -1.353   4.875
  249    HD2  PHE  34           HD2      PHE  34  -0.733  -2.297   7.515
  250    HE1  PHE  34           HE1      PHE  34  -2.736  -2.401   3.014
  251    HE2  PHE  34           HE2      PHE  34   0.492  -3.350   5.638
  252    HZ   PHE  34           HZ       PHE  34  -0.521  -3.399   3.388
  253    H    THR  35           H        THR  35  -2.575  -2.693   9.781
  254    HA   THR  35           HA       THR  35  -1.928  -5.165   8.559
  255    HB   THR  35           HB       THR  35  -0.216  -3.824   9.744
  256    HG1  THR  35           HG1      THR  35   0.864  -5.517  10.224
  257   1HG2  THR  35          HG21      THR  35  -1.678  -4.645  12.250
  258   2HG2  THR  35          HG22      THR  35  -1.535  -3.016  11.567
  259   3HG2  THR  35          HG23      THR  35  -0.103  -3.832  12.188
  260    H    PHE  36           H        PHE  36  -4.159  -4.203  11.053
  261    HA   PHE  36           HA       PHE  36  -4.605  -6.759  12.134
  262   1HB   PHE  36          HB2       PHE  36  -5.432  -5.062  13.468
  263   2HB   PHE  36          HB1       PHE  36  -6.113  -4.164  12.128
  264    HD1  PHE  36           HD1      PHE  36  -6.512  -7.556  13.649
  265    HD2  PHE  36           HD2      PHE  36  -8.399  -4.084  12.119
  266    HE1  PHE  36           HE1      PHE  36  -8.721  -8.527  14.187
  267    HE2  PHE  36           HE2      PHE  36 -10.601  -5.037  12.627
  268    HZ   PHE  36           HZ       PHE  36 -10.769  -7.264  13.667
  269    H    HIS  37           H        HIS  37  -6.329  -4.897   9.635
  270    HA   HIS  37           HA       HIS  37  -7.977  -7.122   9.139
  271   1HB   HIS  37          HB2       HIS  37  -9.239  -5.838   7.666
  272   2HB   HIS  37          HB1       HIS  37  -8.532  -4.611   8.698
  273    HD1  HIS  37           HD1      HIS  37  -7.026  -2.878   7.546
  274    HD2  HIS  37           HD2      HIS  37  -8.337  -5.921   5.063
  275    HE1  HIS  37           HE1      HIS  37  -6.581  -2.077   5.186
  276    H    VAL  38           H        VAL  38  -4.954  -6.130   7.913
  277    HA   VAL  38           HA       VAL  38  -4.927  -7.863   5.684
  278    HB   VAL  38           HB       VAL  38  -2.711  -6.725   7.368
  279   1HG1  VAL  38          HG11      VAL  38  -1.954  -8.895   6.452
  280   2HG1  VAL  38          HG12      VAL  38  -1.110  -7.566   5.657
  281   3HG1  VAL  38          HG13      VAL  38  -2.442  -8.385   4.834
  282   1HG2  VAL  38          HG21      VAL  38  -2.220  -5.405   5.362
  283   2HG2  VAL  38          HG22      VAL  38  -3.882  -5.175   5.914
  284   3HG2  VAL  38          HG23      VAL  38  -3.546  -6.206   4.523
  285    H    ASP  39           H        ASP  39  -3.783  -8.355   9.044
  286    HA   ASP  39           HA       ASP  39  -3.037 -11.066   8.654
  287   1HB   ASP  39          HB2       ASP  39  -2.249  -9.892  10.635
  288   2HB   ASP  39          HB1       ASP  39  -3.923  -9.587  11.099
  289    H    SER  40           H        SER  40  -6.016  -9.559   9.214
  290    HA   SER  40           HA       SER  40  -7.369 -12.011   9.947
  291   1HB   SER  40          HB2       SER  40  -7.996  -9.810  10.967
  292   2HB   SER  40          HB1       SER  40  -8.570  -9.295   9.389
  293    HG   SER  40           HG       SER  40 -10.182 -10.760   9.459
  294    H    GLU  41           H        GLU  41  -7.351  -9.810   7.152
  295    HA   GLU  41           HA       GLU  41  -9.304 -11.612   5.877
  296   1HB   GLU  41          HB2       GLU  41  -8.763  -8.730   5.202
  297   2HB   GLU  41          HB1       GLU  41 -10.071  -9.733   4.594
  298   1HG   GLU  41          HG2       GLU  41  -9.678  -8.846   7.429
  299   2HG   GLU  41          HG1       GLU  41 -10.844  -8.180   6.290
  300    H    HIS  42           H        HIS  42  -6.089 -10.410   5.615
  301    HA   HIS  42           HA       HIS  42  -5.857 -11.744   2.998
  302   1HB   HIS  42          HB2       HIS  42  -4.204  -9.291   3.508
  303   2HB   HIS  42          HB1       HIS  42  -4.691 -10.028   1.996
  304    HD1  HIS  42           HD1      HIS  42  -7.532  -9.618   1.626
  305    HD2  HIS  42           HD2      HIS  42  -5.324  -6.915   3.888
  306    HE1  HIS  42           HE1      HIS  42  -8.884  -7.491   1.694
  307    HA   PRO  43           HA       PRO  43  -2.729 -12.542   6.458
  308   1HB   PRO  43          HB2       PRO  43  -3.119 -15.217   6.809
  309   2HB   PRO  43          HB1       PRO  43  -4.077 -13.950   7.617
  310   1HG   PRO  43          HG2       PRO  43  -4.727 -15.441   5.073
  311   2HG   PRO  43          HG1       PRO  43  -5.769 -15.224   6.499
  312   1HD   PRO  43          HD2       PRO  43  -5.997 -13.699   4.341
  313   2HD   PRO  43          HD1       PRO  43  -6.166 -13.025   5.979
  314    H    ASN  44           H        ASN  44  -3.477 -14.291   3.518
  315    HA   ASN  44           HA       ASN  44  -0.625 -14.519   2.904
  316   1HB   ASN  44          HB2       ASN  44  -2.727 -16.645   2.385
  317   2HB   ASN  44          HB1       ASN  44  -1.148 -16.620   1.611
  318   1HD2  ASN  44          HD21      ASN  44  -2.903 -17.287   4.476
  319   2HD2  ASN  44          HD22      ASN  44  -1.605 -17.972   5.376
  320    H    VAL  45           H        VAL  45  -0.151 -13.759   0.908
  321    HA   VAL  45           HA       VAL  45  -2.343 -13.231  -0.922
  322    HB   VAL  45           HB       VAL  45  -1.507 -10.884  -1.279
  323   1HG1  VAL  45          HG11      VAL  45  -2.616  -9.943   0.679
  324   2HG1  VAL  45          HG12      VAL  45  -2.597 -11.547   1.442
  325   3HG1  VAL  45          HG13      VAL  45  -3.515 -11.274  -0.049
  326   1HG2  VAL  45          HG21      VAL  45   0.695 -11.090  -0.254
  327   2HG2  VAL  45          HG22      VAL  45  -0.055 -11.384   1.319
  328   3HG2  VAL  45          HG23      VAL  45  -0.247  -9.817   0.527
  329    H    VAL  46           H        VAL  46  -1.631 -12.694  -3.075
  330    HA   VAL  46           HA       VAL  46   1.123 -12.802  -3.651
  331    HB   VAL  46           HB       VAL  46   0.499 -15.232  -3.353
  332   1HG1  VAL  46          HG11      VAL  46  -1.222 -14.822  -5.770
  333   2HG1  VAL  46          HG12      VAL  46  -1.746 -15.226  -4.136
  334   3HG1  VAL  46          HG13      VAL  46  -0.805 -16.387  -5.071
  335   1HG2  VAL  46          HG21      VAL  46   1.401 -14.536  -6.156
  336   2HG2  VAL  46          HG22      VAL  46   1.612 -16.100  -5.370
  337   3HG2  VAL  46          HG23      VAL  46   2.435 -14.678  -4.735
  338    H    LEU  47           H        LEU  47   1.312 -12.733  -6.235
  339    HA   LEU  47           HA       LEU  47  -1.001 -11.996  -7.688
  340   1HB   LEU  47          HB2       LEU  47  -0.638  -9.862  -6.455
  341   2HB   LEU  47          HB1       LEU  47   0.981  -9.772  -7.107
  342    HG   LEU  47           HG       LEU  47   0.029  -9.564  -9.391
  343   1HD1  LEU  47          HD11      LEU  47  -2.085 -10.707  -9.058
  344   2HD1  LEU  47          HD12      LEU  47  -2.357  -9.069  -9.655
  345   3HD1  LEU  47          HD13      LEU  47  -2.617  -9.441  -7.952
  346   1HD2  LEU  47          HD21      LEU  47   0.621  -7.564  -8.116
  347   2HD2  LEU  47          HD22      LEU  47  -0.999  -7.529  -7.416
  348   3HD2  LEU  47          HD23      LEU  47  -0.781  -7.274  -9.146
  349    H    ASN  48           H        ASN  48   2.374 -10.913  -7.872
  350    HA   ASN  48           HA       ASN  48   3.462 -12.806  -9.563
  351   1HB   ASN  48          HB2       ASN  48   1.790 -12.012 -11.266
  352   2HB   ASN  48          HB1       ASN  48   2.414 -10.380 -11.083
  353   1HD2  ASN  48          HD21      ASN  48   4.385  -9.813 -12.122
  354   2HD2  ASN  48          HD22      ASN  48   5.120 -10.888 -13.241
  355    H    SER  49           H        SER  49   3.260  -9.273  -9.669
  356    HA   SER  49           HA       SER  49   5.802  -8.994  -8.347
  357   1HB   SER  49          HB2       SER  49   6.321  -7.292 -10.248
  358   2HB   SER  49          HB1       SER  49   6.551  -9.006 -10.606
  359    HG   SER  49           HG       SER  49   5.120  -7.392 -11.991
  360    H    SER  50           H        SER  50   5.579  -7.255  -6.868
  361    HA   SER  50           HA       SER  50   3.697  -5.173  -7.511
  362   1HB   SER  50          HB2       SER  50   3.648  -6.663  -4.904
  363   2HB   SER  50          HB1       SER  50   2.538  -5.441  -5.511
  364    HG   SER  50           HG       SER  50   2.388  -7.161  -7.309
  365    H    TYR  51           H        TYR  51   3.953  -3.470  -5.723
  366    HA   TYR  51           HA       TYR  51   6.684  -3.440  -4.685
  367   1HB   TYR  51          HB2       TYR  51   5.022  -1.404  -6.046
  368   2HB   TYR  51          HB1       TYR  51   6.062  -0.877  -4.743
  369    HD1  TYR  51           HD1      TYR  51   6.958  -3.545  -7.185
  370    HD2  TYR  51           HD2      TYR  51   7.467   0.501  -5.997
  371    HE1  TYR  51           HE1      TYR  51   8.818  -3.307  -8.783
  372    HE2  TYR  51           HE2      TYR  51   9.313   0.748  -7.572
  373    HH   TYR  51           HH       TYR  51   9.931  -1.504 -10.001
  374    H    VAL  52           H        VAL  52   6.914  -2.723  -2.642
  375    HA   VAL  52           HA       VAL  52   4.510  -1.984  -1.128
  376    HB   VAL  52           HB       VAL  52   4.973  -4.398  -0.772
  377   1HG1  VAL  52          HG11      VAL  52   7.300  -4.372  -1.263
  378   2HG1  VAL  52          HG12      VAL  52   6.963  -5.111   0.304
  379   3HG1  VAL  52          HG13      VAL  52   7.606  -3.474   0.228
  380   1HG2  VAL  52          HG21      VAL  52   5.241  -4.462   1.645
  381   2HG2  VAL  52          HG22      VAL  52   4.094  -3.231   1.123
  382   3HG2  VAL  52          HG23      VAL  52   5.721  -2.761   1.628
  383    H    CYS  53           H        CYS  53   4.916  -0.459   0.408
  384    HA   CYS  53           HA       CYS  53   7.558   0.829   0.463
  385   1HB   CYS  53          HB2       CYS  53   5.635   2.255   0.514
  386   2HB   CYS  53          HB1       CYS  53   4.933   1.397   1.876
  387    H    VAL  54           H        VAL  54   8.994  -0.468   1.499
  388    HA   VAL  54           HA       VAL  54   8.479  -2.374   3.416
  389    HB   VAL  54           HB       VAL  54  10.957  -0.982   3.968
  390   1HG1  VAL  54          HG11      VAL  54  10.367  -3.579   2.770
  391   2HG1  VAL  54          HG12      VAL  54  10.484  -3.287   4.526
  392   3HG1  VAL  54          HG13      VAL  54  11.917  -3.115   3.464
  393   1HG2  VAL  54          HG21      VAL  54  10.999  -0.178   1.810
  394   2HG2  VAL  54          HG22      VAL  54  10.280  -1.600   1.151
  395   3HG2  VAL  54          HG23      VAL  54  11.960  -1.655   1.722
  396    H    GLU  55           H        GLU  55   9.003   1.012   3.710
  397    HA   GLU  55           HA       GLU  55   9.533   1.294   6.395
  398   1HB   GLU  55          HB2       GLU  55   7.925   3.252   4.755
  399   2HB   GLU  55          HB1       GLU  55   8.943   3.611   6.139
  400   1HG   GLU  55          HG2       GLU  55   9.956   2.594   3.483
  401   2HG   GLU  55          HG1       GLU  55   9.922   4.278   3.966
  402    H    CYS  56           H        CYS  56   6.566   1.157   4.615
  403    HA   CYS  56           HA       CYS  56   4.922   1.352   7.099
  404   1HB   CYS  56          HB2       CYS  56   3.914   1.368   4.277
  405   2HB   CYS  56          HB1       CYS  56   3.092   1.961   5.721
  406    H    ASN  57           H        ASN  57   6.155  -0.859   4.967
  407    HA   ASN  57           HA       ASN  57   5.738  -2.941   4.201
  408   1HB   ASN  57          HB2       ASN  57   5.276  -3.018   7.065
  409   2HB   ASN  57          HB1       ASN  57   4.194  -4.125   6.196
  410   1HD2  ASN  57          HD21      ASN  57   7.192  -3.415   4.963
  411   2HD2  ASN  57          HD22      ASN  57   7.859  -4.988   5.294
  412    H    PHE  58           H        PHE  58   4.156  -1.396   2.903
  413    HA   PHE  58           HA       PHE  58   1.517  -2.639   3.055
  414   1HB   PHE  58          HB2       PHE  58   0.349  -0.684   3.228
  415   2HB   PHE  58          HB1       PHE  58   1.866  -0.012   3.788
  416    HD1  PHE  58           HD1      PHE  58  -0.454  -0.260   0.963
  417    HD2  PHE  58           HD2      PHE  58   3.077   1.584   2.407
  418    HE1  PHE  58           HE1      PHE  58  -0.570   1.408  -0.867
  419    HE2  PHE  58           HE2      PHE  58   2.949   3.250   0.550
  420    HZ   PHE  58           HZ       PHE  58   1.139   3.136  -1.059
  421    H    LEU  59           H        LEU  59   0.878  -3.496   1.264
  422    HA   LEU  59           HA       LEU  59   2.496  -3.153  -1.139
  423   1HB   LEU  59          HB2       LEU  59   0.775  -5.279  -0.032
  424   2HB   LEU  59          HB1       LEU  59   0.814  -5.110  -1.765
  425    HG   LEU  59           HG       LEU  59   3.334  -5.523  -0.150
  426   1HD1  LEU  59          HD11      LEU  59   3.067  -7.868  -0.775
  427   2HD1  LEU  59          HD12      LEU  59   1.514  -7.444  -1.546
  428   3HD1  LEU  59          HD13      LEU  59   1.684  -7.313   0.194
  429   1HD2  LEU  59          HD21      LEU  59   2.594  -5.893  -3.061
  430   2HD2  LEU  59          HD22      LEU  59   4.145  -6.276  -2.349
  431   3HD2  LEU  59          HD23      LEU  59   3.608  -4.602  -2.419
  432    H    THR  60           H        THR  60   1.624  -2.312  -2.934
  433    HA   THR  60           HA       THR  60  -1.208  -1.637  -2.860
  434    HB   THR  60           HB       THR  60  -0.228   0.407  -2.432
  435    HG1  THR  60           HG1      THR  60  -1.561   0.572  -4.269
  436   1HG2  THR  60          HG21      THR  60   2.089  -0.285  -2.678
  437   2HG2  THR  60          HG22      THR  60   1.834   1.282  -3.393
  438   3HG2  THR  60          HG23      THR  60   1.974  -0.143  -4.430
  439    H    LYS  61           H        LYS  61  -2.101  -1.190  -5.057
  440    HA   LYS  61           HA       LYS  61  -1.278  -3.371  -6.824
  441   1HB   LYS  61          HB2       LYS  61  -3.611  -1.482  -7.129
  442   2HB   LYS  61          HB1       LYS  61  -3.358  -3.006  -7.965
  443   1HG   LYS  61          HG2       LYS  61  -3.559  -4.165  -5.764
  444   2HG   LYS  61          HG1       LYS  61  -3.932  -2.585  -5.055
  445   1HD   LYS  61          HD2       LYS  61  -5.989  -3.724  -5.436
  446   2HD   LYS  61          HD1       LYS  61  -5.857  -2.410  -6.601
  447   1HE   LYS  61          HE2       LYS  61  -6.669  -4.278  -7.786
  448   2HE   LYS  61          HE1       LYS  61  -4.989  -4.112  -8.246
  449   1HZ   LYS  61          HZ1       LYS  61  -4.499  -5.891  -6.554
  450   2HZ   LYS  61          HZ2       LYS  61  -5.420  -6.365  -7.879
  451   3HZ   LYS  61          HZ3       LYS  61  -6.163  -6.120  -6.398
  452    H    ARG  62           H        ARG  62  -0.405  -0.264  -6.453
  453    HA   ARG  62           HA       ARG  62   0.083   0.062  -9.308
  454   1HB   ARG  62          HB2       ARG  62  -0.543   2.396  -9.187
  455   2HB   ARG  62          HB1       ARG  62  -1.879   1.413  -8.617
  456   1HG   ARG  62          HG2       ARG  62  -1.019   1.899  -6.274
  457   2HG   ARG  62          HG1       ARG  62  -0.012   3.131  -7.027
  458   1HD   ARG  62          HD2       ARG  62  -1.926   4.283  -6.346
  459   2HD   ARG  62          HD1       ARG  62  -2.172   4.005  -8.067
  460    HE   ARG  62           HE       ARG  62  -3.433   2.425  -5.897
  461   1HH1  ARG  62          HH11      ARG  62  -3.634   3.667  -9.252
  462   2HH1  ARG  62          HH12      ARG  62  -5.230   3.127  -9.428
  463   1HH2  ARG  62          HH21      ARG  62  -5.453   1.726  -6.195
  464   2HH2  ARG  62          HH22      ARG  62  -6.342   1.962  -7.637
  465    H    TYR  63           H        TYR  63   2.090   0.943  -9.771
  466    HA   TYR  63           HA       TYR  63   4.034   0.850  -7.671
  467   1HB   TYR  63          HB2       TYR  63   4.356   1.837 -10.523
  468   2HB   TYR  63          HB1       TYR  63   5.664   1.447  -9.417
  469    HD1  TYR  63           HD1      TYR  63   3.785   0.233 -12.099
  470    HD2  TYR  63           HD2      TYR  63   5.495  -1.048  -8.429
  471    HE1  TYR  63           HE1      TYR  63   3.764  -2.082 -12.908
  472    HE2  TYR  63           HE2      TYR  63   5.477  -3.370  -9.230
  473    HH   TYR  63           HH       TYR  63   4.968  -4.137 -12.474
  474    H    ASP  64           H        ASP  64   2.080   3.164  -9.114
  475    HA   ASP  64           HA       ASP  64   3.326   5.654  -8.721
  476   1HB   ASP  64          HB2       ASP  64   0.388   5.074  -8.362
  477   2HB   ASP  64          HB1       ASP  64   1.128   6.588  -8.849
  478    H    ALA  65           H        ALA  65   1.550   3.673  -6.448
  479    HA   ALA  65           HA       ALA  65   1.105   5.765  -4.605
  480   1HB   ALA  65          HB1       ALA  65   1.100   2.796  -4.216
  481   2HB   ALA  65          HB2       ALA  65  -0.280   3.808  -4.632
  482   3HB   ALA  65          HB3       ALA  65   0.490   3.966  -3.049
  483    H    LEU  66           H        LEU  66   3.772   3.741  -5.203
  484    HA   LEU  66           HA       LEU  66   5.058   4.234  -2.663
  485   1HB   LEU  66          HB2       LEU  66   6.233   3.192  -5.201
  486   2HB   LEU  66          HB1       LEU  66   7.017   3.159  -3.635
  487    HG   LEU  66           HG       LEU  66   6.332   0.987  -3.959
  488   1HD1  LEU  66          HD11      LEU  66   5.723   1.762  -1.751
  489   2HD1  LEU  66          HD12      LEU  66   4.579   0.543  -2.321
  490   3HD1  LEU  66          HD13      LEU  66   4.133   2.243  -2.350
  491   1HD2  LEU  66          HD21      LEU  66   3.672   2.017  -4.893
  492   2HD2  LEU  66          HD22      LEU  66   4.110   0.308  -4.744
  493   3HD2  LEU  66          HD23      LEU  66   4.952   1.354  -5.899
  494    H    SER  67           H        SER  67   5.043   5.516  -5.884
  495    HA   SER  67           HA       SER  67   7.418   7.118  -5.694
  496   1HB   SER  67          HB2       SER  67   5.060   6.846  -7.411
  497   2HB   SER  67          HB1       SER  67   6.128   8.226  -7.692
  498    HG   SER  67           HG       SER  67   7.579   5.973  -7.509
  499    H    GLU  68           H        GLU  68   3.960   7.733  -5.515
  500    HA   GLU  68           HA       GLU  68   4.339  10.457  -4.780
  501   1HB   GLU  68          HB2       GLU  68   1.840   9.157  -3.957
  502   2HB   GLU  68          HB1       GLU  68   2.122  10.678  -4.796
  503   1HG   GLU  68          HG2       GLU  68   2.705   9.243  -6.830
  504   2HG   GLU  68          HG1       GLU  68   2.067   7.934  -5.912
  505    H    HIS  69           H        HIS  69   4.458   7.568  -3.158
  506    HA   HIS  69           HA       HIS  69   3.468   8.029  -0.629
  507   1HB   HIS  69          HB2       HIS  69   4.546   5.946  -1.610
  508   2HB   HIS  69          HB1       HIS  69   6.057   6.620  -0.977
  509    HD1  HIS  69           HD1      HIS  69   2.659   5.498   0.229
  510    HD2  HIS  69           HD2      HIS  69   6.504   6.155   1.520
  511    HE1  HIS  69           HE1      HIS  69   2.700   4.680   2.617
  512    H    ASN  70           H        ASN  70   6.930   8.566  -1.431
  513    HA   ASN  70           HA       ASN  70   7.411  10.059   0.980
  514   1HB   ASN  70          HB2       ASN  70   9.586  10.598  -0.094
  515   2HB   ASN  70          HB1       ASN  70   9.249   8.878   0.006
  516   1HD2  ASN  70          HD21      ASN  70  11.075   9.970  -1.569
  517   2HD2  ASN  70          HD22      ASN  70  10.633   9.714  -3.252
  518    H    LEU  71           H        LEU  71   5.928  10.880  -1.829
  519    HA   LEU  71           HA       LEU  71   6.547  13.690  -1.753
  520   1HB   LEU  71          HB2       LEU  71   6.130  12.974  -3.897
  521   2HB   LEU  71          HB1       LEU  71   4.915  11.831  -3.386
  522    HG   LEU  71           HG       LEU  71   3.334  13.592  -3.117
  523   1HD1  LEU  71          HD11      LEU  71   5.511  15.371  -4.336
  524   2HD1  LEU  71          HD12      LEU  71   4.929  15.475  -2.679
  525   3HD1  LEU  71          HD13      LEU  71   3.854  15.894  -4.016
  526   1HD2  LEU  71          HD21      LEU  71   4.654  13.503  -5.822
  527   2HD2  LEU  71          HD22      LEU  71   3.031  14.117  -5.516
  528   3HD2  LEU  71          HD23      LEU  71   3.405  12.422  -5.202
  529    H    LYS  72           H        LYS  72   3.773  11.644  -0.921
  530    HA   LYS  72           HA       LYS  72   2.612  13.935   0.477
  531   1HB   LYS  72          HB2       LYS  72   0.516  12.168   0.278
  532   2HB   LYS  72          HB1       LYS  72   0.751  13.557  -0.785
  533   1HG   LYS  72          HG2       LYS  72   2.141  11.908  -2.196
  534   2HG   LYS  72          HG1       LYS  72   1.419  10.650  -1.247
  535   1HD   LYS  72          HD2       LYS  72  -0.051  12.656  -2.947
  536   2HD   LYS  72          HD1       LYS  72   0.222  10.958  -3.322
  537   1HE   LYS  72          HE2       LYS  72  -1.168  10.357  -1.319
  538   2HE   LYS  72          HE1       LYS  72  -1.465  12.063  -1.075
  539   1HZ   LYS  72          HZ1       LYS  72  -2.249  10.540  -3.504
  540   2HZ   LYS  72          HZ2       LYS  72  -2.573  12.159  -3.195
  541   3HZ   LYS  72          HZ3       LYS  72  -3.260  10.971  -2.226
  542    H    TYR  73           H        TYR  73   3.287  10.616   0.830
  543    HA   TYR  73           HA       TYR  73   2.131  10.370   3.488
  544   1HB   TYR  73          HB2       TYR  73   3.704   8.459   1.794
  545   2HB   TYR  73          HB1       TYR  73   3.048   8.036   3.375
  546    HD1  TYR  73           HD1      TYR  73   1.850   9.572   0.157
  547    HD2  TYR  73           HD2      TYR  73   1.112   6.810   3.304
  548    HE1  TYR  73           HE1      TYR  73  -0.184   8.883  -0.932
  549    HE2  TYR  73           HE2      TYR  73  -0.968   6.136   2.189
  550    HH   TYR  73           HH       TYR  73  -2.538   7.166   0.688
  551    H    HIS  74           H        HIS  74   5.443   9.929   2.124
  552    HA   HIS  74           HA       HIS  74   6.497  10.633   4.822
  553   1HB   HIS  74          HB2       HIS  74   7.773   8.959   2.651
  554   2HB   HIS  74          HB1       HIS  74   8.612   9.431   4.120
  555    HD1  HIS  74           HD1      HIS  74   6.308   8.580   6.154
  556    HD2  HIS  74           HD2      HIS  74   7.718   6.365   2.950
  557    HE1  HIS  74           HE1      HIS  74   5.658   6.186   6.636
  558    HA   PRO  75           HA       PRO  75   7.717  13.974   1.772
  559   1HB   PRO  75          HB2       PRO  75   6.976  16.091   3.226
  560   2HB   PRO  75          HB1       PRO  75   5.804  15.143   2.289
  561   1HG   PRO  75          HG2       PRO  75   6.473  14.939   5.215
  562   2HG   PRO  75          HG1       PRO  75   4.871  15.037   4.458
  563   1HD   PRO  75          HD2       PRO  75   5.925  12.669   5.203
  564   2HD   PRO  75          HD1       PRO  75   4.940  12.861   3.737
  565    H    GLY  76           H        GLY  76   9.461  15.278   1.700
  566   1HA   GLY  76          HA2       GLY  76  10.905  16.677   3.418
  567   2HA   GLY  76          HA1       GLY  76  11.389  15.054   3.885
  568    H    GLU  77           H        GLU  77  11.295  13.948   1.236
  569    HA   GLU  77           HA       GLU  77  13.013  15.353  -0.524
  570   1HB   GLU  77          HB2       GLU  77  14.958  13.820  -0.289
  571   2HB   GLU  77          HB1       GLU  77  14.708  14.784   1.154
  572   1HG   GLU  77          HG2       GLU  77  14.923  12.844   2.258
  573   2HG   GLU  77          HG1       GLU  77  13.272  12.544   1.700
  574    H    GLU  78           H        GLU  78  13.738  13.606  -2.253
  575    HA   GLU  78           HA       GLU  78  11.627  11.573  -2.321
  576   1HB   GLU  78          HB2       GLU  78  10.994  13.571  -3.725
  577   2HB   GLU  78          HB1       GLU  78  12.464  13.230  -4.646
  578   1HG   GLU  78          HG2       GLU  78  11.605  11.101  -5.324
  579   2HG   GLU  78          HG1       GLU  78  10.149  11.326  -4.354
  580    H    ASN  79           H        ASN  79  13.179  10.038  -1.781
  581    HA   ASN  79           HA       ASN  79  14.830   9.117  -4.004
  582   1HB   ASN  79          HB2       ASN  79  15.820   9.696  -1.234
  583   2HB   ASN  79          HB1       ASN  79  16.786   8.818  -2.440
  584   1HD2  ASN  79          HD21      ASN  79  15.572  11.767  -1.351
  585   2HD2  ASN  79          HD22      ASN  79  16.291  12.874  -2.477
  586    H    PHE  80           H        PHE  80  13.487   7.363  -4.101
  587    HA   PHE  80           HA       PHE  80  13.391   5.605  -1.762
  588   1HB   PHE  80          HB2       PHE  80  11.557   6.141  -3.975
  589   2HB   PHE  80          HB1       PHE  80  11.843   4.433  -3.714
  590    HD1  PHE  80           HD1      PHE  80   9.945   7.241  -2.737
  591    HD2  PHE  80           HD2      PHE  80  11.547   3.601  -1.263
  592    HE1  PHE  80           HE1      PHE  80   8.204   7.173  -0.979
  593    HE2  PHE  80           HE2      PHE  80   9.805   3.521   0.448
  594    HZ   PHE  80           HZ       PHE  80   8.131   5.300   0.593
  595    H    LYS  81           H        LYS  81  14.078   3.483  -1.901
  596    HA   LYS  81           HA       LYS  81  15.778   2.812  -4.215
  597   1HB   LYS  81          HB2       LYS  81  17.388   2.018  -2.725
  598   2HB   LYS  81          HB1       LYS  81  16.556   3.159  -1.664
  599   1HG   LYS  81          HG2       LYS  81  15.249   1.465  -0.675
  600   2HG   LYS  81          HG1       LYS  81  15.801   0.277  -1.837
  601   1HD   LYS  81          HD2       LYS  81  18.139   0.757  -0.920
  602   2HD   LYS  81          HD1       LYS  81  17.253   1.521   0.420
  603   1HE   LYS  81          HE2       LYS  81  15.983  -0.520   0.772
  604   2HE   LYS  81          HE1       LYS  81  16.842  -1.282  -0.562
  605   1HZ   LYS  81          HZ1       LYS  81  18.154  -0.285   1.906
  606   2HZ   LYS  81          HZ2       LYS  81  18.885  -1.169   0.687
  607   3HZ   LYS  81          HZ3       LYS  81  17.715  -1.882   1.678
  608    H    LEU  82           H        LEU  82  15.856   0.278  -4.474
  609    HA   LEU  82           HA       LEU  82  13.318  -0.849  -3.618
  610   1HB   LEU  82          HB2       LEU  82  13.072  -2.017  -5.754
  611   2HB   LEU  82          HB1       LEU  82  13.018  -0.284  -5.962
  612    HG   LEU  82           HG       LEU  82  15.541  -1.822  -6.475
  613   1HD1  LEU  82          HD11      LEU  82  13.272  -1.268  -8.408
  614   2HD1  LEU  82          HD12      LEU  82  13.761  -2.857  -7.818
  615   3HD1  LEU  82          HD13      LEU  82  14.846  -1.925  -8.849
  616   1HD2  LEU  82          HD21      LEU  82  14.452   0.772  -7.583
  617   2HD2  LEU  82          HD22      LEU  82  16.003   0.046  -8.000
  618   3HD2  LEU  82          HD23      LEU  82  15.711   0.616  -6.358
  619    H    THR  83           H        THR  83  13.405  -2.902  -2.922
  620    HA   THR  83           HA       THR  83  15.827  -4.413  -3.328
  621    HB   THR  83           HB       THR  83  16.276  -3.290  -1.235
  622    HG1  THR  83           HG1      THR  83  15.976  -5.195   0.284
  623   1HG2  THR  83          HG21      THR  83  14.772  -3.340   0.709
  624   2HG2  THR  83          HG22      THR  83  13.588  -4.235  -0.239
  625   3HG2  THR  83          HG23      THR  83  13.987  -2.576  -0.681
  626    H    MET  84           H        MET  84  15.180  -6.637  -3.694
  627    HA   MET  84           HA       MET  84  12.250  -7.001  -3.474
  628   1HB   MET  84          HB2       MET  84  14.158  -9.038  -4.625
  629   2HB   MET  84          HB1       MET  84  12.447  -8.797  -4.949
  630   1HG   MET  84          HG2       MET  84  12.879  -6.868  -6.211
  631   2HG   MET  84          HG1       MET  84  14.602  -6.928  -5.833
  632   1HE   MET  84          HE1       MET  84  15.745 -10.134  -7.767
  633   2HE   MET  84          HE2       MET  84  15.226 -10.079  -6.088
  634   3HE   MET  84          HE3       MET  84  16.245  -8.791  -6.741
  635    H    VAL  85           H        VAL  85  11.891  -7.528  -1.376
  636    HA   VAL  85           HA       VAL  85  12.748 -10.134  -0.599
  637    HB   VAL  85           HB       VAL  85  13.103  -9.142   1.849
  638   1HG1  VAL  85          HG11      VAL  85  15.256  -8.959  -0.262
  639   2HG1  VAL  85          HG12      VAL  85  14.825 -10.400   0.661
  640   3HG1  VAL  85          HG13      VAL  85  15.535  -9.007   1.478
  641   1HG2  VAL  85          HG21      VAL  85  12.613  -6.818   1.270
  642   2HG2  VAL  85          HG22      VAL  85  13.929  -6.829   0.100
  643   3HG2  VAL  85          HG23      VAL  85  14.287  -6.971   1.824
  644    H    LYS  86           H        LYS  86  10.629 -10.980  -0.422
  645    HA   LYS  86           HA       LYS  86   9.236  -9.566   1.671
  646   1HB   LYS  86          HB2       LYS  86   8.249  -8.968  -0.634
  647   2HB   LYS  86          HB1       LYS  86   7.608 -10.621  -0.589
  648   1HG   LYS  86          HG2       LYS  86   5.927  -9.073   0.112
  649   2HG   LYS  86          HG1       LYS  86   6.380 -10.156   1.417
  650   1HD   LYS  86          HD2       LYS  86   7.579  -8.522   2.580
  651   2HD   LYS  86          HD1       LYS  86   7.795  -7.529   1.147
  652   1HE   LYS  86          HE2       LYS  86   5.610  -6.638   1.310
  653   2HE   LYS  86          HE1       LYS  86   5.080  -7.874   2.457
  654   1HZ   LYS  86          HZ1       LYS  86   6.650  -6.940   4.033
  655   2HZ   LYS  86          HZ2       LYS  86   5.580  -5.737   3.525
  656   3HZ   LYS  86          HZ3       LYS  86   7.166  -5.823   2.894
  657    H    ARG  87           H        ARG  87   8.681 -10.811   3.195
  658    HA   ARG  87           HA       ARG  87   8.893 -13.625   2.561
  659   1HB   ARG  87          HB2       ARG  87   9.819 -12.184   5.054
  660   2HB   ARG  87          HB1       ARG  87   9.861 -13.923   4.814
  661   1HG   ARG  87          HG2       ARG  87  12.088 -13.255   4.370
  662   2HG   ARG  87          HG1       ARG  87  11.348 -13.404   2.775
  663   1HD   ARG  87          HD2       ARG  87  12.698 -11.380   2.860
  664   2HD   ARG  87          HD1       ARG  87  10.996 -10.991   2.686
  665    HE   ARG  87           HE       ARG  87  12.064 -10.983   5.384
  666   1HH1  ARG  87          HH11      ARG  87  11.153  -8.934   2.578
  667   2HH1  ARG  87          HH12      ARG  87  11.044  -7.523   3.430
  668   1HH2  ARG  87          HH21      ARG  87  11.903  -8.974   6.597
  669   2HH2  ARG  87          HH22      ARG  87  11.481  -7.533   5.798
  670    H    ASN  88           H        ASN  88   7.512 -14.980   3.574
  671    HA   ASN  88           HA       ASN  88   5.765 -15.789   4.733
  672   1HB   ASN  88          HB2       ASN  88   6.631 -14.387   6.645
  673   2HB   ASN  88          HB1       ASN  88   5.560 -13.096   6.124
  674   1HD2  ASN  88          HD21      ASN  88   4.460 -13.106   8.066
  675   2HD2  ASN  88          HD22      ASN  88   3.344 -14.352   8.492
  676    H    ASN  89           H        ASN  89   5.582 -13.972   2.262
  677    HA   ASN  89           HA       ASN  89   2.644 -13.936   2.182
  678   1HB   ASN  89          HB2       ASN  89   4.324 -11.551   1.347
  679   2HB   ASN  89          HB1       ASN  89   2.614 -11.734   1.018
  680   1HD2  ASN  89          HD21      ASN  89   5.045 -11.033   3.376
  681   2HD2  ASN  89          HD22      ASN  89   3.957 -10.440   4.574
  682    H    GLN  90           H        GLN  90   5.068 -12.571   0.031
  683    HA   GLN  90           HA       GLN  90   5.171 -14.677  -1.835
  684   1HB   GLN  90          HB2       GLN  90   4.246 -13.533  -3.730
  685   2HB   GLN  90          HB1       GLN  90   2.963 -13.485  -2.505
  686   1HG   GLN  90          HG2       GLN  90   4.870 -11.235  -2.975
  687   2HG   GLN  90          HG1       GLN  90   3.466 -11.447  -4.010
  688   1HE2  GLN  90          HE21      GLN  90   4.643 -10.568  -0.926
  689   2HE2  GLN  90          HE22      GLN  90   3.164  -9.900  -0.308
  690    H    THR  91           H        THR  91   6.641 -13.659  -3.682
  691    HA   THR  91           HA       THR  91   8.337 -11.789  -2.289
  692    HB   THR  91           HB       THR  91  10.009 -12.473  -4.180
  693    HG1  THR  91           HG1      THR  91   8.208 -14.701  -4.179
  694   1HG2  THR  91          HG21      THR  91   9.250 -14.396  -1.948
  695   2HG2  THR  91          HG22      THR  91  10.304 -13.011  -1.758
  696   3HG2  THR  91          HG23      THR  91  10.804 -14.358  -2.770
  697    H    ILE  92           H        ILE  92   8.207  -9.802  -2.689
  698    HA   ILE  92           HA       ILE  92   7.602  -8.740  -5.235
  699    HB   ILE  92           HB       ILE  92   6.064  -7.057  -4.089
  700   1HG1  ILE  92          HG12      ILE  92   4.769  -8.247  -2.165
  701   2HG1  ILE  92          HG11      ILE  92   6.288  -9.106  -2.019
  702   1HG2  ILE  92          HG21      ILE  92   4.087  -8.544  -4.242
  703   2HG2  ILE  92          HG22      ILE  92   5.197  -9.908  -4.472
  704   3HG2  ILE  92          HG23      ILE  92   5.149  -8.594  -5.645
  705   1HD1  ILE  92          HD11      ILE  92   6.179  -7.132  -0.544
  706   2HD1  ILE  92          HD12      ILE  92   6.129  -6.110  -1.983
  707   3HD1  ILE  92          HD13      ILE  92   7.528  -7.120  -1.664
  708    H    PHE  93           H        PHE  93   7.994  -6.291  -5.213
  709    HA   PHE  93           HA       PHE  93  10.721  -6.076  -4.213
  710   1HB   PHE  93          HB2       PHE  93   9.041  -4.209  -5.878
  711   2HB   PHE  93          HB1       PHE  93  10.759  -4.076  -5.611
  712    HD1  PHE  93           HD1      PHE  93   8.119  -6.017  -7.272
  713    HD2  PHE  93           HD2      PHE  93  12.232  -5.232  -6.895
  714    HE1  PHE  93           HE1      PHE  93   8.503  -7.222  -9.391
  715    HE2  PHE  93           HE2      PHE  93  12.674  -6.440  -9.030
  716    HZ   PHE  93           HZ       PHE  93  10.794  -7.431 -10.268
  717    H    GLU  94           H        GLU  94  11.143  -4.882  -2.443
  718    HA   GLU  94           HA       GLU  94   9.010  -3.265  -1.337
  719   1HB   GLU  94          HB2       GLU  94  11.584  -4.157   0.005
  720   2HB   GLU  94          HB1       GLU  94  10.227  -3.353   0.756
  721   1HG   GLU  94          HG2       GLU  94   8.948  -5.453  -0.181
  722   2HG   GLU  94          HG1       GLU  94  10.548  -6.171   0.021
  723    H    GLN  95           H        GLN  95   9.341  -1.138  -0.969
  724    HA   GLN  95           HA       GLN  95  11.769  -0.050  -2.208
  725   1HB   GLN  95          HB2       GLN  95   9.506   0.188  -3.452
  726   2HB   GLN  95          HB1       GLN  95   9.085   1.336  -2.185
  727   1HG   GLN  95          HG2       GLN  95  10.874   2.758  -2.763
  728   2HG   GLN  95          HG1       GLN  95  11.552   1.545  -3.844
  729   1HE2  GLN  95          HE21      GLN  95   9.127   4.033  -3.393
  730   2HE2  GLN  95          HE22      GLN  95   8.691   4.128  -5.051
  731    H    THR  96           H        THR  96  13.049   0.889  -0.716
  732    HA   THR  96           HA       THR  96  11.794   1.973   1.744
  733    HB   THR  96           HB       THR  96  14.640   1.546   1.997
  734    HG1  THR  96           HG1      THR  96  13.056  -0.424   0.837
  735   1HG2  THR  96          HG21      THR  96  12.226   0.305   3.341
  736   2HG2  THR  96          HG22      THR  96  13.054   1.742   3.868
  737   3HG2  THR  96          HG23      THR  96  13.882   0.178   3.923
  738    H    ILE  97           H        ILE  97  12.960   3.816   2.714
  739    HA   ILE  97           HA       ILE  97  14.061   5.595   0.623
  740    HB   ILE  97           HB       ILE  97  13.004   6.435   3.335
  741   1HG1  ILE  97          HG12      ILE  97  11.374   6.483   0.842
  742   2HG1  ILE  97          HG11      ILE  97  11.391   5.019   1.806
  743   1HG2  ILE  97          HG21      ILE  97  12.757   8.551   2.198
  744   2HG2  ILE  97          HG22      ILE  97  13.072   7.814   0.627
  745   3HG2  ILE  97          HG23      ILE  97  14.374   7.971   1.798
  746   1HD1  ILE  97          HD11      ILE  97   9.538   6.094   2.465
  747   2HD1  ILE  97          HD12      ILE  97  10.226   7.689   2.375
  748   3HD1  ILE  97          HD13      ILE  97  10.668   6.590   3.723
  749    H    ASN  98           H        ASN  98  15.823   6.875   1.226
  750    HA   ASN  98           HA       ASN  98  17.583   5.593   3.176
  751   1HB   ASN  98          HB2       ASN  98  19.339   7.046   2.000
  752   2HB   ASN  98          HB1       ASN  98  18.657   5.713   1.070
  753   1HD2  ASN  98          HD21      ASN  98  17.090   8.882   1.660
  754   2HD2  ASN  98          HD22      ASN  98  17.109   9.348   0.037
  755    H    ASP  99           H        ASP  99  15.360   7.652   3.628
  756    HA   ASP  99           HA       ASP  99  16.884   9.400   5.410
  757   1HB   ASP  99          HB2       ASP  99  16.816  10.373   3.072
  758   2HB   ASP  99          HB1       ASP  99  15.111  10.601   3.335
  759    H    LEU 100           H        LEU 100  13.768   9.168   3.778
  760    HA   LEU 100           HA       LEU 100  12.226  10.192   5.964
  761   1HB   LEU 100          HB2       LEU 100  11.225   8.833   3.459
  762   2HB   LEU 100          HB1       LEU 100  10.450   9.998   4.499
  763    HG   LEU 100           HG       LEU 100  12.933  10.888   3.159
  764   1HD1  LEU 100          HD11      LEU 100  11.462  11.594   1.236
  765   2HD1  LEU 100          HD12      LEU 100  10.302  10.367   1.796
  766   3HD1  LEU 100          HD13      LEU 100  11.924   9.917   1.272
  767   1HD2  LEU 100          HD21      LEU 100  10.273  12.125   3.657
  768   2HD2  LEU 100          HD22      LEU 100  11.726  12.946   3.106
  769   3HD2  LEU 100          HD23      LEU 100  11.661  12.266   4.749
  770    H    THR 101           H        THR 101  13.734   7.501   5.896
  771    HA   THR 101           HA       THR 101  12.103   5.312   6.177
  772    HB   THR 101           HB       THR 101  14.596   5.937   7.740
  773    HG1  THR 101           HG1      THR 101  14.476   5.031   5.069
  774   1HG2  THR 101          HG21      THR 101  13.675   3.429   6.316
  775   2HG2  THR 101          HG22      THR 101  13.507   3.704   8.050
  776   3HG2  THR 101          HG23      THR 101  15.113   3.588   7.324
  777    H    PHE 102           H        PHE 102  12.995   7.934   8.296
  778    HA   PHE 102           HA       PHE 102  11.541   6.761  10.573
  779   1HB   PHE 102          HB2       PHE 102  13.575   9.007  10.560
  780   2HB   PHE 102          HB1       PHE 102  12.819   8.290  11.981
  781    HD1  PHE 102           HD1      PHE 102  13.504   6.099  12.770
  782    HD2  PHE 102           HD2      PHE 102  15.350   7.879   9.376
  783    HE1  PHE 102           HE1      PHE 102  15.336   4.470  12.911
  784    HE2  PHE 102           HE2      PHE 102  17.183   6.254   9.510
  785    HZ   PHE 102           HZ       PHE 102  17.177   4.542  11.280
  Start of MODEL    7
    1    HA   MET   1           HA       MET   1 -14.227  11.991  16.274
    2   1HB   MET   1          HB2       MET   1 -14.515  12.010  19.282
    3   2HB   MET   1          HB1       MET   1 -14.628  10.564  18.293
    4   1HG   MET   1          HG2       MET   1 -12.213  12.343  18.481
    5   2HG   MET   1          HG1       MET   1 -12.429  10.829  19.359
    6   1HE   MET   1          HE1       MET   1 -10.102   9.979  18.413
    7   2HE   MET   1          HE2       MET   1  -9.894  11.487  17.523
    8   3HE   MET   1          HE3       MET   1  -9.694   9.943  16.699
    9    H    ALA   2           H        ALA   2 -16.043  12.704  15.088
   10    HA   ALA   2           HA       ALA   2 -18.499  11.616  16.006
   11   1HB   ALA   2          HB1       ALA   2 -19.809  13.694  15.757
   12   2HB   ALA   2          HB2       ALA   2 -18.318  14.607  15.538
   13   3HB   ALA   2          HB3       ALA   2 -18.657  13.827  17.086
   14    H    HIS   3           H        HIS   3 -20.075  11.713  14.225
   15    HA   HIS   3           HA       HIS   3 -20.764  11.592  12.103
   16   1HB   HIS   3          HB2       HIS   3 -19.959  13.898  11.777
   17   2HB   HIS   3          HB1       HIS   3 -18.338  13.312  11.458
   18    HD1  HIS   3           HD1      HIS   3 -21.585  14.058   9.801
   19    HD2  HIS   3           HD2      HIS   3 -18.022  12.120   8.890
   20    HE1  HIS   3           HE1      HIS   3 -21.534  13.838   7.305
   21    H    HIS   4           H        HIS   4 -17.249  11.374  11.964
   22    HA   HIS   4           HA       HIS   4 -15.807   9.894  11.240
   23   1HB   HIS   4          HB2       HIS   4 -18.007   7.873  11.738
   24   2HB   HIS   4          HB1       HIS   4 -16.348   7.432  11.328
   25    HD1  HIS   4           HD1      HIS   4 -14.543   7.725  13.222
   26    HD2  HIS   4           HD2      HIS   4 -18.374   8.921  14.298
   27    HE1  HIS   4           HE1      HIS   4 -14.475   8.127  15.694
   28    H    HIS   5           H        HIS   5 -14.944   9.020   9.491
   29    HA   HIS   5           HA       HIS   5 -14.469   9.078   7.329
   30   1HB   HIS   5          HB2       HIS   5 -16.425   7.387   7.118
   31   2HB   HIS   5          HB1       HIS   5 -17.436   8.765   6.716
   32    HD1  HIS   5           HD1      HIS   5 -14.897   6.450   5.297
   33    HD2  HIS   5           HD2      HIS   5 -16.955   9.871   4.160
   34    HE1  HIS   5           HE1      HIS   5 -14.637   6.628   2.794
   35    H    HIS   6           H        HIS   6 -13.798  11.006   7.555
   36    HA   HIS   6           HA       HIS   6 -15.586  13.272   7.839
   37   1HB   HIS   6          HB2       HIS   6 -12.572  13.128   8.083
   38   2HB   HIS   6          HB1       HIS   6 -13.620  14.425   8.642
   39    HD1  HIS   6           HD1      HIS   6 -11.894  11.521   9.910
   40    HD2  HIS   6           HD2      HIS   6 -15.538  13.370  10.700
   41    HE1  HIS   6           HE1      HIS   6 -12.653  10.654  12.144
   42    H    HIS   7           H        HIS   7 -14.047  15.331   6.883
   43    HA   HIS   7           HA       HIS   7 -14.460  15.022   4.056
   44   1HB   HIS   7          HB2       HIS   7 -15.046  17.137   5.352
   45   2HB   HIS   7          HB1       HIS   7 -13.324  17.436   5.505
   46    HD1  HIS   7           HD1      HIS   7 -15.869  16.960   2.688
   47    HD2  HIS   7           HD2      HIS   7 -12.308  18.928   3.523
   48    HE1  HIS   7           HE1      HIS   7 -15.329  18.315   0.655
   49    H    HIS   8           H        HIS   8 -11.980  14.497   6.199
   50    HA   HIS   8           HA       HIS   8  -9.833  14.745   4.276
   51   1HB   HIS   8          HB2       HIS   8  -9.955  13.840   7.133
   52   2HB   HIS   8          HB1       HIS   8  -8.569  13.394   6.147
   53    HD1  HIS   8           HD1      HIS   8  -6.985  15.310   5.404
   54    HD2  HIS   8           HD2      HIS   8 -10.072  16.505   7.908
   55    HE1  HIS   8           HE1      HIS   8  -6.365  17.614   6.217
   56    H    ASN   9           H        ASN   9 -12.262  12.879   4.184
   57    HA   ASN   9           HA       ASN   9 -10.797  10.496   3.330
   58   1HB   ASN   9          HB2       ASN   9 -13.608  10.797   4.423
   59   2HB   ASN   9          HB1       ASN   9 -13.047   9.336   3.628
   60   1HD2  ASN   9          HD21      ASN   9 -11.644   8.014   4.693
   61   2HD2  ASN   9          HD22      ASN   9 -11.276   8.176   6.379
   62    H    GLN  10           H        GLN  10 -10.688  10.413   1.166
   63    HA   GLN  10           HA       GLN  10 -12.529  12.014  -0.437
   64   1HB   GLN  10          HB2       GLN  10 -10.213  10.281  -1.310
   65   2HB   GLN  10          HB1       GLN  10 -11.104  11.401  -2.316
   66   1HG   GLN  10          HG2       GLN  10 -10.218  13.269  -1.046
   67   2HG   GLN  10          HG1       GLN  10  -9.376  12.148   0.030
   68   1HE2  GLN  10          HE21      GLN  10  -7.380  13.004  -0.516
   69   2HE2  GLN  10          HE22      GLN  10  -6.608  12.705  -2.023
   70    H    GLN  11           H        GLN  11 -12.359   8.921   0.799
   71    HA   GLN  11           HA       GLN  11 -13.004   6.828   0.267
   72   1HB   GLN  11          HB2       GLN  11 -15.382   6.560  -0.418
   73   2HB   GLN  11          HB1       GLN  11 -15.214   7.776   0.825
   74   1HG   GLN  11          HG2       GLN  11 -15.434   9.517  -0.934
   75   2HG   GLN  11          HG1       GLN  11 -15.697   8.238  -2.115
   76   1HE2  GLN  11          HE21      GLN  11 -17.749   8.933  -2.613
   77   2HE2  GLN  11          HE22      GLN  11 -19.079   8.745  -1.528
   78    H    ASN  12           H        ASN  12 -11.157   7.564  -1.320
   79    HA   ASN  12           HA       ASN  12 -11.957   7.117  -4.105
   80   1HB   ASN  12          HB2       ASN  12 -10.903   9.265  -3.591
   81   2HB   ASN  12          HB1       ASN  12  -9.539   8.439  -2.869
   82   1HD2  ASN  12          HD21      ASN  12  -8.218   9.597  -4.227
   83   2HD2  ASN  12          HD22      ASN  12  -8.037   9.221  -5.906
   84    H    LYS  13           H        LYS  13 -10.895   5.611  -5.335
   85    HA   LYS  13           HA       LYS  13  -9.806   3.386  -3.892
   86   1HB   LYS  13          HB2       LYS  13 -10.062   3.822  -6.868
   87   2HB   LYS  13          HB1       LYS  13  -9.575   2.324  -6.102
   88   1HG   LYS  13          HG2       LYS  13 -11.754   2.211  -4.970
   89   2HG   LYS  13          HG1       LYS  13 -12.237   3.678  -5.829
   90   1HD   LYS  13          HD2       LYS  13 -11.952   2.554  -7.954
   91   2HD   LYS  13          HD1       LYS  13 -11.410   1.092  -7.128
   92   1HE   LYS  13          HE2       LYS  13 -13.588   0.956  -5.996
   93   2HE   LYS  13          HE1       LYS  13 -14.116   2.384  -6.883
   94   1HZ   LYS  13          HZ1       LYS  13 -14.895   0.359  -7.884
   95   2HZ   LYS  13          HZ2       LYS  13 -13.322  -0.203  -8.086
   96   3HZ   LYS  13          HZ3       LYS  13 -13.860   1.175  -8.936
   97    H    LYS  14           H        LYS  14  -8.606   6.041  -5.720
   98    HA   LYS  14           HA       LYS  14  -5.930   5.042  -5.940
   99   1HB   LYS  14          HB2       LYS  14  -6.574   6.696  -7.560
  100   2HB   LYS  14          HB1       LYS  14  -7.160   7.783  -6.316
  101   1HG   LYS  14          HG2       LYS  14  -5.079   8.613  -7.236
  102   2HG   LYS  14          HG1       LYS  14  -4.845   8.139  -5.557
  103   1HD   LYS  14          HD2       LYS  14  -3.966   5.941  -6.409
  104   2HD   LYS  14          HD1       LYS  14  -4.012   6.639  -8.028
  105   1HE   LYS  14          HE2       LYS  14  -2.493   7.802  -5.705
  106   2HE   LYS  14          HE1       LYS  14  -1.775   6.766  -6.939
  107   1HZ   LYS  14          HZ1       LYS  14  -2.246   8.449  -8.565
  108   2HZ   LYS  14          HZ2       LYS  14  -1.389   9.102  -7.257
  109   3HZ   LYS  14          HZ3       LYS  14  -3.024   9.430  -7.425
  110    H    VAL  15           H        VAL  15  -4.513   4.967  -4.393
  111    HA   VAL  15           HA       VAL  15  -4.706   5.248  -1.813
  112    HB   VAL  15           HB       VAL  15  -2.650   4.613  -3.359
  113   1HG1  VAL  15          HG11      VAL  15  -2.022   6.694  -4.186
  114   2HG1  VAL  15          HG12      VAL  15  -0.735   6.134  -3.086
  115   3HG1  VAL  15          HG13      VAL  15  -1.903   7.350  -2.556
  116   1HG2  VAL  15          HG21      VAL  15  -2.813   3.999  -1.048
  117   2HG2  VAL  15          HG22      VAL  15  -2.327   5.617  -0.570
  118   3HG2  VAL  15          HG23      VAL  15  -1.170   4.563  -1.395
  119    H    GLU  16           H        GLU  16  -5.346   6.826  -0.424
  120    HA   GLU  16           HA       GLU  16  -5.117   9.625  -1.249
  121   1HB   GLU  16          HB2       GLU  16  -6.506   8.490   1.162
  122   2HB   GLU  16          HB1       GLU  16  -6.686  10.092   0.461
  123   1HG   GLU  16          HG2       GLU  16  -7.698   9.115  -1.506
  124   2HG   GLU  16          HG1       GLU  16  -7.462   7.516  -0.795
  125    H    GLY  17           H        GLY  17  -4.888   8.159   1.946
  126   1HA   GLY  17          HA2       GLY  17  -2.237   9.363   2.202
  127   2HA   GLY  17          HA1       GLY  17  -3.511   9.993   3.254
  128    H    GLY  18           H        GLY  18  -3.806   6.782   2.501
  129   1HA   GLY  18          HA2       GLY  18  -2.473   6.047   5.006
  130   2HA   GLY  18          HA1       GLY  18  -4.100   5.481   4.643
  131    H    TYR  19           H        TYR  19  -3.611   3.321   4.663
  132    HA   TYR  19           HA       TYR  19  -1.631   2.447   2.694
  133   1HB   TYR  19          HB2       TYR  19  -2.744   0.897   5.016
  134   2HB   TYR  19          HB1       TYR  19  -1.299   0.527   4.065
  135    HD1  TYR  19           HD1      TYR  19   0.409   2.664   4.013
  136    HD2  TYR  19           HD2      TYR  19  -2.319   1.723   7.143
  137    HE1  TYR  19           HE1      TYR  19   1.711   4.045   5.565
  138    HE2  TYR  19           HE2      TYR  19  -1.050   3.083   8.679
  139    HH   TYR  19           HH       TYR  19   1.200   5.299   7.629
  140    H    GLU  20           H        GLU  20  -2.447   1.986   0.935
  141    HA   GLU  20           HA       GLU  20  -5.114   0.881   0.580
  142   1HB   GLU  20          HB2       GLU  20  -4.313   2.691  -0.864
  143   2HB   GLU  20          HB1       GLU  20  -2.889   1.753  -1.292
  144   1HG   GLU  20          HG2       GLU  20  -4.631   0.057  -2.188
  145   2HG   GLU  20          HG1       GLU  20  -5.723   1.434  -2.155
  146    H    CYS  21           H        CYS  21  -5.191  -1.310   0.639
  147    HA   CYS  21           HA       CYS  21  -2.828  -2.925   0.625
  148   1HB   CYS  21          HB2       CYS  21  -5.680  -3.809   0.296
  149   2HB   CYS  21          HB1       CYS  21  -4.307  -4.855   0.572
  150    H    LYS  22           H        LYS  22  -2.091  -4.286  -0.866
  151    HA   LYS  22           HA       LYS  22  -2.598  -3.964  -3.633
  152   1HB   LYS  22          HB2       LYS  22  -0.456  -4.649  -2.649
  153   2HB   LYS  22          HB1       LYS  22  -1.190  -6.131  -2.069
  154   1HG   LYS  22          HG2       LYS  22  -1.201  -5.487  -4.975
  155   2HG   LYS  22          HG1       LYS  22   0.254  -6.130  -4.216
  156   1HD   LYS  22          HD2       LYS  22  -0.956  -8.076  -3.479
  157   2HD   LYS  22          HD1       LYS  22  -2.465  -7.419  -4.121
  158   1HE   LYS  22          HE2       LYS  22  -0.025  -7.932  -5.732
  159   2HE   LYS  22          HE1       LYS  22  -1.332  -9.123  -5.555
  160   1HZ   LYS  22          HZ1       LYS  22  -1.540  -7.849  -7.599
  161   2HZ   LYS  22          HZ2       LYS  22  -1.528  -6.399  -6.782
  162   3HZ   LYS  22          HZ3       LYS  22  -2.821  -7.467  -6.587
  163    H    TYR  23           H        TYR  23  -3.971  -5.966  -1.128
  164    HA   TYR  23           HA       TYR  23  -5.163  -7.664  -3.165
  165   1HB   TYR  23          HB2       TYR  23  -5.597  -8.582  -0.453
  166   2HB   TYR  23          HB1       TYR  23  -4.878  -9.417  -1.814
  167    HD1  TYR  23           HD1      TYR  23  -2.358  -9.195  -2.187
  168    HD2  TYR  23           HD2      TYR  23  -4.297  -7.705   1.272
  169    HE1  TYR  23           HE1      TYR  23  -0.200  -9.167  -0.984
  170    HE2  TYR  23           HE2      TYR  23  -2.185  -7.664   2.476
  171    HH   TYR  23           HH       TYR  23  -0.006  -8.925   2.333
  172    H    CYS  24           H        CYS  24  -6.005  -4.949  -1.658
  173    HA   CYS  24           HA       CYS  24  -8.731  -5.442  -2.152
  174   1HB   CYS  24          HB2       CYS  24  -9.673  -4.998   0.072
  175   2HB   CYS  24          HB1       CYS  24  -8.532  -6.330   0.146
  176    H    THR  25           H        THR  25  -9.599  -3.621  -2.912
  177    HA   THR  25           HA       THR  25  -7.845  -1.338  -2.896
  178    HB   THR  25           HB       THR  25 -10.455  -1.673  -4.409
  179    HG1  THR  25           HG1      THR  25  -8.280  -3.072  -4.617
  180   1HG2  THR  25          HG21      THR  25  -9.574   0.639  -4.273
  181   2HG2  THR  25          HG22      THR  25  -9.453  -0.001  -5.915
  182   3HG2  THR  25          HG23      THR  25  -8.020   0.073  -4.890
  183    H    PHE  26           H        PHE  26  -8.310  -1.311  -0.594
  184    HA   PHE  26           HA       PHE  26 -10.271   0.716   0.031
  185   1HB   PHE  26          HB2       PHE  26  -9.930  -1.877   1.596
  186   2HB   PHE  26          HB1       PHE  26 -10.775  -0.466   2.205
  187    HD1  PHE  26           HD1      PHE  26 -12.891   0.264   1.063
  188    HD2  PHE  26           HD2      PHE  26 -10.996  -3.446   0.206
  189    HE1  PHE  26           HE1      PHE  26 -14.983  -0.572   0.079
  190    HE2  PHE  26           HE2      PHE  26 -13.083  -4.289  -0.782
  191    HZ   PHE  26           HZ       PHE  26 -15.081  -2.850  -0.846
  192    H    GLN  27           H        GLN  27  -9.527   1.897   1.907
  193    HA   GLN  27           HA       GLN  27  -6.732   1.368   2.464
  194   1HB   GLN  27          HB2       GLN  27  -6.572   2.948   0.757
  195   2HB   GLN  27          HB1       GLN  27  -7.891   3.927   1.404
  196   1HG   GLN  27          HG2       GLN  27  -6.518   4.630   3.225
  197   2HG   GLN  27          HG1       GLN  27  -5.260   3.489   2.763
  198   1HE2  GLN  27          HE21      GLN  27  -4.037   3.925   1.175
  199   2HE2  GLN  27          HE22      GLN  27  -3.845   5.440   0.378
  200    H    THR  28           H        THR  28  -6.017   1.945   4.439
  201    HA   THR  28           HA       THR  28  -7.580   3.750   6.020
  202    HB   THR  28           HB       THR  28  -8.394   1.570   6.842
  203    HG1  THR  28           HG1      THR  28  -8.343   2.764   8.591
  204   1HG2  THR  28          HG21      THR  28  -6.876  -0.079   7.877
  205   2HG2  THR  28          HG22      THR  28  -5.499   0.924   7.483
  206   3HG2  THR  28          HG23      THR  28  -6.433   0.176   6.190
  207    HA   PRO  29           HA       PRO  29  -3.345   5.115   6.579
  208   1HB   PRO  29          HB2       PRO  29  -3.942   7.292   8.108
  209   2HB   PRO  29          HB1       PRO  29  -4.082   7.267   6.347
  210   1HG   PRO  29          HG2       PRO  29  -6.197   6.955   8.412
  211   2HG   PRO  29          HG1       PRO  29  -6.245   7.832   6.871
  212   1HD   PRO  29          HD2       PRO  29  -7.359   5.367   7.215
  213   2HD   PRO  29          HD1       PRO  29  -6.695   5.916   5.655
  214    H    ASP  30           H        ASP  30  -5.407   3.768   8.800
  215    HA   ASP  30           HA       ASP  30  -3.623   4.136  11.068
  216   1HB   ASP  30          HB2       ASP  30  -6.170   2.518  10.776
  217   2HB   ASP  30          HB1       ASP  30  -5.259   2.713  12.261
  218    H    LEU  31           H        LEU  31  -1.831   2.925  10.913
  219    HA   LEU  31           HA       LEU  31  -1.435   0.714   9.354
  220   1HB   LEU  31          HB2       LEU  31   0.150   2.241  10.745
  221   2HB   LEU  31          HB1       LEU  31  -0.058   1.046  12.003
  222    HG   LEU  31           HG       LEU  31   2.021   0.576  10.873
  223   1HD1  LEU  31          HD11      LEU  31  -0.059  -1.300   9.900
  224   2HD1  LEU  31          HD12      LEU  31   0.782  -1.414  11.457
  225   3HD1  LEU  31          HD13      LEU  31   1.669  -1.658   9.933
  226   1HD2  LEU  31          HD21      LEU  31   1.562   1.804   8.863
  227   2HD2  LEU  31          HD22      LEU  31   0.428   0.569   8.351
  228   3HD2  LEU  31          HD23      LEU  31   2.159   0.181   8.471
  229    H    ASN  32           H        ASN  32  -2.506   0.966  12.728
  230    HA   ASN  32           HA       ASN  32  -2.521  -1.677  13.502
  231   1HB   ASN  32          HB2       ASN  32  -3.096   0.343  14.963
  232   2HB   ASN  32          HB1       ASN  32  -4.627   0.316  14.070
  233   1HD2  ASN  32          HD21      ASN  32  -3.355  -2.783  14.785
  234   2HD2  ASN  32          HD22      ASN  32  -4.513  -3.056  16.023
  235    H    MET  33           H        MET  33  -5.041   0.205  11.901
  236    HA   MET  33           HA       MET  33  -6.848  -1.983  11.876
  237   1HB   MET  33          HB2       MET  33  -6.972   0.550  10.232
  238   2HB   MET  33          HB1       MET  33  -8.293  -0.573  10.480
  239   1HG   MET  33          HG2       MET  33  -6.916   1.014  12.580
  240   2HG   MET  33          HG1       MET  33  -8.474   1.446  11.865
  241   1HE   MET  33          HE1       MET  33 -10.690  -0.102  12.195
  242   2HE   MET  33          HE2       MET  33 -10.717  -1.568  13.174
  243   3HE   MET  33          HE3       MET  33  -9.810  -1.537  11.664
  244    H    PHE  34           H        PHE  34  -4.497  -0.626   9.756
  245    HA   PHE  34           HA       PHE  34  -5.189  -2.000   7.399
  246   1HB   PHE  34          HB2       PHE  34  -3.673  -0.157   7.224
  247   2HB   PHE  34          HB1       PHE  34  -2.573  -0.842   8.391
  248    HD1  PHE  34           HD1      PHE  34  -3.965  -1.371   4.981
  249    HD2  PHE  34           HD2      PHE  34  -0.800  -2.192   7.707
  250    HE1  PHE  34           HE1      PHE  34  -2.665  -2.394   3.158
  251    HE2  PHE  34           HE2      PHE  34   0.512  -3.209   5.883
  252    HZ   PHE  34           HZ       PHE  34  -0.428  -3.311   3.605
  253    H    THR  35           H        THR  35  -2.746  -2.733   9.841
  254    HA   THR  35           HA       THR  35  -2.138  -5.222   8.629
  255    HB   THR  35           HB       THR  35  -0.402  -4.110   9.940
  256    HG1  THR  35           HG1      THR  35  -1.047  -6.672  10.198
  257   1HG2  THR  35          HG21      THR  35  -0.520  -3.999  12.387
  258   2HG2  THR  35          HG22      THR  35  -2.170  -4.644  12.322
  259   3HG2  THR  35          HG23      THR  35  -1.799  -3.072  11.605
  260    H    PHE  36           H        PHE  36  -4.449  -4.236  11.001
  261    HA   PHE  36           HA       PHE  36  -4.989  -6.825  11.962
  262   1HB   PHE  36          HB2       PHE  36  -5.634  -5.132  13.392
  263   2HB   PHE  36          HB1       PHE  36  -6.417  -4.179  12.150
  264    HD1  PHE  36           HD1      PHE  36  -8.708  -4.123  12.333
  265    HD2  PHE  36           HD2      PHE  36  -6.686  -7.641  13.573
  266    HE1  PHE  36           HE1      PHE  36 -10.865  -5.123  12.986
  267    HE2  PHE  36           HE2      PHE  36  -8.830  -8.648  14.252
  268    HZ   PHE  36           HZ       PHE  36 -10.924  -7.390  13.952
  269    H    HIS  37           H        HIS  37  -6.666  -4.777   9.541
  270    HA   HIS  37           HA       HIS  37  -8.497  -6.869   9.001
  271   1HB   HIS  37          HB2       HIS  37  -9.526  -5.473   7.403
  272   2HB   HIS  37          HB1       HIS  37  -8.778  -4.328   8.505
  273    HD1  HIS  37           HD1      HIS  37  -7.320  -2.572   7.414
  274    HD2  HIS  37           HD2      HIS  37  -8.078  -5.808   4.935
  275    HE1  HIS  37           HE1      HIS  37  -6.470  -1.902   5.127
  276    H    VAL  38           H        VAL  38  -5.386  -6.060   7.855
  277    HA   VAL  38           HA       VAL  38  -5.406  -7.742   5.571
  278    HB   VAL  38           HB       VAL  38  -3.147  -6.601   7.212
  279   1HG1  VAL  38          HG11      VAL  38  -1.578  -7.403   5.474
  280   2HG1  VAL  38          HG12      VAL  38  -2.908  -8.264   4.692
  281   3HG1  VAL  38          HG13      VAL  38  -2.376  -8.742   6.304
  282   1HG2  VAL  38          HG21      VAL  38  -2.706  -5.292   5.172
  283   2HG2  VAL  38          HG22      VAL  38  -4.316  -5.023   5.833
  284   3HG2  VAL  38          HG23      VAL  38  -4.113  -6.038   4.410
  285    H    ASP  39           H        ASP  39  -4.147  -8.164   8.869
  286    HA   ASP  39           HA       ASP  39  -3.238 -10.793   8.531
  287   1HB   ASP  39          HB2       ASP  39  -2.653  -9.216  10.394
  288   2HB   ASP  39          HB1       ASP  39  -4.245  -9.501  11.068
  289    H    SER  40           H        SER  40  -6.365  -9.508   9.106
  290    HA   SER  40           HA       SER  40  -7.477 -12.050   9.894
  291   1HB   SER  40          HB2       SER  40  -8.222  -9.862  10.869
  292   2HB   SER  40          HB1       SER  40  -8.891  -9.444   9.303
  293    HG   SER  40           HG       SER  40 -10.229 -11.313   9.474
  294    H    GLU  41           H        GLU  41  -7.609  -9.915   7.035
  295    HA   GLU  41           HA       GLU  41  -9.456 -11.813   5.751
  296   1HB   GLU  41          HB2       GLU  41  -8.644  -9.042   4.884
  297   2HB   GLU  41          HB1       GLU  41  -9.821 -10.058   4.064
  298   1HG   GLU  41          HG2       GLU  41 -11.255 -10.003   6.022
  299   2HG   GLU  41          HG1       GLU  41 -10.060  -9.027   6.879
  300    H    HIS  42           H        HIS  42  -6.281 -10.352   5.190
  301    HA   HIS  42           HA       HIS  42  -5.715 -12.333   3.192
  302   1HB   HIS  42          HB2       HIS  42  -4.556 -10.182   2.107
  303   2HB   HIS  42          HB1       HIS  42  -6.062 -10.801   1.470
  304    HD1  HIS  42           HD1      HIS  42  -8.156  -9.240   1.944
  305    HD2  HIS  42           HD2      HIS  42  -4.582  -7.727   3.415
  306    HE1  HIS  42           HE1      HIS  42  -8.613  -6.860   2.487
  307    HA   PRO  43           HA       PRO  43  -2.454 -11.299   6.404
  308   1HB   PRO  43          HB2       PRO  43  -1.810 -13.908   6.987
  309   2HB   PRO  43          HB1       PRO  43  -3.079 -12.992   7.813
  310   1HG   PRO  43          HG2       PRO  43  -3.340 -14.959   5.576
  311   2HG   PRO  43          HG1       PRO  43  -4.317 -14.799   7.049
  312   1HD   PRO  43          HD2       PRO  43  -5.167 -13.835   4.690
  313   2HD   PRO  43          HD1       PRO  43  -5.501 -12.994   6.220
  314    H    ASN  44           H        ASN  44  -2.443 -13.790   3.935
  315    HA   ASN  44           HA       ASN  44  -0.129 -12.609   2.792
  316   1HB   ASN  44          HB2       ASN  44   1.110 -14.693   2.511
  317   2HB   ASN  44          HB1       ASN  44   0.863 -14.405   4.230
  318   1HD2  ASN  44          HD21      ASN  44  -0.492 -15.712   5.309
  319   2HD2  ASN  44          HD22      ASN  44  -1.044 -17.238   4.720
  320    H    VAL  45           H        VAL  45  -0.190 -12.844   0.606
  321    HA   VAL  45           HA       VAL  45  -2.262 -14.474  -0.612
  322    HB   VAL  45           HB       VAL  45  -1.782 -11.500  -1.154
  323   1HG1  VAL  45          HG11      VAL  45  -3.732 -11.579  -2.559
  324   2HG1  VAL  45          HG12      VAL  45  -3.923 -13.297  -2.252
  325   3HG1  VAL  45          HG13      VAL  45  -2.512 -12.713  -3.164
  326   1HG2  VAL  45          HG21      VAL  45  -4.001 -11.097  -0.272
  327   2HG2  VAL  45          HG22      VAL  45  -2.897 -11.785   0.931
  328   3HG2  VAL  45          HG23      VAL  45  -4.123 -12.808   0.169
  329    H    VAL  46           H        VAL  46  -1.515 -14.941  -2.828
  330    HA   VAL  46           HA       VAL  46   1.091 -13.889  -3.215
  331    HB   VAL  46           HB       VAL  46   1.616 -15.942  -2.135
  332   1HG1  VAL  46          HG11      VAL  46   0.948 -18.154  -2.944
  333   2HG1  VAL  46          HG12      VAL  46  -0.073 -17.385  -4.161
  334   3HG1  VAL  46          HG13      VAL  46  -0.432 -17.170  -2.449
  335   1HG2  VAL  46          HG21      VAL  46   3.131 -15.376  -3.947
  336   2HG2  VAL  46          HG22      VAL  46   2.131 -16.266  -5.095
  337   3HG2  VAL  46          HG23      VAL  46   2.980 -17.129  -3.814
  338    H    LEU  47           H        LEU  47   0.725 -12.714  -4.942
  339    HA   LEU  47           HA       LEU  47  -0.285 -14.131  -7.284
  340   1HB   LEU  47          HB2       LEU  47  -0.206 -11.135  -6.859
  341   2HB   LEU  47          HB1       LEU  47  -0.760 -11.925  -8.322
  342    HG   LEU  47           HG       LEU  47  -2.081 -11.997  -5.607
  343   1HD1  LEU  47          HD11      LEU  47  -3.920 -10.924  -6.724
  344   2HD1  LEU  47          HD12      LEU  47  -3.043 -10.970  -8.250
  345   3HD1  LEU  47          HD13      LEU  47  -2.450  -9.967  -6.931
  346   1HD2  LEU  47          HD21      LEU  47  -2.839 -13.482  -8.118
  347   2HD2  LEU  47          HD22      LEU  47  -3.839 -13.332  -6.677
  348   3HD2  LEU  47          HD23      LEU  47  -2.305 -14.194  -6.590
  349    H    ASN  48           H        ASN  48   1.716 -11.172  -7.403
  350    HA   ASN  48           HA       ASN  48   4.080 -12.668  -7.636
  351   1HB   ASN  48          HB2       ASN  48   3.224 -13.172  -9.911
  352   2HB   ASN  48          HB1       ASN  48   3.190 -11.448 -10.262
  353   1HD2  ASN  48          HD21      ASN  48   4.706 -11.589 -11.922
  354   2HD2  ASN  48          HD22      ASN  48   6.367 -11.903 -11.625
  355    H    SER  49           H        SER  49   3.511  -9.682  -9.507
  356    HA   SER  49           HA       SER  49   5.572  -8.574  -7.791
  357   1HB   SER  49          HB2       SER  49   5.942  -7.024  -9.763
  358   2HB   SER  49          HB1       SER  49   6.348  -8.721 -10.017
  359    HG   SER  49           HG       SER  49   5.112  -8.548 -11.664
  360    H    SER  50           H        SER  50   5.146  -6.930  -6.485
  361    HA   SER  50           HA       SER  50   3.364  -4.831  -7.144
  362   1HB   SER  50          HB2       SER  50   3.020  -6.564  -4.682
  363   2HB   SER  50          HB1       SER  50   2.177  -5.062  -5.045
  364    HG   SER  50           HG       SER  50   1.955  -6.775  -7.085
  365    H    TYR  51           H        TYR  51   3.669  -3.194  -5.266
  366    HA   TYR  51           HA       TYR  51   6.443  -3.409  -4.336
  367   1HB   TYR  51          HB2       TYR  51   4.840  -1.095  -5.301
  368   2HB   TYR  51          HB1       TYR  51   6.220  -0.862  -4.251
  369    HD1  TYR  51           HD1      TYR  51   7.163   0.604  -5.893
  370    HD2  TYR  51           HD2      TYR  51   6.399  -3.458  -6.851
  371    HE1  TYR  51           HE1      TYR  51   8.590   0.816  -7.885
  372    HE2  TYR  51           HE2      TYR  51   7.819  -3.262  -8.846
  373    HH   TYR  51           HH       TYR  51   9.854  -0.579  -9.348
  374    H    VAL  52           H        VAL  52   6.870  -2.741  -2.290
  375    HA   VAL  52           HA       VAL  52   4.598  -1.965  -0.610
  376    HB   VAL  52           HB       VAL  52   5.076  -4.372  -0.262
  377   1HG1  VAL  52          HG11      VAL  52   7.422  -4.392  -0.784
  378   2HG1  VAL  52          HG12      VAL  52   7.104  -5.109   0.789
  379   3HG1  VAL  52          HG13      VAL  52   7.767  -3.475   0.688
  380   1HG2  VAL  52          HG21      VAL  52   5.386  -4.407   2.153
  381   2HG2  VAL  52          HG22      VAL  52   4.229  -3.186   1.632
  382   3HG2  VAL  52          HG23      VAL  52   5.865  -2.708   2.104
  383    H    CYS  53           H        CYS  53   5.027  -0.330   0.728
  384    HA   CYS  53           HA       CYS  53   7.649   0.962   0.656
  385   1HB   CYS  53          HB2       CYS  53   5.712   2.369   0.755
  386   2HB   CYS  53          HB1       CYS  53   5.054   1.517   2.139
  387    H    VAL  54           H        VAL  54   9.116  -0.399   1.652
  388    HA   VAL  54           HA       VAL  54   8.659  -2.115   3.753
  389    HB   VAL  54           HB       VAL  54  11.269  -0.948   4.071
  390   1HG1  VAL  54          HG11      VAL  54  12.036  -3.088   3.493
  391   2HG1  VAL  54          HG12      VAL  54  10.470  -3.481   2.800
  392   3HG1  VAL  54          HG13      VAL  54  10.624  -3.264   4.572
  393   1HG2  VAL  54          HG21      VAL  54  10.458  -1.557   1.252
  394   2HG2  VAL  54          HG22      VAL  54  12.131  -1.493   1.794
  395   3HG2  VAL  54          HG23      VAL  54  11.106  -0.060   1.893
  396    H    GLU  55           H        GLU  55   9.181   1.267   3.735
  397    HA   GLU  55           HA       GLU  55   9.897   1.813   6.366
  398   1HB   GLU  55          HB2       GLU  55   8.141   3.498   4.587
  399   2HB   GLU  55          HB1       GLU  55   9.117   4.070   5.925
  400   1HG   GLU  55          HG2       GLU  55  10.211   2.852   3.395
  401   2HG   GLU  55          HG1       GLU  55  10.062   4.578   3.701
  402    H    CYS  56           H        CYS  56   6.835   1.425   4.843
  403    HA   CYS  56           HA       CYS  56   5.411   1.774   7.466
  404   1HB   CYS  56          HB2       CYS  56   4.171   1.482   4.750
  405   2HB   CYS  56          HB1       CYS  56   3.421   2.134   6.201
  406    H    ASN  57           H        ASN  57   6.443  -0.505   5.274
  407    HA   ASN  57           HA       ASN  57   5.891  -2.422   4.446
  408   1HB   ASN  57          HB2       ASN  57   6.428  -2.938   6.950
  409   2HB   ASN  57          HB1       ASN  57   4.770  -3.469   6.997
  410   1HD2  ASN  57          HD21      ASN  57   7.635  -3.816   5.471
  411   2HD2  ASN  57          HD22      ASN  57   7.398  -5.446   4.930
  412    H    PHE  58           H        PHE  58   4.405  -1.239   3.293
  413    HA   PHE  58           HA       PHE  58   1.842  -2.444   3.718
  414   1HB   PHE  58          HB2       PHE  58   0.564  -0.542   3.806
  415   2HB   PHE  58          HB1       PHE  58   2.073   0.197   4.296
  416    HD1  PHE  58           HD1      PHE  58   3.238   1.701   2.773
  417    HD2  PHE  58           HD2      PHE  58  -0.380  -0.147   1.651
  418    HE1  PHE  58           HE1      PHE  58   2.992   3.342   0.878
  419    HE2  PHE  58           HE2      PHE  58  -0.648   1.517  -0.224
  420    HZ   PHE  58           HZ       PHE  58   1.067   3.215  -0.593
  421    H    LEU  59           H        LEU  59   1.061  -3.368   1.958
  422    HA   LEU  59           HA       LEU  59   2.557  -3.100  -0.507
  423   1HB   LEU  59          HB2       LEU  59   1.071  -5.230   0.809
  424   2HB   LEU  59          HB1       LEU  59   0.719  -5.121  -0.895
  425    HG   LEU  59           HG       LEU  59   3.481  -5.415   0.254
  426   1HD1  LEU  59          HD11      LEU  59   3.261  -7.739  -0.514
  427   2HD1  LEU  59          HD12      LEU  59   1.623  -7.372  -1.083
  428   3HD1  LEU  59          HD13      LEU  59   1.974  -7.356   0.639
  429   1HD2  LEU  59          HD21      LEU  59   4.054  -5.986  -2.080
  430   2HD2  LEU  59          HD22      LEU  59   3.463  -4.344  -1.937
  431   3HD2  LEU  59          HD23      LEU  59   2.411  -5.601  -2.575
  432    H    THR  60           H        THR  60   1.624  -2.182  -2.236
  433    HA   THR  60           HA       THR  60  -1.198  -1.525  -1.984
  434    HB   THR  60           HB       THR  60  -0.317   0.556  -1.791
  435    HG1  THR  60           HG1      THR  60  -1.620   0.825  -3.645
  436   1HG2  THR  60          HG21      THR  60   2.009  -0.091  -1.949
  437   2HG2  THR  60          HG22      THR  60   1.725   1.389  -2.853
  438   3HG2  THR  60          HG23      THR  60   1.889  -0.143  -3.706
  439    H    LYS  61           H        LYS  61  -2.379  -1.210  -3.837
  440    HA   LYS  61           HA       LYS  61  -2.403  -3.349  -5.661
  441   1HB   LYS  61          HB2       LYS  61  -4.333  -2.124  -4.791
  442   2HB   LYS  61          HB1       LYS  61  -3.773  -0.668  -5.578
  443   1HG   LYS  61          HG2       LYS  61  -4.083  -1.872  -7.764
  444   2HG   LYS  61          HG1       LYS  61  -4.908  -3.141  -6.853
  445   1HD   LYS  61          HD2       LYS  61  -6.412  -1.385  -5.907
  446   2HD   LYS  61          HD1       LYS  61  -5.653  -0.218  -6.989
  447   1HE   LYS  61          HE2       LYS  61  -7.665  -0.907  -8.025
  448   2HE   LYS  61          HE1       LYS  61  -6.353  -1.710  -8.887
  449   1HZ   LYS  61          HZ1       LYS  61  -6.814  -3.716  -7.556
  450   2HZ   LYS  61          HZ2       LYS  61  -8.138  -3.234  -8.476
  451   3HZ   LYS  61          HZ3       LYS  61  -8.101  -2.903  -6.820
  452    H    ARG  62           H        ARG  62  -0.954  -0.215  -5.662
  453    HA   ARG  62           HA       ARG  62  -0.346  -0.417  -8.530
  454   1HB   ARG  62          HB2       ARG  62  -0.693   1.971  -8.701
  455   2HB   ARG  62          HB1       ARG  62  -2.118   1.241  -7.989
  456   1HG   ARG  62          HG2       ARG  62  -1.163   1.882  -5.738
  457   2HG   ARG  62          HG1       ARG  62   0.014   2.842  -6.633
  458   1HD   ARG  62          HD2       ARG  62  -1.695   4.341  -6.081
  459   2HD   ARG  62          HD1       ARG  62  -1.979   3.923  -7.770
  460    HE   ARG  62           HE       ARG  62  -3.428   2.721  -5.507
  461   1HH1  ARG  62          HH11      ARG  62  -3.506   3.999  -8.850
  462   2HH1  ARG  62          HH12      ARG  62  -5.194   3.773  -8.964
  463   1HH2  ARG  62          HH21      ARG  62  -5.609   2.552  -5.699
  464   2HH2  ARG  62          HH22      ARG  62  -6.430   2.934  -7.160
  465    H    TYR  63           H        TYR  63   1.686   0.849  -9.062
  466    HA   TYR  63           HA       TYR  63   3.520   0.578  -6.828
  467   1HB   TYR  63          HB2       TYR  63   5.367   0.758  -8.515
  468   2HB   TYR  63          HB1       TYR  63   4.298  -0.604  -8.785
  469    HD1  TYR  63           HD1      TYR  63   3.132  -0.836 -10.816
  470    HD2  TYR  63           HD2      TYR  63   5.176   2.793  -9.986
  471    HE1  TYR  63           HE1      TYR  63   2.799  -0.125 -13.145
  472    HE2  TYR  63           HE2      TYR  63   4.849   3.519 -12.309
  473    HH   TYR  63           HH       TYR  63   2.687   1.936 -14.380
  474    H    ASP  64           H        ASP  64   1.853   2.919  -8.505
  475    HA   ASP  64           HA       ASP  64   3.740   5.038  -8.155
  476   1HB   ASP  64          HB2       ASP  64   1.919   6.554  -8.664
  477   2HB   ASP  64          HB1       ASP  64   2.188   5.337  -9.930
  478    H    ALA  65           H        ALA  65   1.395   3.710  -6.129
  479    HA   ALA  65           HA       ALA  65   1.018   5.825  -4.292
  480   1HB   ALA  65          HB1       ALA  65   0.462   4.029  -2.642
  481   2HB   ALA  65          HB2       ALA  65   0.961   2.838  -3.856
  482   3HB   ALA  65          HB3       ALA  65  -0.400   3.903  -4.162
  483    H    LEU  66           H        LEU  66   3.653   3.718  -4.796
  484    HA   LEU  66           HA       LEU  66   5.028   4.345  -2.341
  485   1HB   LEU  66          HB2       LEU  66   6.076   3.072  -4.833
  486   2HB   LEU  66          HB1       LEU  66   6.919   3.138  -3.302
  487    HG   LEU  66           HG       LEU  66   6.129   0.979  -3.397
  488   1HD1  LEU  66          HD11      LEU  66   4.417   0.760  -1.700
  489   2HD1  LEU  66          HD12      LEU  66   3.984   2.449  -1.941
  490   3HD1  LEU  66          HD13      LEU  66   5.576   2.037  -1.278
  491   1HD2  LEU  66          HD21      LEU  66   3.498   2.038  -4.362
  492   2HD2  LEU  66          HD22      LEU  66   3.891   0.336  -4.073
  493   3HD2  LEU  66          HD23      LEU  66   4.735   1.249  -5.334
  494    H    SER  67           H        SER  67   4.977   5.409  -5.611
  495    HA   SER  67           HA       SER  67   7.400   6.949  -5.589
  496   1HB   SER  67          HB2       SER  67   5.055   6.574  -7.294
  497   2HB   SER  67          HB1       SER  67   6.117   7.940  -7.647
  498    HG   SER  67           HG       SER  67   7.749   5.984  -7.414
  499    H    GLU  68           H        GLU  68   4.000   7.668  -5.349
  500    HA   GLU  68           HA       GLU  68   4.519  10.408  -4.784
  501   1HB   GLU  68          HB2       GLU  68   1.896   9.277  -4.004
  502   2HB   GLU  68          HB1       GLU  68   2.317  10.778  -4.812
  503   1HG   GLU  68          HG2       GLU  68   2.973   9.257  -6.802
  504   2HG   GLU  68          HG1       GLU  68   2.019   8.077  -5.974
  505    H    HIS  69           H        HIS  69   4.502   7.600  -3.045
  506    HA   HIS  69           HA       HIS  69   3.560   8.179  -0.518
  507   1HB   HIS  69          HB2       HIS  69   4.564   6.027  -1.431
  508   2HB   HIS  69          HB1       HIS  69   6.110   6.686  -0.848
  509    HD1  HIS  69           HD1      HIS  69   2.713   5.624   0.404
  510    HD2  HIS  69           HD2      HIS  69   6.566   6.303   1.693
  511    HE1  HIS  69           HE1      HIS  69   2.765   4.838   2.800
  512    H    ASN  70           H        ASN  70   7.016   8.619  -1.428
  513    HA   ASN  70           HA       ASN  70   7.614  10.151   0.918
  514   1HB   ASN  70          HB2       ASN  70   9.750  10.628  -0.259
  515   2HB   ASN  70          HB1       ASN  70   9.381   8.919  -0.100
  516   1HD2  ASN  70          HD21      ASN  70  11.151   9.996  -1.777
  517   2HD2  ASN  70          HD22      ASN  70  10.668   9.675  -3.430
  518    H    LEU  71           H        LEU  71   6.051  10.920  -1.845
  519    HA   LEU  71           HA       LEU  71   6.736  13.700  -1.849
  520   1HB   LEU  71          HB2       LEU  71   6.153  12.980  -3.970
  521   2HB   LEU  71          HB1       LEU  71   4.932  11.885  -3.378
  522    HG   LEU  71           HG       LEU  71   3.409  13.694  -3.053
  523   1HD1  LEU  71          HD11      LEU  71   5.034  15.527  -2.596
  524   2HD1  LEU  71          HD12      LEU  71   3.950  15.974  -3.911
  525   3HD1  LEU  71          HD13      LEU  71   5.596  15.444  -4.270
  526   1HD2  LEU  71          HD21      LEU  71   4.647  13.658  -5.797
  527   2HD2  LEU  71          HD22      LEU  71   3.031  14.255  -5.421
  528   3HD2  LEU  71          HD23      LEU  71   3.425  12.553  -5.174
  529    H    LYS  72           H        LYS  72   3.928  11.748  -0.891
  530    HA   LYS  72           HA       LYS  72   2.940  14.088   0.561
  531   1HB   LYS  72          HB2       LYS  72   0.784  12.412   0.463
  532   2HB   LYS  72          HB1       LYS  72   1.050  13.780  -0.625
  533   1HG   LYS  72          HG2       LYS  72   2.248  12.066  -2.090
  534   2HG   LYS  72          HG1       LYS  72   1.579  10.850  -1.050
  535   1HD   LYS  72          HD2       LYS  72  -0.024  12.847  -2.645
  536   2HD   LYS  72          HD1       LYS  72   0.137  11.117  -2.962
  537   1HE   LYS  72          HE2       LYS  72  -1.012  10.636  -0.794
  538   2HE   LYS  72          HE1       LYS  72  -1.139  12.363  -0.526
  539   1HZ   LYS  72          HZ1       LYS  72  -3.113  11.345  -1.310
  540   2HZ   LYS  72          HZ2       LYS  72  -2.364  10.874  -2.750
  541   3HZ   LYS  72          HZ3       LYS  72  -2.583  12.525  -2.406
  542    H    TYR  73           H        TYR  73   3.492  10.746   0.924
  543    HA   TYR  73           HA       TYR  73   2.349  10.555   3.593
  544   1HB   TYR  73          HB2       TYR  73   3.867   8.609   1.903
  545   2HB   TYR  73          HB1       TYR  73   3.196   8.183   3.483
  546    HD1  TYR  73           HD1      TYR  73   1.174   7.045   3.405
  547    HD2  TYR  73           HD2      TYR  73   2.120   9.721   0.256
  548    HE1  TYR  73           HE1      TYR  73  -0.906   6.447   2.244
  549    HE2  TYR  73           HE2      TYR  73   0.092   9.140  -0.880
  550    HH   TYR  73           HH       TYR  73  -2.384   7.723   0.620
  551    H    HIS  74           H        HIS  74   5.610  10.085   2.160
  552    HA   HIS  74           HA       HIS  74   6.724  10.830   4.806
  553   1HB   HIS  74          HB2       HIS  74   7.935   9.088   2.642
  554   2HB   HIS  74          HB1       HIS  74   8.796   9.555   4.106
  555    HD1  HIS  74           HD1      HIS  74   6.253   8.824   6.035
  556    HD2  HIS  74           HD2      HIS  74   7.980   6.450   3.098
  557    HE1  HIS  74           HE1      HIS  74   5.563   6.470   6.564
  558    HA   PRO  75           HA       PRO  75   7.738  14.002   1.541
  559   1HB   PRO  75          HB2       PRO  75   7.006  16.197   2.888
  560   2HB   PRO  75          HB1       PRO  75   5.816  15.180   2.061
  561   1HG   PRO  75          HG2       PRO  75   6.592  15.161   4.969
  562   2HG   PRO  75          HG1       PRO  75   4.961  15.169   4.255
  563   1HD   PRO  75          HD2       PRO  75   6.146  12.879   5.110
  564   2HD   PRO  75          HD1       PRO  75   5.064  12.945   3.705
  565    H    GLY  76           H        GLY  76   9.439  15.304   1.324
  566   1HA   GLY  76          HA2       GLY  76  10.885  16.796   2.965
  567   2HA   GLY  76          HA1       GLY  76  11.454  15.187   3.398
  568    H    GLU  77           H        GLU  77  11.372  13.958   0.905
  569    HA   GLU  77           HA       GLU  77  12.873  15.421  -1.016
  570   1HB   GLU  77          HB2       GLU  77  14.897  13.970  -0.830
  571   2HB   GLU  77          HB1       GLU  77  14.686  15.013   0.566
  572   1HG   GLU  77          HG2       GLU  77  15.080  13.131   1.745
  573   2HG   GLU  77          HG1       GLU  77  13.386  12.792   1.351
  574    H    GLU  78           H        GLU  78  13.632  13.659  -2.723
  575    HA   GLU  78           HA       GLU  78  11.616  11.537  -2.682
  576   1HB   GLU  78          HB2       GLU  78  10.905  13.439  -4.167
  577   2HB   GLU  78          HB1       GLU  78  12.389  13.108  -5.081
  578   1HG   GLU  78          HG2       GLU  78  11.601  10.873  -5.572
  579   2HG   GLU  78          HG1       GLU  78  10.112  11.174  -4.681
  580    H    ASN  79           H        ASN  79  13.200  10.067  -2.094
  581    HA   ASN  79           HA       ASN  79  14.871   9.091  -4.282
  582   1HB   ASN  79          HB2       ASN  79  15.813   9.811  -1.526
  583   2HB   ASN  79          HB1       ASN  79  16.805   8.884  -2.665
  584   1HD2  ASN  79          HD21      ASN  79  15.466  11.867  -1.818
  585   2HD2  ASN  79          HD22      ASN  79  16.263  12.932  -2.935
  586    H    PHE  80           H        PHE  80  13.503   7.323  -4.289
  587    HA   PHE  80           HA       PHE  80  13.471   5.630  -1.904
  588   1HB   PHE  80          HB2       PHE  80  11.589   6.167  -4.053
  589   2HB   PHE  80          HB1       PHE  80  11.856   4.453  -3.815
  590    HD1  PHE  80           HD1      PHE  80  10.011   7.274  -2.764
  591    HD2  PHE  80           HD2      PHE  80  11.629   3.622  -1.371
  592    HE1  PHE  80           HE1      PHE  80   8.326   7.212  -0.936
  593    HE2  PHE  80           HE2      PHE  80   9.958   3.544   0.412
  594    HZ   PHE  80           HZ       PHE  80   8.298   5.343   0.627
  595    H    LYS  81           H        LYS  81  14.198   3.545  -2.017
  596    HA   LYS  81           HA       LYS  81  15.870   2.859  -4.341
  597   1HB   LYS  81          HB2       LYS  81  17.428   1.968  -2.865
  598   2HB   LYS  81          HB1       LYS  81  16.636   3.130  -1.788
  599   1HG   LYS  81          HG2       LYS  81  15.297   1.459  -0.793
  600   2HG   LYS  81          HG1       LYS  81  15.792   0.270  -1.987
  601   1HD   LYS  81          HD2       LYS  81  18.154   0.651  -1.128
  602   2HD   LYS  81          HD1       LYS  81  17.356   1.458   0.241
  603   1HE   LYS  81          HE2       LYS  81  16.060  -0.540   0.696
  604   2HE   LYS  81          HE1       LYS  81  16.766  -1.329  -0.708
  605   1HZ   LYS  81          HZ1       LYS  81  18.311  -0.439   1.671
  606   2HZ   LYS  81          HZ2       LYS  81  18.905  -1.344   0.379
  607   3HZ   LYS  81          HZ3       LYS  81  17.763  -2.005   1.427
  608    H    LEU  82           H        LEU  82  15.974   0.359  -4.602
  609    HA   LEU  82           HA       LEU  82  13.330  -0.761  -4.077
  610   1HB   LEU  82          HB2       LEU  82  13.405  -1.923  -6.229
  611   2HB   LEU  82          HB1       LEU  82  13.416  -0.188  -6.436
  612    HG   LEU  82           HG       LEU  82  15.968  -1.782  -6.560
  613   1HD1  LEU  82          HD11      LEU  82  14.061  -1.136  -8.810
  614   2HD1  LEU  82          HD12      LEU  82  14.405  -2.745  -8.171
  615   3HD1  LEU  82          HD13      LEU  82  15.668  -1.836  -9.003
  616   1HD2  LEU  82          HD21      LEU  82  16.711   0.091  -7.959
  617   2HD2  LEU  82          HD22      LEU  82  16.170   0.658  -6.378
  618   3HD2  LEU  82          HD23      LEU  82  15.127   0.844  -7.787
  619    H    THR  83           H        THR  83  13.340  -2.711  -3.167
  620    HA   THR  83           HA       THR  83  15.642  -4.421  -3.471
  621    HB   THR  83           HB       THR  83  16.259  -3.219  -1.471
  622    HG1  THR  83           HG1      THR  83  16.188  -5.687  -1.428
  623   1HG2  THR  83          HG21      THR  83  14.868  -2.962   0.490
  624   2HG2  THR  83          HG22      THR  83  13.581  -3.866  -0.293
  625   3HG2  THR  83          HG23      THR  83  14.044  -2.278  -0.918
  626    H    MET  84           H        MET  84  14.628  -6.400  -4.164
  627    HA   MET  84           HA       MET  84  11.838  -6.693  -3.241
  628   1HB   MET  84          HB2       MET  84  12.448  -6.950  -5.701
  629   2HB   MET  84          HB1       MET  84  13.352  -8.376  -5.233
  630   1HG   MET  84          HG2       MET  84  10.389  -8.062  -4.781
  631   2HG   MET  84          HG1       MET  84  11.071  -8.789  -6.220
  632   1HE   MET  84          HE1       MET  84  13.447 -10.572  -5.132
  633   2HE   MET  84          HE2       MET  84  12.235 -11.192  -6.255
  634   3HE   MET  84          HE3       MET  84  12.631 -12.098  -4.797
  635    H    VAL  85           H        VAL  85  11.894  -7.494  -1.295
  636    HA   VAL  85           HA       VAL  85  12.709 -10.227  -1.099
  637    HB   VAL  85           HB       VAL  85  13.597  -9.589   1.350
  638   1HG1  VAL  85          HG11      VAL  85  15.905  -9.481   0.473
  639   2HG1  VAL  85          HG12      VAL  85  15.260  -9.182  -1.143
  640   3HG1  VAL  85          HG13      VAL  85  14.962 -10.726  -0.349
  641   1HG2  VAL  85          HG21      VAL  85  13.118  -7.179   1.111
  642   2HG2  VAL  85          HG22      VAL  85  14.240  -7.095  -0.241
  643   3HG2  VAL  85          HG23      VAL  85  14.842  -7.466   1.374
  644    H    LYS  86           H        LYS  86  10.633 -11.002  -0.669
  645    HA   LYS  86           HA       LYS  86   9.502  -9.798   1.708
  646   1HB   LYS  86          HB2       LYS  86   8.385  -8.913  -0.437
  647   2HB   LYS  86          HB1       LYS  86   7.689 -10.533  -0.552
  648   1HG   LYS  86          HG2       LYS  86   6.084  -9.213   0.379
  649   2HG   LYS  86          HG1       LYS  86   6.712 -10.175   1.714
  650   1HD   LYS  86          HD2       LYS  86   7.996  -8.352   2.580
  651   2HD   LYS  86          HD1       LYS  86   7.806  -7.407   1.117
  652   1HE   LYS  86          HE2       LYS  86   6.326  -6.339   2.602
  653   2HE   LYS  86          HE1       LYS  86   5.324  -7.432   1.684
  654   1HZ   LYS  86          HZ1       LYS  86   6.394  -8.064   4.392
  655   2HZ   LYS  86          HZ2       LYS  86   5.313  -9.013   3.534
  656   3HZ   LYS  86          HZ3       LYS  86   4.847  -7.512   4.087
  657    H    ARG  87           H        ARG  87   9.188 -11.270   3.085
  658    HA   ARG  87           HA       ARG  87   9.021 -13.996   2.112
  659   1HB   ARG  87          HB2       ARG  87  10.306 -12.963   4.655
  660   2HB   ARG  87          HB1       ARG  87  10.216 -14.649   4.167
  661   1HG   ARG  87          HG2       ARG  87  12.422 -14.032   3.580
  662   2HG   ARG  87          HG1       ARG  87  11.518 -13.906   2.069
  663   1HD   ARG  87          HD2       ARG  87  12.941 -11.975   2.210
  664   2HD   ARG  87          HD1       ARG  87  11.285 -11.459   2.458
  665    HE   ARG  87           HE       ARG  87  12.697 -12.025   4.887
  666   1HH1  ARG  87          HH11      ARG  87  11.852  -9.372   2.591
  667   2HH1  ARG  87          HH12      ARG  87  12.275  -8.163   3.672
  668   1HH2  ARG  87          HH21      ARG  87  13.309 -10.246   6.313
  669   2HH2  ARG  87          HH22      ARG  87  13.121  -8.637   5.797
  670    H    ASN  88           H        ASN  88   7.755 -15.420   3.423
  671    HA   ASN  88           HA       ASN  88   5.954 -16.080   4.585
  672   1HB   ASN  88          HB2       ASN  88   6.267 -13.463   6.092
  673   2HB   ASN  88          HB1       ASN  88   5.086 -14.685   6.513
  674   1HD2  ASN  88          HD21      ASN  88   5.887 -15.102   8.504
  675   2HD2  ASN  88          HD22      ASN  88   7.404 -15.856   8.809
  676    H    ASN  89           H        ASN  89   5.810 -14.104   2.229
  677    HA   ASN  89           HA       ASN  89   2.904 -13.773   2.336
  678   1HB   ASN  89          HB2       ASN  89   4.806 -11.527   1.576
  679   2HB   ASN  89          HB1       ASN  89   3.083 -11.495   1.275
  680   1HD2  ASN  89          HD21      ASN  89   5.628 -11.173   3.634
  681   2HD2  ASN  89          HD22      ASN  89   4.618 -10.562   4.889
  682    H    GLN  90           H        GLN  90   5.087 -12.321   0.005
  683    HA   GLN  90           HA       GLN  90   5.128 -14.413  -1.878
  684   1HB   GLN  90          HB2       GLN  90   4.028 -13.251  -3.659
  685   2HB   GLN  90          HB1       GLN  90   2.866 -13.354  -2.317
  686   1HG   GLN  90          HG2       GLN  90   4.505 -10.953  -2.970
  687   2HG   GLN  90          HG1       GLN  90   2.922 -11.231  -3.701
  688   1HE2  GLN  90          HE21      GLN  90   4.693 -10.322  -0.935
  689   2HE2  GLN  90          HE22      GLN  90   3.306  -9.812   0.000
  690    H    THR  91           H        THR  91   6.476 -13.419  -3.785
  691    HA   THR  91           HA       THR  91   8.308 -11.618  -2.453
  692    HB   THR  91           HB       THR  91   9.813 -12.154  -4.416
  693    HG1  THR  91           HG1      THR  91   7.889 -12.949  -5.634
  694   1HG2  THR  91          HG21      THR  91   8.887 -14.446  -2.657
  695   2HG2  THR  91          HG22      THR  91  10.092 -13.253  -2.209
  696   3HG2  THR  91          HG23      THR  91  10.418 -14.384  -3.519
  697    H    ILE  92           H        ILE  92   8.089  -9.635  -2.695
  698    HA   ILE  92           HA       ILE  92   7.254  -8.420  -5.134
  699    HB   ILE  92           HB       ILE  92   5.874  -6.797  -3.724
  700   1HG1  ILE  92          HG12      ILE  92   4.733  -8.138  -1.792
  701   2HG1  ILE  92          HG11      ILE  92   6.263  -8.987  -1.818
  702   1HG2  ILE  92          HG21      ILE  92   3.854  -8.284  -3.783
  703   2HG2  ILE  92          HG22      ILE  92   4.944  -9.590  -4.285
  704   3HG2  ILE  92          HG23      ILE  92   4.765  -8.157  -5.281
  705   1HD1  ILE  92          HD11      ILE  92   6.241  -7.118  -0.226
  706   2HD1  ILE  92          HD12      ILE  92   6.079  -6.010  -1.591
  707   3HD1  ILE  92          HD13      ILE  92   7.510  -7.022  -1.435
  708    H    PHE  93           H        PHE  93   7.681  -6.024  -5.095
  709    HA   PHE  93           HA       PHE  93  10.474  -5.864  -4.288
  710   1HB   PHE  93          HB2       PHE  93   8.704  -4.058  -5.926
  711   2HB   PHE  93          HB1       PHE  93  10.419  -3.815  -5.700
  712    HD1  PHE  93           HD1      PHE  93   7.823  -5.720  -7.404
  713    HD2  PHE  93           HD2      PHE  93  11.991  -5.215  -6.834
  714    HE1  PHE  93           HE1      PHE  93   8.240  -7.036  -9.445
  715    HE2  PHE  93           HE2      PHE  93  12.438  -6.539  -8.888
  716    HZ   PHE  93           HZ       PHE  93  10.552  -7.443 -10.189
  717    H    GLU  94           H        GLU  94  10.991  -4.779  -2.445
  718    HA   GLU  94           HA       GLU  94   8.986  -3.128  -1.228
  719   1HB   GLU  94          HB2       GLU  94  11.684  -3.922  -0.103
  720   2HB   GLU  94          HB1       GLU  94  10.277  -3.321   0.750
  721   1HG   GLU  94          HG2       GLU  94   9.123  -5.422   0.018
  722   2HG   GLU  94          HG1       GLU  94  10.722  -6.065  -0.349
  723    H    GLN  95           H        GLN  95   9.407  -0.998  -0.844
  724    HA   GLN  95           HA       GLN  95  11.754   0.099  -2.233
  725   1HB   GLN  95          HB2       GLN  95   9.323   0.283  -3.236
  726   2HB   GLN  95          HB1       GLN  95   9.118   1.530  -2.019
  727   1HG   GLN  95          HG2       GLN  95  10.955   2.786  -2.951
  728   2HG   GLN  95          HG1       GLN  95  11.281   1.503  -4.107
  729   1HE2  GLN  95          HE21      GLN  95   9.188   4.129  -3.256
  730   2HE2  GLN  95          HE22      GLN  95   8.395   4.202  -4.791
  731    H    THR  96           H        THR  96  13.103   0.969  -0.719
  732    HA   THR  96           HA       THR  96  11.940   2.171   1.714
  733    HB   THR  96           HB       THR  96  14.755   1.795   1.952
  734    HG1  THR  96           HG1      THR  96  14.308  -0.703   1.910
  735   1HG2  THR  96          HG21      THR  96  14.112   0.396   3.883
  736   2HG2  THR  96          HG22      THR  96  12.463   0.332   3.290
  737   3HG2  THR  96          HG23      THR  96  13.127   1.861   3.830
  738    H    ILE  97           H        ILE  97  13.140   3.995   2.547
  739    HA   ILE  97           HA       ILE  97  14.169   5.722   0.380
  740    HB   ILE  97           HB       ILE  97  13.274   6.631   3.141
  741   1HG1  ILE  97          HG12      ILE  97  11.535   6.580   0.712
  742   2HG1  ILE  97          HG11      ILE  97  11.598   5.174   1.757
  743   1HG2  ILE  97          HG21      ILE  97  14.568   8.112   1.517
  744   2HG2  ILE  97          HG22      ILE  97  13.012   8.723   2.015
  745   3HG2  ILE  97          HG23      ILE  97  13.191   7.971   0.417
  746   1HD1  ILE  97          HD11      ILE  97  10.487   7.915   2.293
  747   2HD1  ILE  97          HD12      ILE  97  10.907   6.790   3.607
  748   3HD1  ILE  97          HD13      ILE  97   9.733   6.321   2.397
  749    H    ASN  98           H        ASN  98  15.943   7.019   0.844
  750    HA   ASN  98           HA       ASN  98  17.864   5.709   2.603
  751   1HB   ASN  98          HB2       ASN  98  19.484   7.235   1.339
  752   2HB   ASN  98          HB1       ASN  98  18.719   5.957   0.392
  753   1HD2  ASN  98          HD21      ASN  98  17.207   9.036   1.362
  754   2HD2  ASN  98          HD22      ASN  98  17.034   9.638  -0.208
  755    H    ASP  99           H        ASP  99  15.628   7.868   3.176
  756    HA   ASP  99           HA       ASP  99  17.298   9.586   4.883
  757   1HB   ASP  99          HB2       ASP  99  17.161  10.531   2.564
  758   2HB   ASP  99          HB1       ASP  99  15.463  10.763   2.850
  759    H    LEU 100           H        LEU 100  14.055   9.303   3.490
  760    HA   LEU 100           HA       LEU 100  12.718  10.564   5.693
  761   1HB   LEU 100          HB2       LEU 100  11.491   9.047   3.368
  762   2HB   LEU 100          HB1       LEU 100  10.777  10.260   4.393
  763    HG   LEU 100           HG       LEU 100  13.152  11.105   2.823
  764   1HD1  LEU 100          HD11      LEU 100  11.861   9.885   1.136
  765   2HD1  LEU 100          HD12      LEU 100  11.722  11.603   0.903
  766   3HD1  LEU 100          HD13      LEU 100  10.399  10.712   1.675
  767   1HD2  LEU 100          HD21      LEU 100  11.946  13.146   2.741
  768   2HD2  LEU 100          HD22      LEU 100  11.922  12.558   4.414
  769   3HD2  LEU 100          HD23      LEU 100  10.510  12.369   3.359
  770    H    THR 101           H        THR 101  14.129   7.833   5.648
  771    HA   THR 101           HA       THR 101  12.316   5.872   6.479
  772    HB   THR 101           HB       THR 101  15.290   6.158   6.881
  773    HG1  THR 101           HG1      THR 101  13.848   4.995   4.746
  774   1HG2  THR 101          HG21      THR 101  13.570   3.692   6.555
  775   2HG2  THR 101          HG22      THR 101  14.289   4.216   8.085
  776   3HG2  THR 101          HG23      THR 101  15.316   3.711   6.737
  777    H    PHE 102           H        PHE 102  13.938   8.546   7.895
  778    HA   PHE 102           HA       PHE 102  13.538   7.567  10.644
  779   1HB   PHE 102          HB2       PHE 102  15.485   9.654   9.633
  780   2HB   PHE 102          HB1       PHE 102  15.289   9.171  11.314
  781    HD1  PHE 102           HD1      PHE 102  16.010   6.916  12.025
  782    HD2  PHE 102           HD2      PHE 102  16.746   8.371   8.091
  783    HE1  PHE 102           HE1      PHE 102  17.703   5.172  11.701
  784    HE2  PHE 102           HE2      PHE 102  18.443   6.625   7.758
  785    HZ   PHE 102           HZ       PHE 102  18.926   5.019   9.565
  Start of MODEL    8
    1    HA   MET   1           HA       MET   1  -7.533  13.447  -4.118
    2   1HB   MET   1          HB2       MET   1  -9.955  14.872  -2.957
    3   2HB   MET   1          HB1       MET   1  -8.283  15.362  -2.731
    4   1HG   MET   1          HG2       MET   1  -9.795  15.337  -5.342
    5   2HG   MET   1          HG1       MET   1  -9.413  16.759  -4.376
    6   1HE   MET   1          HE1       MET   1  -7.055  17.805  -4.131
    7   2HE   MET   1          HE2       MET   1  -5.568  17.066  -4.734
    8   3HE   MET   1          HE3       MET   1  -6.467  16.297  -3.428
    9    H    ALA   2           H        ALA   2  -7.059  13.743  -1.597
   10    HA   ALA   2           HA       ALA   2  -7.821  11.178  -0.510
   11   1HB   ALA   2          HB1       ALA   2  -5.441  11.809  -0.565
   12   2HB   ALA   2          HB2       ALA   2  -6.014  11.507   1.074
   13   3HB   ALA   2          HB3       ALA   2  -5.784  13.158   0.519
   14    H    HIS   3           H        HIS   3  -9.780  11.313   0.330
   15    HA   HIS   3           HA       HIS   3 -10.257  12.294   2.847
   16   1HB   HIS   3          HB2       HIS   3 -11.829  14.191   2.520
   17   2HB   HIS   3          HB1       HIS   3 -10.218  14.606   1.975
   18    HD1  HIS   3           HD1      HIS   3 -13.369  15.544   1.112
   19    HD2  HIS   3           HD2      HIS   3 -10.378  13.744  -1.124
   20    HE1  HIS   3           HE1      HIS   3 -13.863  16.109  -1.297
   21    H    HIS   4           H        HIS   4 -11.748  10.906   3.577
   22    HA   HIS   4           HA       HIS   4 -13.501   9.885   1.533
   23   1HB   HIS   4          HB2       HIS   4 -14.044   7.971   2.897
   24   2HB   HIS   4          HB1       HIS   4 -12.313   8.186   2.984
   25    HD1  HIS   4           HD1      HIS   4 -11.327   8.330   5.365
   26    HD2  HIS   4           HD2      HIS   4 -15.470   8.574   5.265
   27    HE1  HIS   4           HE1      HIS   4 -12.107   8.102   7.751
   28    H    HIS   5           H        HIS   5 -15.032  11.100   1.139
   29    HA   HIS   5           HA       HIS   5 -16.656  12.172   3.326
   30   1HB   HIS   5          HB2       HIS   5 -17.662  13.681   1.568
   31   2HB   HIS   5          HB1       HIS   5 -15.935  13.910   1.791
   32    HD1  HIS   5           HD1      HIS   5 -18.457  13.064  -0.776
   33    HD2  HIS   5           HD2      HIS   5 -14.341  12.917  -0.325
   34    HE1  HIS   5           HE1      HIS   5 -17.526  12.729  -3.078
   35    H    HIS   6           H        HIS   6 -16.455   9.495   1.967
   36    HA   HIS   6           HA       HIS   6 -19.307   9.069   1.581
   37   1HB   HIS   6          HB2       HIS   6 -18.729   7.268  -0.088
   38   2HB   HIS   6          HB1       HIS   6 -18.349   8.888  -0.631
   39    HD1  HIS   6           HD1      HIS   6 -16.012   9.210  -1.530
   40    HD2  HIS   6           HD2      HIS   6 -16.359   5.756   0.747
   41    HE1  HIS   6           HE1      HIS   6 -13.794   8.013  -1.715
   42    H    HIS   7           H        HIS   7 -20.137   7.452   2.691
   43    HA   HIS   7           HA       HIS   7 -20.408   5.979   4.366
   44   1HB   HIS   7          HB2       HIS   7 -17.994   4.630   3.105
   45   2HB   HIS   7          HB1       HIS   7 -19.119   3.865   4.214
   46    HD1  HIS   7           HD1      HIS   7 -21.231   2.853   3.151
   47    HD2  HIS   7           HD2      HIS   7 -18.997   5.177   0.530
   48    HE1  HIS   7           HE1      HIS   7 -22.179   2.431   0.858
   49    H    HIS   8           H        HIS   8 -17.217   4.895   4.703
   50    HA   HIS   8           HA       HIS   8 -16.192   6.747   6.587
   51   1HB   HIS   8          HB2       HIS   8 -16.290   5.255   8.582
   52   2HB   HIS   8          HB1       HIS   8 -17.901   5.716   8.060
   53    HD1  HIS   8           HD1      HIS   8 -15.662   2.714   8.478
   54    HD2  HIS   8           HD2      HIS   8 -19.468   3.610   7.049
   55    HE1  HIS   8           HE1      HIS   8 -16.849   0.526   8.229
   56    H    ASN   9           H        ASN   9 -15.515   5.310   4.143
   57    HA   ASN   9           HA       ASN   9 -13.330   3.563   5.061
   58   1HB   ASN   9          HB2       ASN   9 -15.158   3.043   2.694
   59   2HB   ASN   9          HB1       ASN   9 -13.832   2.029   3.219
   60   1HD2  ASN   9          HD21      ASN   9 -14.189   0.589   4.948
   61   2HD2  ASN   9          HD22      ASN   9 -15.768   0.289   5.570
   62    H    GLN  10           H        GLN  10 -11.436   3.900   3.777
   63    HA   GLN  10           HA       GLN  10 -11.565   6.021   1.806
   64   1HB   GLN  10          HB2       GLN  10  -9.297   4.103   2.372
   65   2HB   GLN  10          HB1       GLN  10  -9.165   5.623   1.508
   66   1HG   GLN  10          HG2       GLN  10  -9.692   5.255   4.451
   67   2HG   GLN  10          HG1       GLN  10  -8.155   5.682   3.724
   68   1HE2  GLN  10          HE21      GLN  10  -9.580   7.565   1.803
   69   2HE2  GLN  10          HE22      GLN  10  -9.935   8.910   2.786
   70    H    GLN  11           H        GLN  11 -12.765   5.291   0.130
   71    HA   GLN  11           HA       GLN  11 -12.230   2.585  -0.890
   72   1HB   GLN  11          HB2       GLN  11 -14.380   2.922   0.269
   73   2HB   GLN  11          HB1       GLN  11 -14.798   4.184  -0.869
   74   1HG   GLN  11          HG2       GLN  11 -14.926   2.554  -2.667
   75   2HG   GLN  11          HG1       GLN  11 -14.383   1.281  -1.575
   76   1HE2  GLN  11          HE21      GLN  11 -15.957   2.220   0.646
   77   2HE2  GLN  11          HE22      GLN  11 -17.601   1.817   0.306
   78    H    ASN  12           H        ASN  12 -11.008   5.221  -1.669
   79    HA   ASN  12           HA       ASN  12 -12.083   5.700  -4.286
   80   1HB   ASN  12          HB2       ASN  12  -9.682   6.851  -2.882
   81   2HB   ASN  12          HB1       ASN  12  -9.977   7.161  -4.589
   82   1HD2  ASN  12          HD21      ASN  12 -10.914   7.889  -1.347
   83   2HD2  ASN  12          HD22      ASN  12 -12.072   9.088  -1.755
   84    H    LYS  13           H        LYS  13 -10.519   5.768  -6.201
   85    HA   LYS  13           HA       LYS  13  -9.661   3.013  -6.540
   86   1HB   LYS  13          HB2       LYS  13  -9.708   5.299  -8.500
   87   2HB   LYS  13          HB1       LYS  13  -9.416   3.617  -8.895
   88   1HG   LYS  13          HG2       LYS  13 -11.680   3.035  -8.241
   89   2HG   LYS  13          HG1       LYS  13 -11.995   4.705  -7.773
   90   1HD   LYS  13          HD2       LYS  13 -11.277   3.774 -10.558
   91   2HD   LYS  13          HD1       LYS  13 -12.905   4.165 -10.002
   92   1HE   LYS  13          HE2       LYS  13 -12.193   6.472  -9.558
   93   2HE   LYS  13          HE1       LYS  13 -10.568   6.082 -10.108
   94   1HZ   LYS  13          HZ1       LYS  13 -13.017   5.956 -11.775
   95   2HZ   LYS  13          HZ2       LYS  13 -11.454   5.611 -12.296
   96   3HZ   LYS  13          HZ3       LYS  13 -11.847   7.179 -11.824
   97    H    LYS  14           H        LYS  14  -8.318   5.944  -5.702
   98    HA   LYS  14           HA       LYS  14  -5.641   5.040  -6.463
   99   1HB   LYS  14          HB2       LYS  14  -6.335   7.023  -7.757
  100   2HB   LYS  14          HB1       LYS  14  -6.662   7.882  -6.265
  101   1HG   LYS  14          HG2       LYS  14  -4.559   8.628  -7.176
  102   2HG   LYS  14          HG1       LYS  14  -4.255   7.727  -5.692
  103   1HD   LYS  14          HD2       LYS  14  -3.722   5.731  -7.075
  104   2HD   LYS  14          HD1       LYS  14  -3.935   6.724  -8.519
  105   1HE   LYS  14          HE2       LYS  14  -1.910   7.164  -6.330
  106   2HE   LYS  14          HE1       LYS  14  -1.577   6.502  -7.925
  107   1HZ   LYS  14          HZ1       LYS  14  -1.020   8.876  -7.705
  108   2HZ   LYS  14          HZ2       LYS  14  -2.619   9.239  -7.397
  109   3HZ   LYS  14          HZ3       LYS  14  -2.178   8.624  -8.905
  110    H    VAL  15           H        VAL  15  -4.081   5.298  -4.927
  111    HA   VAL  15           HA       VAL  15  -4.703   5.010  -2.259
  112    HB   VAL  15           HB       VAL  15  -2.578   4.507  -3.669
  113   1HG1  VAL  15          HG11      VAL  15  -0.688   6.013  -3.356
  114   2HG1  VAL  15          HG12      VAL  15  -1.806   7.197  -2.672
  115   3HG1  VAL  15          HG13      VAL  15  -1.992   6.686  -4.352
  116   1HG2  VAL  15          HG21      VAL  15  -2.813   3.777  -1.385
  117   2HG2  VAL  15          HG22      VAL  15  -2.302   5.366  -0.810
  118   3HG2  VAL  15          HG23      VAL  15  -1.164   4.337  -1.672
  119    H    GLU  16           H        GLU  16  -5.127   6.539  -0.619
  120    HA   GLU  16           HA       GLU  16  -5.126   9.345  -1.466
  121   1HB   GLU  16          HB2       GLU  16  -6.508   8.032   0.854
  122   2HB   GLU  16          HB1       GLU  16  -6.728   9.691   0.327
  123   1HG   GLU  16          HG2       GLU  16  -7.569   8.800  -1.829
  124   2HG   GLU  16          HG1       GLU  16  -7.410   7.192  -1.088
  125    H    GLY  17           H        GLY  17  -4.889   7.974   1.764
  126   1HA   GLY  17          HA2       GLY  17  -2.239   9.133   2.074
  127   2HA   GLY  17          HA1       GLY  17  -3.545   9.901   2.979
  128    H    GLY  18           H        GLY  18  -3.796   6.633   2.385
  129   1HA   GLY  18          HA2       GLY  18  -2.705   6.013   5.045
  130   2HA   GLY  18          HA1       GLY  18  -4.293   5.414   4.565
  131    H    TYR  19           H        TYR  19  -3.750   3.254   4.757
  132    HA   TYR  19           HA       TYR  19  -1.732   2.205   2.839
  133   1HB   TYR  19          HB2       TYR  19  -2.788   0.846   5.273
  134   2HB   TYR  19          HB1       TYR  19  -1.311   0.477   4.378
  135    HD1  TYR  19           HD1      TYR  19  -2.504   1.772   7.332
  136    HD2  TYR  19           HD2      TYR  19   0.371   2.639   4.321
  137    HE1  TYR  19           HE1      TYR  19  -1.375   3.188   8.879
  138    HE2  TYR  19           HE2      TYR  19   1.575   4.092   5.884
  139    HH   TYR  19           HH       TYR  19   1.028   5.411   7.869
  140    H    GLU  20           H        GLU  20  -2.484   1.524   1.203
  141    HA   GLU  20           HA       GLU  20  -5.118   0.302   1.162
  142   1HB   GLU  20          HB2       GLU  20  -4.544   1.911  -0.633
  143   2HB   GLU  20          HB1       GLU  20  -3.135   0.947  -1.038
  144   1HG   GLU  20          HG2       GLU  20  -4.875  -0.968  -1.372
  145   2HG   GLU  20          HG1       GLU  20  -6.021   0.361  -1.522
  146    H    CYS  21           H        CYS  21  -5.238  -1.753   0.728
  147    HA   CYS  21           HA       CYS  21  -2.854  -3.451   0.804
  148   1HB   CYS  21          HB2       CYS  21  -5.721  -4.262   0.443
  149   2HB   CYS  21          HB1       CYS  21  -4.371  -5.338   0.764
  150    H    LYS  22           H        LYS  22  -2.002  -4.331  -0.935
  151    HA   LYS  22           HA       LYS  22  -2.637  -3.837  -3.608
  152   1HB   LYS  22          HB2       LYS  22  -0.416  -4.445  -2.885
  153   2HB   LYS  22          HB1       LYS  22  -0.978  -5.963  -2.228
  154   1HG   LYS  22          HG2       LYS  22  -1.110  -5.444  -5.173
  155   2HG   LYS  22          HG1       LYS  22   0.422  -5.884  -4.422
  156   1HD   LYS  22          HD2       LYS  22  -2.072  -7.432  -4.003
  157   2HD   LYS  22          HD1       LYS  22  -1.005  -7.788  -5.387
  158   1HE   LYS  22          HE2       LYS  22  -0.278  -7.906  -2.438
  159   2HE   LYS  22          HE1       LYS  22  -0.688  -9.307  -3.415
  160   1HZ   LYS  22          HZ1       LYS  22   1.677  -7.548  -3.668
  161   2HZ   LYS  22          HZ2       LYS  22   1.234  -8.649  -4.835
  162   3HZ   LYS  22          HZ3       LYS  22   1.618  -9.204  -3.261
  163    H    TYR  23           H        TYR  23  -4.171  -5.834  -1.435
  164    HA   TYR  23           HA       TYR  23  -5.347  -7.530  -3.484
  165   1HB   TYR  23          HB2       TYR  23  -5.676  -9.023  -1.235
  166   2HB   TYR  23          HB1       TYR  23  -4.342  -9.197  -2.366
  167    HD1  TYR  23           HD1      TYR  23  -5.282  -8.171   1.007
  168    HD2  TYR  23           HD2      TYR  23  -2.152  -8.223  -1.843
  169    HE1  TYR  23           HE1      TYR  23  -3.646  -7.691   2.784
  170    HE2  TYR  23           HE2      TYR  23  -0.510  -7.747  -0.085
  171    HH   TYR  23           HH       TYR  23  -1.204  -8.001   3.185
  172    H    CYS  24           H        CYS  24  -6.137  -4.913  -1.809
  173    HA   CYS  24           HA       CYS  24  -8.854  -5.437  -2.260
  174   1HB   CYS  24          HB2       CYS  24  -9.781  -5.103  -0.012
  175   2HB   CYS  24          HB1       CYS  24  -8.653  -6.451  -0.027
  176    H    THR  25           H        THR  25  -9.777  -3.636  -2.976
  177    HA   THR  25           HA       THR  25  -8.166  -1.255  -2.785
  178    HB   THR  25           HB       THR  25 -10.759  -1.678  -4.318
  179    HG1  THR  25           HG1      THR  25  -8.723  -2.905  -4.799
  180   1HG2  THR  25          HG21      THR  25 -10.048   0.324  -5.590
  181   2HG2  THR  25          HG22      THR  25  -8.639   0.491  -4.540
  182   3HG2  THR  25          HG23      THR  25 -10.259   0.704  -3.882
  183    H    PHE  26           H        PHE  26  -8.430  -1.278  -0.624
  184    HA   PHE  26           HA       PHE  26 -10.438   0.496   0.351
  185   1HB   PHE  26          HB2       PHE  26 -11.534  -1.571   0.909
  186   2HB   PHE  26          HB1       PHE  26 -10.017  -2.313   1.399
  187    HD1  PHE  26           HD1      PHE  26 -12.016   0.726   2.296
  188    HD2  PHE  26           HD2      PHE  26  -9.741  -2.608   3.625
  189    HE1  PHE  26           HE1      PHE  26 -12.423   1.379   4.639
  190    HE2  PHE  26           HE2      PHE  26 -10.142  -1.971   5.940
  191    HZ   PHE  26           HZ       PHE  26 -11.485   0.031   6.464
  192    H    GLN  27           H        GLN  27  -9.420   1.840   1.635
  193    HA   GLN  27           HA       GLN  27  -6.741   1.093   2.501
  194   1HB   GLN  27          HB2       GLN  27  -6.456   2.552   0.704
  195   2HB   GLN  27          HB1       GLN  27  -7.745   3.621   1.222
  196   1HG   GLN  27          HG2       GLN  27  -6.396   4.370   3.076
  197   2HG   GLN  27          HG1       GLN  27  -5.173   3.169   2.650
  198   1HE2  GLN  27          HE21      GLN  27  -3.885   3.551   1.155
  199   2HE2  GLN  27          HE22      GLN  27  -3.676   5.002   0.236
  200    H    THR  28           H        THR  28  -6.032   1.883   4.465
  201    HA   THR  28           HA       THR  28  -7.707   3.713   5.853
  202    HB   THR  28           HB       THR  28  -8.611   1.604   6.695
  203    HG1  THR  28           HG1      THR  28  -8.496   3.150   8.283
  204   1HG2  THR  28          HG21      THR  28  -6.678   0.138   6.219
  205   2HG2  THR  28          HG22      THR  28  -7.199  -0.029   7.895
  206   3HG2  THR  28          HG23      THR  28  -5.778   0.923   7.512
  207    HA   PRO  29           HA       PRO  29  -3.543   5.172   6.704
  208   1HB   PRO  29          HB2       PRO  29  -4.332   7.336   8.191
  209   2HB   PRO  29          HB1       PRO  29  -4.296   7.293   6.420
  210   1HG   PRO  29          HG2       PRO  29  -6.616   6.899   8.260
  211   2HG   PRO  29          HG1       PRO  29  -6.524   7.827   6.752
  212   1HD   PRO  29          HD2       PRO  29  -7.619   5.370   6.830
  213   2HD   PRO  29          HD1       PRO  29  -6.676   5.911   5.424
  214    H    ASP  30           H        ASP  30  -5.763   3.833   8.794
  215    HA   ASP  30           HA       ASP  30  -4.118   4.183  11.164
  216   1HB   ASP  30          HB2       ASP  30  -6.677   2.628  10.705
  217   2HB   ASP  30          HB1       ASP  30  -5.812   2.685  12.230
  218    H    LEU  31           H        LEU  31  -2.297   3.030  10.995
  219    HA   LEU  31           HA       LEU  31  -1.786   0.784   9.547
  220   1HB   LEU  31          HB2       LEU  31  -0.307   2.348  11.013
  221   2HB   LEU  31          HB1       LEU  31  -0.599   1.170  12.274
  222    HG   LEU  31           HG       LEU  31   1.558   0.715  11.313
  223   1HD1  LEU  31          HD11      LEU  31   0.304  -1.282  11.841
  224   2HD1  LEU  31          HD12      LEU  31   1.302  -1.544  10.393
  225   3HD1  LEU  31          HD13      LEU  31  -0.431  -1.202  10.239
  226   1HD2  LEU  31          HD21      LEU  31   1.880   0.275   8.935
  227   2HD2  LEU  31          HD22      LEU  31   1.229   1.900   9.248
  228   3HD2  LEU  31          HD23      LEU  31   0.164   0.630   8.678
  229    H    ASN  32           H        ASN  32  -2.997   1.044  12.889
  230    HA   ASN  32           HA       ASN  32  -3.005  -1.608  13.629
  231   1HB   ASN  32          HB2       ASN  32  -3.600   0.394  15.101
  232   2HB   ASN  32          HB1       ASN  32  -5.144   0.343  14.221
  233   1HD2  ASN  32          HD21      ASN  32  -3.815  -2.706  14.870
  234   2HD2  ASN  32          HD22      ASN  32  -4.898  -3.034  16.167
  235    H    MET  33           H        MET  33  -5.478   0.254  11.963
  236    HA   MET  33           HA       MET  33  -7.266  -1.926  11.884
  237   1HB   MET  33          HB2       MET  33  -7.294   0.588  10.207
  238   2HB   MET  33          HB1       MET  33  -8.621  -0.550  10.369
  239   1HG   MET  33          HG2       MET  33  -7.400   1.066  12.523
  240   2HG   MET  33          HG1       MET  33  -8.931   1.442  11.726
  241   1HE   MET  33          HE1       MET  33 -10.082  -1.645  11.452
  242   2HE   MET  33          HE2       MET  33 -11.082  -0.256  11.879
  243   3HE   MET  33          HE3       MET  33 -11.109  -1.706  12.883
  244    H    PHE  34           H        PHE  34  -4.867  -0.552   9.766
  245    HA   PHE  34           HA       PHE  34  -5.456  -1.976   7.423
  246   1HB   PHE  34          HB2       PHE  34  -3.954  -0.136   7.241
  247   2HB   PHE  34          HB1       PHE  34  -2.895  -0.749   8.479
  248    HD1  PHE  34           HD1      PHE  34  -1.054  -2.041   7.926
  249    HD2  PHE  34           HD2      PHE  34  -4.140  -1.502   5.028
  250    HE1  PHE  34           HE1      PHE  34   0.363  -3.117   6.213
  251    HE2  PHE  34           HE2      PHE  34  -2.732  -2.577   3.327
  252    HZ   PHE  34           HZ       PHE  34  -0.484  -3.389   3.916
  253    H    THR  35           H        THR  35  -3.113  -2.683   9.946
  254    HA   THR  35           HA       THR  35  -2.436  -5.173   8.780
  255    HB   THR  35           HB       THR  35  -0.817  -3.883  10.135
  256    HG1  THR  35           HG1      THR  35   0.137  -5.635  10.560
  257   1HG2  THR  35          HG21      THR  35  -2.569  -4.630  12.466
  258   2HG2  THR  35          HG22      THR  35  -2.277  -3.015  11.795
  259   3HG2  THR  35          HG23      THR  35  -0.962  -3.886  12.586
  260    H    PHE  36           H        PHE  36  -4.847  -4.137  11.033
  261    HA   PHE  36           HA       PHE  36  -5.460  -6.678  12.080
  262   1HB   PHE  36          HB2       PHE  36  -6.251  -4.941  13.383
  263   2HB   PHE  36          HB1       PHE  36  -6.926  -4.039  12.050
  264    HD1  PHE  36           HD1      PHE  36  -9.240  -3.988  12.025
  265    HD2  PHE  36           HD2      PHE  36  -7.322  -7.458  13.556
  266    HE1  PHE  36           HE1      PHE  36 -11.435  -4.988  12.512
  267    HE2  PHE  36           HE2      PHE  36  -9.516  -8.457  14.061
  268    HZ   PHE  36           HZ       PHE  36 -11.572  -7.218  13.533
  269    H    HIS  37           H        HIS  37  -7.107  -4.716   9.579
  270    HA   HIS  37           HA       HIS  37  -8.823  -6.861   8.990
  271   1HB   HIS  37          HB2       HIS  37  -9.859  -5.514   7.362
  272   2HB   HIS  37          HB1       HIS  37  -9.124  -4.330   8.432
  273    HD1  HIS  37           HD1      HIS  37  -7.545  -2.673   7.358
  274    HD2  HIS  37           HD2      HIS  37  -8.564  -5.827   4.867
  275    HE1  HIS  37           HE1      HIS  37  -6.617  -2.077   5.072
  276    H    VAL  38           H        VAL  38  -5.651  -6.090   7.918
  277    HA   VAL  38           HA       VAL  38  -5.638  -7.885   5.735
  278    HB   VAL  38           HB       VAL  38  -3.419  -6.751   7.408
  279   1HG1  VAL  38          HG11      VAL  38  -2.697  -8.964   6.593
  280   2HG1  VAL  38          HG12      VAL  38  -1.821  -7.698   5.724
  281   3HG1  VAL  38          HG13      VAL  38  -3.175  -8.531   4.953
  282   1HG2  VAL  38          HG21      VAL  38  -2.850  -5.537   5.329
  283   2HG2  VAL  38          HG22      VAL  38  -4.479  -5.190   5.911
  284   3HG2  VAL  38          HG23      VAL  38  -4.246  -6.286   4.550
  285    H    ASP  39           H        ASP  39  -4.403  -8.264   9.078
  286    HA   ASP  39           HA       ASP  39  -3.669 -10.966   8.606
  287   1HB   ASP  39          HB2       ASP  39  -2.599  -9.579  10.312
  288   2HB   ASP  39          HB1       ASP  39  -4.108  -9.513  11.214
  289    H    SER  40           H        SER  40  -6.550  -9.462   9.411
  290    HA   SER  40           HA       SER  40  -7.784 -11.821  10.541
  291   1HB   SER  40          HB2       SER  40  -8.319  -9.570  11.421
  292   2HB   SER  40          HB1       SER  40  -8.974  -9.126   9.856
  293    HG   SER  40           HG       SER  40 -10.674 -10.380  10.154
  294    H    GLU  41           H        GLU  41  -8.019  -9.890   7.554
  295    HA   GLU  41           HA       GLU  41 -10.030 -11.805   6.648
  296   1HB   GLU  41          HB2       GLU  41  -9.343  -9.164   5.367
  297   2HB   GLU  41          HB1       GLU  41 -10.713 -10.190   4.988
  298   1HG   GLU  41          HG2       GLU  41 -10.250  -8.620   7.515
  299   2HG   GLU  41          HG1       GLU  41 -11.494  -8.349   6.301
  300    H    HIS  42           H        HIS  42  -6.944 -10.364   5.537
  301    HA   HIS  42           HA       HIS  42  -6.639 -12.586   3.739
  302   1HB   HIS  42          HB2       HIS  42  -5.442 -10.610   2.366
  303   2HB   HIS  42          HB1       HIS  42  -7.038 -11.204   1.935
  304    HD1  HIS  42           HD1      HIS  42  -8.935  -9.445   2.172
  305    HD2  HIS  42           HD2      HIS  42  -5.303  -8.105   3.689
  306    HE1  HIS  42           HE1      HIS  42  -9.237  -6.989   2.589
  307    HA   PRO  43           HA       PRO  43  -2.935 -11.652   6.420
  308   1HB   PRO  43          HB2       PRO  43  -2.558 -14.223   7.300
  309   2HB   PRO  43          HB1       PRO  43  -3.574 -13.050   8.140
  310   1HG   PRO  43          HG2       PRO  43  -4.359 -15.256   6.283
  311   2HG   PRO  43          HG1       PRO  43  -5.146 -14.716   7.776
  312   1HD   PRO  43          HD2       PRO  43  -6.054 -14.041   5.308
  313   2HD   PRO  43          HD1       PRO  43  -6.225 -12.983   6.725
  314    H    ASN  44           H        ASN  44  -3.485 -14.616   4.568
  315    HA   ASN  44           HA       ASN  44  -0.770 -14.422   3.467
  316   1HB   ASN  44          HB2       ASN  44  -2.607 -16.831   3.667
  317   2HB   ASN  44          HB1       ASN  44  -1.031 -16.833   2.882
  318   1HD2  ASN  44          HD21      ASN  44   0.833 -16.810   4.162
  319   2HD2  ASN  44          HD22      ASN  44   0.762 -17.092   5.860
  320    H    VAL  45           H        VAL  45  -0.671 -13.755   1.458
  321    HA   VAL  45           HA       VAL  45  -2.640 -14.451  -0.472
  322    HB   VAL  45           HB       VAL  45  -3.733 -12.535   0.652
  323   1HG1  VAL  45          HG11      VAL  45  -2.758 -10.357   0.743
  324   2HG1  VAL  45          HG12      VAL  45  -1.223 -11.001   0.147
  325   3HG1  VAL  45          HG13      VAL  45  -1.874 -11.540   1.699
  326   1HG2  VAL  45          HG21      VAL  45  -4.011 -11.008  -1.211
  327   2HG2  VAL  45          HG22      VAL  45  -4.013 -12.678  -1.785
  328   3HG2  VAL  45          HG23      VAL  45  -2.577 -11.669  -1.996
  329    H    VAL  46           H        VAL  46  -1.801 -13.950  -2.638
  330    HA   VAL  46           HA       VAL  46   1.033 -13.212  -2.629
  331    HB   VAL  46           HB       VAL  46   1.555 -15.022  -4.225
  332   1HG1  VAL  46          HG11      VAL  46   0.360 -16.022  -1.649
  333   2HG1  VAL  46          HG12      VAL  46   2.007 -15.426  -1.887
  334   3HG1  VAL  46          HG13      VAL  46   1.490 -16.919  -2.662
  335   1HG2  VAL  46          HG21      VAL  46  -0.026 -16.881  -4.579
  336   2HG2  VAL  46          HG22      VAL  46  -0.662 -15.353  -5.193
  337   3HG2  VAL  46          HG23      VAL  46  -1.248 -15.999  -3.663
  338    H    LEU  47           H        LEU  47   1.884 -12.912  -4.835
  339    HA   LEU  47           HA       LEU  47   0.534 -12.723  -7.185
  340   1HB   LEU  47          HB2       LEU  47  -0.596 -10.710  -6.056
  341   2HB   LEU  47          HB1       LEU  47   0.993  -9.981  -5.948
  342    HG   LEU  47           HG       LEU  47   1.155  -9.990  -8.416
  343   1HD1  LEU  47          HD11      LEU  47  -1.695 -10.962  -8.305
  344   2HD1  LEU  47          HD12      LEU  47  -0.307 -11.863  -8.916
  345   3HD1  LEU  47          HD13      LEU  47  -0.857 -10.414  -9.755
  346   1HD2  LEU  47          HD21      LEU  47  -0.451  -8.201  -8.831
  347   2HD2  LEU  47          HD22      LEU  47   0.329  -7.999  -7.260
  348   3HD2  LEU  47          HD23      LEU  47  -1.317  -8.633  -7.359
  349    H    ASN  48           H        ASN  48   2.152 -12.250  -8.803
  350    HA   ASN  48           HA       ASN  48   4.706 -12.899  -7.726
  351   1HB   ASN  48          HB2       ASN  48   3.969 -13.984  -9.743
  352   2HB   ASN  48          HB1       ASN  48   3.871 -12.446 -10.585
  353   1HD2  ASN  48          HD21      ASN  48   5.724 -11.542 -11.410
  354   2HD2  ASN  48          HD22      ASN  48   7.245 -12.362 -11.398
  355    H    SER  49           H        SER  49   3.441  -9.885  -9.070
  356    HA   SER  49           HA       SER  49   5.870  -8.657  -8.066
  357   1HB   SER  49          HB2       SER  49   4.955  -8.296 -10.927
  358   2HB   SER  49          HB1       SER  49   6.222  -7.346 -10.146
  359    HG   SER  49           HG       SER  49   6.672  -9.927  -9.723
  360    H    SER  50           H        SER  50   5.372  -7.039  -6.782
  361    HA   SER  50           HA       SER  50   3.443  -5.055  -7.478
  362   1HB   SER  50          HB2       SER  50   3.383  -6.527  -4.844
  363   2HB   SER  50          HB1       SER  50   2.323  -5.246  -5.407
  364    HG   SER  50           HG       SER  50   1.883  -6.860  -7.170
  365    H    TYR  51           H        TYR  51   3.684  -3.360  -5.614
  366    HA   TYR  51           HA       TYR  51   6.462  -3.325  -4.694
  367   1HB   TYR  51          HB2       TYR  51   4.746  -1.243  -5.935
  368   2HB   TYR  51          HB1       TYR  51   5.911  -0.768  -4.721
  369    HD1  TYR  51           HD1      TYR  51   6.512  -3.400  -7.301
  370    HD2  TYR  51           HD2      TYR  51   7.235   0.598  -6.058
  371    HE1  TYR  51           HE1      TYR  51   8.205  -3.157  -9.059
  372    HE2  TYR  51           HE2      TYR  51   8.934   0.846  -7.801
  373    HH   TYR  51           HH       TYR  51  10.283  -0.356  -9.195
  374    H    VAL  52           H        VAL  52   6.814  -2.663  -2.645
  375    HA   VAL  52           HA       VAL  52   4.503  -1.918  -0.992
  376    HB   VAL  52           HB       VAL  52   4.985  -4.336  -0.671
  377   1HG1  VAL  52          HG11      VAL  52   7.032  -5.064   0.300
  378   2HG1  VAL  52          HG12      VAL  52   7.653  -3.423   0.235
  379   3HG1  VAL  52          HG13      VAL  52   7.296  -4.304  -1.268
  380   1HG2  VAL  52          HG21      VAL  52   5.358  -4.410   1.734
  381   2HG2  VAL  52          HG22      VAL  52   4.181  -3.188   1.268
  382   3HG2  VAL  52          HG23      VAL  52   5.822  -2.705   1.709
  383    H    CYS  53           H        CYS  53   4.967  -0.401   0.525
  384    HA   CYS  53           HA       CYS  53   7.591   0.911   0.478
  385   1HB   CYS  53          HB2       CYS  53   5.620   2.293   0.646
  386   2HB   CYS  53          HB1       CYS  53   5.034   1.405   2.033
  387    H    VAL  54           H        VAL  54   9.073  -0.442   1.452
  388    HA   VAL  54           HA       VAL  54   8.581  -2.323   3.407
  389    HB   VAL  54           HB       VAL  54  11.126  -1.041   3.848
  390   1HG1  VAL  54          HG11      VAL  54  10.628  -3.348   4.386
  391   2HG1  VAL  54          HG12      VAL  54  11.983  -3.194   3.224
  392   3HG1  VAL  54          HG13      VAL  54  10.367  -3.601   2.648
  393   1HG2  VAL  54          HG21      VAL  54  10.368  -1.607   1.016
  394   2HG2  VAL  54          HG22      VAL  54  12.037  -1.655   1.564
  395   3HG2  VAL  54          HG23      VAL  54  11.096  -0.172   1.698
  396    H    GLU  55           H        GLU  55   9.152   1.052   3.615
  397    HA   GLU  55           HA       GLU  55   9.852   1.344   6.273
  398   1HB   GLU  55          HB2       GLU  55   8.265   3.328   4.661
  399   2HB   GLU  55          HB1       GLU  55   9.331   3.668   6.016
  400   1HG   GLU  55          HG2       GLU  55  10.224   2.574   3.352
  401   2HG   GLU  55          HG1       GLU  55  10.305   4.259   3.834
  402    H    CYS  56           H        CYS  56   6.812   1.200   4.677
  403    HA   CYS  56           HA       CYS  56   5.314   1.514   7.238
  404   1HB   CYS  56          HB2       CYS  56   4.234   1.426   4.439
  405   2HB   CYS  56          HB1       CYS  56   3.382   1.979   5.880
  406    H    ASN  57           H        ASN  57   6.352  -0.762   5.017
  407    HA   ASN  57           HA       ASN  57   5.820  -2.846   4.320
  408   1HB   ASN  57          HB2       ASN  57   5.522  -2.848   7.212
  409   2HB   ASN  57          HB1       ASN  57   4.410  -3.974   6.412
  410   1HD2  ASN  57          HD21      ASN  57   7.312  -3.372   4.944
  411   2HD2  ASN  57          HD22      ASN  57   8.010  -4.915   5.340
  412    H    PHE  58           H        PHE  58   4.284  -1.436   2.991
  413    HA   PHE  58           HA       PHE  58   1.633  -2.585   3.305
  414   1HB   PHE  58          HB2       PHE  58   0.443  -0.633   3.422
  415   2HB   PHE  58          HB1       PHE  58   1.948   0.052   4.004
  416    HD1  PHE  58           HD1      PHE  58   3.209   1.572   2.568
  417    HD2  PHE  58           HD2      PHE  58  -0.393  -0.179   1.244
  418    HE1  PHE  58           HE1      PHE  58   3.055   3.277   0.695
  419    HE2  PHE  58           HE2      PHE  58  -0.561   1.523  -0.578
  420    HZ   PHE  58           HZ       PHE  58   1.188   3.206  -0.837
  421    H    LEU  59           H        LEU  59   0.956  -3.456   1.561
  422    HA   LEU  59           HA       LEU  59   2.535  -3.157  -0.861
  423   1HB   LEU  59          HB2       LEU  59   0.976  -5.323   0.358
  424   2HB   LEU  59          HB1       LEU  59   0.755  -5.200  -1.369
  425    HG   LEU  59           HG       LEU  59   3.454  -5.478  -0.061
  426   1HD1  LEU  59          HD11      LEU  59   1.952  -7.396   0.354
  427   2HD1  LEU  59          HD12      LEU  59   3.275  -7.810  -0.740
  428   3HD1  LEU  59          HD13      LEU  59   1.655  -7.497  -1.382
  429   1HD2  LEU  59          HD21      LEU  59   2.466  -5.735  -2.913
  430   2HD2  LEU  59          HD22      LEU  59   4.076  -6.144  -2.378
  431   3HD2  LEU  59          HD23      LEU  59   3.525  -4.475  -2.287
  432    H    THR  60           H        THR  60   1.652  -2.257  -2.598
  433    HA   THR  60           HA       THR  60  -1.207  -1.741  -2.493
  434    HB   THR  60           HB       THR  60  -0.155   0.244  -1.822
  435    HG1  THR  60           HG1      THR  60  -1.841   0.422  -3.351
  436   1HG2  THR  60          HG21      THR  60   1.598   1.420  -3.098
  437   2HG2  THR  60          HG22      THR  60   1.615   0.107  -4.269
  438   3HG2  THR  60          HG23      THR  60   2.089  -0.185  -2.597
  439    H    LYS  61           H        LYS  61  -2.128  -1.265  -4.601
  440    HA   LYS  61           HA       LYS  61  -1.415  -3.332  -6.382
  441   1HB   LYS  61          HB2       LYS  61  -3.713  -2.610  -5.966
  442   2HB   LYS  61          HB1       LYS  61  -3.383  -1.077  -6.752
  443   1HG   LYS  61          HG2       LYS  61  -2.947  -2.275  -8.866
  444   2HG   LYS  61          HG1       LYS  61  -3.324  -3.797  -8.060
  445   1HD   LYS  61          HD2       LYS  61  -5.231  -1.472  -8.350
  446   2HD   LYS  61          HD1       LYS  61  -5.230  -2.905  -9.373
  447   1HE   LYS  61          HE2       LYS  61  -5.738  -4.306  -7.448
  448   2HE   LYS  61          HE1       LYS  61  -5.662  -2.918  -6.374
  449   1HZ   LYS  61          HZ1       LYS  61  -7.964  -3.406  -6.918
  450   2HZ   LYS  61          HZ2       LYS  61  -7.635  -3.342  -8.551
  451   3HZ   LYS  61          HZ3       LYS  61  -7.525  -1.944  -7.627
  452    H    ARG  62           H        ARG  62  -1.332   0.215  -6.795
  453    HA   ARG  62           HA       ARG  62   0.225  -0.285  -9.224
  454   1HB   ARG  62          HB2       ARG  62  -0.456   1.741 -10.165
  455   2HB   ARG  62          HB1       ARG  62  -1.878   1.261  -9.268
  456   1HG   ARG  62          HG2       ARG  62   0.163   3.263  -8.311
  457   2HG   ARG  62          HG1       ARG  62  -1.315   3.709  -9.135
  458   1HD   ARG  62          HD2       ARG  62  -1.088   2.298  -6.490
  459   2HD   ARG  62          HD1       ARG  62  -1.424   4.009  -6.745
  460    HE   ARG  62           HE       ARG  62  -3.459   3.030  -8.039
  461   1HH1  ARG  62          HH11      ARG  62  -2.031   1.752  -5.019
  462   2HH1  ARG  62          HH12      ARG  62  -3.539   1.209  -4.499
  463   1HH2  ARG  62          HH21      ARG  62  -5.551   2.291  -7.077
  464   2HH2  ARG  62          HH22      ARG  62  -5.432   1.528  -5.554
  465    H    TYR  63           H        TYR  63   2.235   0.693  -9.621
  466    HA   TYR  63           HA       TYR  63   3.729   0.995  -7.237
  467   1HB   TYR  63          HB2       TYR  63   5.758   1.308  -8.639
  468   2HB   TYR  63          HB1       TYR  63   4.832  -0.113  -9.076
  469    HD1  TYR  63           HD1      TYR  63   5.418   3.438 -10.107
  470    HD2  TYR  63           HD2      TYR  63   4.303  -0.485 -11.318
  471    HE1  TYR  63           HE1      TYR  63   5.503   4.144 -12.460
  472    HE2  TYR  63           HE2      TYR  63   4.374   0.218 -13.669
  473    HH   TYR  63           HH       TYR  63   5.753   3.195 -14.644
  474    H    ASP  64           H        ASP  64   2.003   3.212  -8.982
  475    HA   ASP  64           HA       ASP  64   3.479   5.593  -8.638
  476   1HB   ASP  64          HB2       ASP  64   0.458   5.368  -8.472
  477   2HB   ASP  64          HB1       ASP  64   1.385   6.808  -8.841
  478    H    ALA  65           H        ALA  65   1.461   3.788  -6.419
  479    HA   ALA  65           HA       ALA  65   1.045   5.830  -4.516
  480   1HB   ALA  65          HB1       ALA  65   0.549   3.942  -2.964
  481   2HB   ALA  65          HB2       ALA  65   1.065   2.835  -4.256
  482   3HB   ALA  65          HB3       ALA  65  -0.322   3.884  -4.487
  483    H    LEU  66           H        LEU  66   3.705   3.738  -5.062
  484    HA   LEU  66           HA       LEU  66   5.026   4.306  -2.559
  485   1HB   LEU  66          HB2       LEU  66   6.133   3.089  -5.044
  486   2HB   LEU  66          HB1       LEU  66   6.921   3.084  -3.481
  487    HG   LEU  66           HG       LEU  66   6.107   0.953  -3.692
  488   1HD1  LEU  66          HD11      LEU  66   4.326   0.682  -2.065
  489   2HD1  LEU  66          HD12      LEU  66   3.937   2.390  -2.227
  490   3HD1  LEU  66          HD13      LEU  66   5.494   1.906  -1.540
  491   1HD2  LEU  66          HD21      LEU  66   3.872   0.358  -4.472
  492   2HD2  LEU  66          HD22      LEU  66   4.796   1.294  -5.659
  493   3HD2  LEU  66          HD23      LEU  66   3.522   2.073  -4.723
  494    H    SER  67           H        SER  67   4.982   5.489  -5.742
  495    HA   SER  67           HA       SER  67   7.507   6.910  -5.777
  496   1HB   SER  67          HB2       SER  67   5.044   6.695  -7.340
  497   2HB   SER  67          HB1       SER  67   6.222   7.912  -7.823
  498    HG   SER  67           HG       SER  67   6.179   5.079  -7.902
  499    H    GLU  68           H        GLU  68   4.119   7.700  -5.485
  500    HA   GLU  68           HA       GLU  68   4.590  10.460  -4.908
  501   1HB   GLU  68          HB2       GLU  68   2.045   9.270  -4.036
  502   2HB   GLU  68          HB1       GLU  68   2.412  10.749  -4.936
  503   1HG   GLU  68          HG2       GLU  68   2.880   9.297  -6.918
  504   2HG   GLU  68          HG1       GLU  68   2.320   7.980  -5.961
  505    H    HIS  69           H        HIS  69   4.557   7.610  -3.211
  506    HA   HIS  69           HA       HIS  69   3.577   8.133  -0.687
  507   1HB   HIS  69          HB2       HIS  69   4.623   6.000  -1.631
  508   2HB   HIS  69          HB1       HIS  69   6.142   6.684  -0.985
  509    HD1  HIS  69           HD1      HIS  69   2.646   5.846   0.259
  510    HD2  HIS  69           HD2      HIS  69   6.596   5.840   1.430
  511    HE1  HIS  69           HE1      HIS  69   2.656   4.876   2.584
  512    H    ASN  70           H        ASN  70   7.013   8.642  -1.564
  513    HA   ASN  70           HA       ASN  70   7.578  10.154   0.826
  514   1HB   ASN  70          HB2       ASN  70   9.726  10.646  -0.292
  515   2HB   ASN  70          HB1       ASN  70   9.386   8.936  -0.183
  516   1HD2  ASN  70          HD21      ASN  70  11.174   9.953  -1.820
  517   2HD2  ASN  70          HD22      ASN  70  10.693   9.682  -3.497
  518    H    LEU  71           H        LEU  71   6.038  10.945  -1.966
  519    HA   LEU  71           HA       LEU  71   6.680  13.745  -1.923
  520   1HB   LEU  71          HB2       LEU  71   6.133  13.040  -4.059
  521   2HB   LEU  71          HB1       LEU  71   4.927  11.921  -3.486
  522    HG   LEU  71           HG       LEU  71   3.370  13.723  -3.152
  523   1HD1  LEU  71          HD11      LEU  71   5.528  15.483  -4.389
  524   2HD1  LEU  71          HD12      LEU  71   4.938  15.600  -2.730
  525   3HD1  LEU  71          HD13      LEU  71   3.870  15.989  -4.077
  526   1HD2  LEU  71          HD21      LEU  71   2.968  14.217  -5.509
  527   2HD2  LEU  71          HD22      LEU  71   3.411  12.533  -5.239
  528   3HD2  LEU  71          HD23      LEU  71   4.595  13.663  -5.893
  529    H    LYS  72           H        LYS  72   3.903  11.759  -1.037
  530    HA   LYS  72           HA       LYS  72   2.826  14.069   0.397
  531   1HB   LYS  72          HB2       LYS  72   0.698  12.332   0.221
  532   2HB   LYS  72          HB1       LYS  72   0.958  13.723  -0.845
  533   1HG   LYS  72          HG2       LYS  72   2.257  12.038  -2.271
  534   2HG   LYS  72          HG1       LYS  72   1.548  10.799  -1.282
  535   1HD   LYS  72          HD2       LYS  72   0.032  12.814  -2.939
  536   2HD   LYS  72          HD1       LYS  72   0.244  11.099  -3.291
  537   1HE   LYS  72          HE2       LYS  72  -1.080  10.548  -1.245
  538   2HE   LYS  72          HE1       LYS  72  -1.264  12.265  -0.939
  539   1HZ   LYS  72          HZ1       LYS  72  -3.192  11.327  -2.003
  540   2HZ   LYS  72          HZ2       LYS  72  -2.281  10.839  -3.333
  541   3HZ   LYS  72          HZ3       LYS  72  -2.469  12.478  -3.002
  542    H    TYR  73           H        TYR  73   3.428  10.715   0.749
  543    HA   TYR  73           HA       TYR  73   2.282  10.530   3.400
  544   1HB   TYR  73          HB2       TYR  73   3.809   8.589   1.715
  545   2HB   TYR  73          HB1       TYR  73   3.160   8.172   3.307
  546    HD1  TYR  73           HD1      TYR  73   1.988   9.701   0.099
  547    HD2  TYR  73           HD2      TYR  73   1.178   6.957   3.238
  548    HE1  TYR  73           HE1      TYR  73  -0.024   9.026  -1.037
  549    HE2  TYR  73           HE2      TYR  73  -0.884   6.273   2.089
  550    HH   TYR  73           HH       TYR  73  -2.436   7.461   0.474
  551    H    HIS  74           H        HIS  74   5.571  10.062   2.020
  552    HA   HIS  74           HA       HIS  74   6.691  10.781   4.695
  553   1HB   HIS  74          HB2       HIS  74   7.955   9.132   2.478
  554   2HB   HIS  74          HB1       HIS  74   8.810   9.640   3.913
  555    HD1  HIS  74           HD1      HIS  74   9.022   7.749   5.554
  556    HD2  HIS  74           HD2      HIS  74   5.671   7.426   3.149
  557    HE1  HIS  74           HE1      HIS  74   8.117   5.464   5.978
  558    HA   PRO  75           HA       PRO  75   7.858  14.145   1.624
  559   1HB   PRO  75          HB2       PRO  75   7.126  16.263   3.113
  560   2HB   PRO  75          HB1       PRO  75   5.951  15.347   2.162
  561   1HG   PRO  75          HG2       PRO  75   6.593  15.087   5.086
  562   2HG   PRO  75          HG1       PRO  75   4.999  15.183   4.309
  563   1HD   PRO  75          HD2       PRO  75   6.095  12.815   5.035
  564   2HD   PRO  75          HD1       PRO  75   5.077  13.007   3.590
  565    H    GLY  76           H        GLY  76   9.542  15.603   1.653
  566   1HA   GLY  76          HA2       GLY  76  11.077  16.795   3.385
  567   2HA   GLY  76          HA1       GLY  76  11.548  15.129   3.717
  568    H    GLU  77           H        GLU  77  11.463  14.046   1.212
  569    HA   GLU  77           HA       GLU  77  12.971  15.526  -0.709
  570   1HB   GLU  77          HB2       GLU  77  14.929  14.002  -0.669
  571   2HB   GLU  77          HB1       GLU  77  14.829  15.023   0.759
  572   1HG   GLU  77          HG2       GLU  77  14.240  13.257   2.127
  573   2HG   GLU  77          HG1       GLU  77  13.696  12.271   0.769
  574    H    GLU  78           H        GLU  78  13.688  13.858  -2.463
  575    HA   GLU  78           HA       GLU  78  11.685  11.714  -2.509
  576   1HB   GLU  78          HB2       GLU  78  11.061  13.654  -3.966
  577   2HB   GLU  78          HB1       GLU  78  12.608  13.382  -4.782
  578   1HG   GLU  78          HG2       GLU  78  11.894  11.239  -5.555
  579   2HG   GLU  78          HG1       GLU  78  10.383  11.357  -4.653
  580    H    ASN  79           H        ASN  79  13.174  10.149  -1.930
  581    HA   ASN  79           HA       ASN  79  14.994   9.266  -4.016
  582   1HB   ASN  79          HB2       ASN  79  15.958   9.869  -1.212
  583   2HB   ASN  79          HB1       ASN  79  16.916   9.022  -2.427
  584   1HD2  ASN  79          HD21      ASN  79  15.623  11.959  -1.344
  585   2HD2  ASN  79          HD22      ASN  79  16.365  13.058  -2.456
  586    H    PHE  80           H        PHE  80  13.742   7.460  -4.161
  587    HA   PHE  80           HA       PHE  80  13.548   5.755  -1.787
  588   1HB   PHE  80          HB2       PHE  80  11.735   6.244  -4.057
  589   2HB   PHE  80          HB1       PHE  80  12.071   4.544  -3.783
  590    HD1  PHE  80           HD1      PHE  80  11.636   3.638  -1.440
  591    HD2  PHE  80           HD2      PHE  80  10.159   7.367  -2.796
  592    HE1  PHE  80           HE1      PHE  80   9.839   3.519   0.218
  593    HE2  PHE  80           HE2      PHE  80   8.369   7.263  -1.092
  594    HZ   PHE  80           HZ       PHE  80   8.205   5.327   0.390
  595    H    LYS  81           H        LYS  81  14.107   3.527  -2.033
  596    HA   LYS  81           HA       LYS  81  15.789   2.904  -4.374
  597   1HB   LYS  81          HB2       LYS  81  17.390   2.011  -2.947
  598   2HB   LYS  81          HB1       LYS  81  16.614   3.124  -1.806
  599   1HG   LYS  81          HG2       LYS  81  15.266   1.377  -0.911
  600   2HG   LYS  81          HG1       LYS  81  15.862   0.245  -2.115
  601   1HD   LYS  81          HD2       LYS  81  18.177   0.757  -1.137
  602   2HD   LYS  81          HD1       LYS  81  17.249   1.441   0.214
  603   1HE   LYS  81          HE2       LYS  81  16.034  -0.662   0.448
  604   2HE   LYS  81          HE1       LYS  81  16.963  -1.322  -0.895
  605   1HZ   LYS  81          HZ1       LYS  81  18.979  -1.147   0.436
  606   2HZ   LYS  81          HZ2       LYS  81  17.833  -2.031   1.308
  607   3HZ   LYS  81          HZ3       LYS  81  18.131  -0.429   1.704
  608    H    LEU  82           H        LEU  82  15.700   0.368  -4.760
  609    HA   LEU  82           HA       LEU  82  13.216  -0.686  -3.736
  610   1HB   LEU  82          HB2       LEU  82  12.670  -1.745  -5.872
  611   2HB   LEU  82          HB1       LEU  82  12.687  -0.005  -6.021
  612    HG   LEU  82           HG       LEU  82  15.076  -1.613  -6.823
  613   1HD1  LEU  82          HD11      LEU  82  13.121  -2.576  -8.007
  614   2HD1  LEU  82          HD12      LEU  82  14.144  -1.672  -9.124
  615   3HD1  LEU  82          HD13      LEU  82  12.643  -0.962  -8.531
  616   1HD2  LEU  82          HD21      LEU  82  15.409   0.247  -8.363
  617   2HD2  LEU  82          HD22      LEU  82  15.316   0.800  -6.688
  618   3HD2  LEU  82          HD23      LEU  82  13.934   1.008  -7.772
  619    H    THR  83           H        THR  83  13.313  -2.703  -3.119
  620    HA   THR  83           HA       THR  83  15.658  -4.285  -3.744
  621    HB   THR  83           HB       THR  83  16.225  -3.178  -1.672
  622    HG1  THR  83           HG1      THR  83  16.578  -5.511  -1.815
  623   1HG2  THR  83          HG21      THR  83  13.968  -2.466  -0.987
  624   2HG2  THR  83          HG22      THR  83  14.848  -3.196   0.345
  625   3HG2  THR  83          HG23      THR  83  13.604  -4.125  -0.501
  626    H    MET  84           H        MET  84  14.871  -6.440  -4.289
  627    HA   MET  84           HA       MET  84  12.002  -6.732  -3.661
  628   1HB   MET  84          HB2       MET  84  12.774  -7.023  -6.022
  629   2HB   MET  84          HB1       MET  84  13.793  -8.337  -5.460
  630   1HG   MET  84          HG2       MET  84  11.822  -9.631  -4.846
  631   2HG   MET  84          HG1       MET  84  10.783  -8.310  -5.387
  632   1HE   MET  84          HE1       MET  84  10.479 -11.307  -6.516
  633   2HE   MET  84          HE2       MET  84  10.230 -10.961  -8.228
  634   3HE   MET  84          HE3       MET  84   9.464  -9.951  -7.000
  635    H    VAL  85           H        VAL  85  11.882  -7.457  -1.694
  636    HA   VAL  85           HA       VAL  85  12.726 -10.130  -1.234
  637    HB   VAL  85           HB       VAL  85  13.398  -9.359   1.219
  638   1HG1  VAL  85          HG11      VAL  85  14.941 -10.501  -0.289
  639   2HG1  VAL  85          HG12      VAL  85  15.776  -9.173   0.528
  640   3HG1  VAL  85          HG13      VAL  85  15.230  -8.987  -1.142
  641   1HG2  VAL  85          HG21      VAL  85  14.061  -6.897  -0.401
  642   2HG2  VAL  85          HG22      VAL  85  14.581  -7.198   1.259
  643   3HG2  VAL  85          HG23      VAL  85  12.864  -6.982   0.894
  644    H    LYS  86           H        LYS  86  10.663 -10.959  -0.843
  645    HA   LYS  86           HA       LYS  86   9.433  -9.692   1.432
  646   1HB   LYS  86          HB2       LYS  86   8.300  -8.914  -0.763
  647   2HB   LYS  86          HB1       LYS  86   7.648 -10.554  -0.816
  648   1HG   LYS  86          HG2       LYS  86   6.034  -9.067   0.095
  649   2HG   LYS  86          HG1       LYS  86   6.561 -10.211   1.319
  650   1HD   LYS  86          HD2       LYS  86   7.797  -8.637   2.508
  651   2HD   LYS  86          HD1       LYS  86   8.022  -7.610   1.106
  652   1HE   LYS  86          HE2       LYS  86   5.850  -6.633   1.354
  653   2HE   LYS  86          HE1       LYS  86   5.321  -7.890   2.471
  654   1HZ   LYS  86          HZ1       LYS  86   7.463  -5.907   2.895
  655   2HZ   LYS  86          HZ2       LYS  86   6.973  -7.068   4.027
  656   3HZ   LYS  86          HZ3       LYS  86   5.899  -5.838   3.573
  657    H    ARG  87           H        ARG  87   8.974 -11.132   2.892
  658    HA   ARG  87           HA       ARG  87   9.434 -13.847   1.945
  659   1HB   ARG  87          HB2       ARG  87  10.321 -12.590   4.554
  660   2HB   ARG  87          HB1       ARG  87  10.563 -14.269   4.098
  661   1HG   ARG  87          HG2       ARG  87  12.660 -13.240   3.666
  662   2HG   ARG  87          HG1       ARG  87  11.862 -13.370   2.097
  663   1HD   ARG  87          HD2       ARG  87  12.923 -11.194   2.273
  664   2HD   ARG  87          HD1       ARG  87  11.181 -11.027   2.222
  665    HE   ARG  87           HE       ARG  87  12.277 -11.085   4.889
  666   1HH1  ARG  87          HH11      ARG  87  11.343  -8.856   2.217
  667   2HH1  ARG  87          HH12      ARG  87  11.226  -7.503   3.147
  668   1HH2  ARG  87          HH21      ARG  87  12.114  -9.178   6.216
  669   2HH2  ARG  87          HH22      ARG  87  11.686  -7.675   5.547
  670    H    ASN  88           H        ASN  88   8.272 -15.474   2.787
  671    HA   ASN  88           HA       ASN  88   6.702 -16.646   3.866
  672   1HB   ASN  88          HB2       ASN  88   6.251 -14.248   5.674
  673   2HB   ASN  88          HB1       ASN  88   5.590 -15.852   5.928
  674   1HD2  ASN  88          HD21      ASN  88   8.294 -13.806   6.263
  675   2HD2  ASN  88          HD22      ASN  88   9.345 -14.901   7.073
  676    H    ASN  89           H        ASN  89   6.143 -14.396   1.796
  677    HA   ASN  89           HA       ASN  89   3.235 -14.802   1.856
  678   1HB   ASN  89          HB2       ASN  89   4.465 -12.080   1.263
  679   2HB   ASN  89          HB1       ASN  89   2.759 -12.480   1.224
  680   1HD2  ASN  89          HD21      ASN  89   5.488 -11.700   3.185
  681   2HD2  ASN  89          HD22      ASN  89   4.635 -11.515   4.661
  682    H    GLN  90           H        GLN  90   5.303 -12.784  -0.164
  683    HA   GLN  90           HA       GLN  90   5.455 -14.648  -2.317
  684   1HB   GLN  90          HB2       GLN  90   4.376 -13.314  -3.964
  685   2HB   GLN  90          HB1       GLN  90   3.186 -13.453  -2.666
  686   1HG   GLN  90          HG2       GLN  90   5.007 -11.095  -2.897
  687   2HG   GLN  90          HG1       GLN  90   3.580 -11.208  -3.909
  688   1HE2  GLN  90          HE21      GLN  90   4.831 -10.723  -0.745
  689   2HE2  GLN  90          HE22      GLN  90   3.355 -10.176  -0.016
  690    H    THR  91           H        THR  91   6.848 -13.498  -3.990
  691    HA   THR  91           HA       THR  91   8.532 -11.604  -2.577
  692    HB   THR  91           HB       THR  91  10.106 -11.984  -4.539
  693    HG1  THR  91           HG1      THR  91   8.218 -13.118  -5.629
  694   1HG2  THR  91          HG21      THR  91  11.005 -14.055  -3.513
  695   2HG2  THR  91          HG22      THR  91   9.471 -14.282  -2.672
  696   3HG2  THR  91          HG23      THR  91  10.487 -12.921  -2.268
  697    H    ILE  92           H        ILE  92   8.208  -9.637  -2.850
  698    HA   ILE  92           HA       ILE  92   7.461  -8.497  -5.354
  699    HB   ILE  92           HB       ILE  92   5.923  -6.902  -4.070
  700   1HG1  ILE  92          HG12      ILE  92   4.772  -8.169  -2.128
  701   2HG1  ILE  92          HG11      ILE  92   6.292  -9.038  -2.072
  702   1HG2  ILE  92          HG21      ILE  92   5.005  -8.441  -5.641
  703   2HG2  ILE  92          HG22      ILE  92   3.992  -8.427  -4.189
  704   3HG2  ILE  92          HG23      ILE  92   5.115  -9.755  -4.474
  705   1HD1  ILE  92          HD11      ILE  92   6.259  -7.138  -0.532
  706   2HD1  ILE  92          HD12      ILE  92   6.090  -6.048  -1.910
  707   3HD1  ILE  92          HD13      ILE  92   7.533  -7.036  -1.736
  708    H    PHE  93           H        PHE  93   7.786  -6.068  -5.341
  709    HA   PHE  93           HA       PHE  93  10.552  -5.827  -4.480
  710   1HB   PHE  93          HB2       PHE  93   8.762  -4.070  -6.152
  711   2HB   PHE  93          HB1       PHE  93  10.459  -3.769  -5.890
  712    HD1  PHE  93           HD1      PHE  93  12.102  -5.097  -7.010
  713    HD2  PHE  93           HD2      PHE  93   7.959  -5.775  -7.645
  714    HE1  PHE  93           HE1      PHE  93  12.631  -6.380  -9.064
  715    HE2  PHE  93           HE2      PHE  93   8.464  -7.069  -9.680
  716    HZ   PHE  93           HZ       PHE  93  10.807  -7.368 -10.394
  717    H    GLU  94           H        GLU  94  11.013  -4.746  -2.638
  718    HA   GLU  94           HA       GLU  94   8.966  -3.151  -1.407
  719   1HB   GLU  94          HB2       GLU  94  11.631  -4.097  -0.297
  720   2HB   GLU  94          HB1       GLU  94  10.339  -3.340   0.603
  721   1HG   GLU  94          HG2       GLU  94   8.990  -5.393  -0.307
  722   2HG   GLU  94          HG1       GLU  94  10.599  -6.127  -0.304
  723    H    GLN  95           H        GLN  95   9.333  -1.030  -1.005
  724    HA   GLN  95           HA       GLN  95  11.693   0.104  -2.337
  725   1HB   GLN  95          HB2       GLN  95   9.256   0.325  -3.321
  726   2HB   GLN  95          HB1       GLN  95   9.092   1.573  -2.091
  727   1HG   GLN  95          HG2       GLN  95  10.965   2.770  -3.010
  728   2HG   GLN  95          HG1       GLN  95  11.246   1.469  -4.162
  729   1HE2  GLN  95          HE21      GLN  95   9.271   4.163  -3.307
  730   2HE2  GLN  95          HE22      GLN  95   8.478   4.318  -4.830
  731    H    THR  96           H        THR  96  13.036   0.956  -0.828
  732    HA   THR  96           HA       THR  96  11.905   1.998   1.688
  733    HB   THR  96           HB       THR  96  14.723   1.643   1.820
  734    HG1  THR  96           HG1      THR  96  14.142  -0.883   1.597
  735   1HG2  THR  96          HG21      THR  96  12.448   0.115   3.094
  736   2HG2  THR  96          HG22      THR  96  13.146   1.585   3.696
  737   3HG2  THR  96          HG23      THR  96  14.120   0.112   3.647
  738    H    ILE  97           H        ILE  97  13.017   3.834   2.607
  739    HA   ILE  97           HA       ILE  97  14.152   5.613   0.534
  740    HB   ILE  97           HB       ILE  97  13.087   6.506   3.229
  741   1HG1  ILE  97          HG12      ILE  97  11.440   6.561   0.736
  742   2HG1  ILE  97          HG11      ILE  97  11.452   5.086   1.682
  743   1HG2  ILE  97          HG21      ILE  97  13.211   7.892   0.531
  744   2HG2  ILE  97          HG22      ILE  97  14.501   7.957   1.706
  745   3HG2  ILE  97          HG23      ILE  97  12.941   8.631   2.117
  746   1HD1  ILE  97          HD11      ILE  97   9.571   6.206   2.344
  747   2HD1  ILE  97          HD12      ILE  97  10.330   7.773   2.329
  748   3HD1  ILE  97          HD13      ILE  97  10.721   6.596   3.619
  749    H    ASN  98           H        ASN  98  15.890   6.882   1.161
  750    HA   ASN  98           HA       ASN  98  17.694   5.494   2.945
  751   1HB   ASN  98          HB2       ASN  98  19.363   7.051   1.782
  752   2HB   ASN  98          HB1       ASN  98  18.625   5.802   0.779
  753   1HD2  ASN  98          HD21      ASN  98  17.148   8.894   1.803
  754   2HD2  ASN  98          HD22      ASN  98  17.015   9.550   0.246
  755    H    ASP  99           H        ASP  99  15.476   7.701   3.443
  756    HA   ASP  99           HA       ASP  99  17.066   9.236   5.367
  757   1HB   ASP  99          HB2       ASP  99  17.156  10.297   3.086
  758   2HB   ASP  99          HB1       ASP  99  15.470  10.626   3.290
  759    H    LEU 100           H        LEU 100  13.991   9.282   3.613
  760    HA   LEU 100           HA       LEU 100  12.406  10.307   5.788
  761   1HB   LEU 100          HB2       LEU 100  11.400   8.978   3.275
  762   2HB   LEU 100          HB1       LEU 100  10.650  10.183   4.276
  763    HG   LEU 100           HG       LEU 100  13.155  10.988   2.906
  764   1HD1  LEU 100          HD11      LEU 100  11.772  11.588   0.939
  765   2HD1  LEU 100          HD12      LEU 100  10.442  10.660   1.641
  766   3HD1  LEU 100          HD13      LEU 100  11.919   9.849   1.143
  767   1HD2  LEU 100          HD21      LEU 100  11.878  12.438   4.473
  768   2HD2  LEU 100          HD22      LEU 100  10.515  12.305   3.324
  769   3HD2  LEU 100          HD23      LEU 100  12.014  13.052   2.818
  770    H    THR 101           H        THR 101  13.832   7.646   5.823
  771    HA   THR 101           HA       THR 101  12.364   5.367   5.686
  772    HB   THR 101           HB       THR 101  14.473   6.062   7.728
  773    HG1  THR 101           HG1      THR 101  14.745   5.210   5.030
  774   1HG2  THR 101          HG21      THR 101  13.905   3.522   6.204
  775   2HG2  THR 101          HG22      THR 101  13.449   3.797   7.891
  776   3HG2  THR 101          HG23      THR 101  15.156   3.737   7.426
  777    H    PHE 102           H        PHE 102  12.370   7.819   8.237
  778    HA   PHE 102           HA       PHE 102  10.657   6.117   9.891
  779   1HB   PHE 102          HB2       PHE 102  12.287   8.541  10.677
  780   2HB   PHE 102          HB1       PHE 102  11.267   7.597  11.759
  781    HD1  PHE 102           HD1      PHE 102  14.463   7.795  10.053
  782    HD2  PHE 102           HD2      PHE 102  11.903   5.294  12.351
  783    HE1  PHE 102           HE1      PHE 102  16.361   6.299  10.526
  784    HE2  PHE 102           HE2      PHE 102  13.792   3.797  12.833
  785    HZ   PHE 102           HZ       PHE 102  16.023   4.297  11.923
  Start of MODEL    9
    1    HA   MET   1           HA       MET   1 -15.372   4.023  16.097
    2   1HB   MET   1          HB2       MET   1 -15.552   5.356  13.377
    3   2HB   MET   1          HB1       MET   1 -16.410   5.922  14.794
    4   1HG   MET   1          HG2       MET   1 -14.481   7.275  14.594
    5   2HG   MET   1          HG1       MET   1 -14.176   6.164  15.924
    6   1HE   MET   1          HE1       MET   1 -12.208   6.040  11.758
    7   2HE   MET   1          HE2       MET   1 -13.147   7.390  12.388
    8   3HE   MET   1          HE3       MET   1 -13.951   5.877  11.973
    9    H    ALA   2           H        ALA   2 -16.819   3.661  12.836
   10    HA   ALA   2           HA       ALA   2 -19.240   2.745  14.110
   11   1HB   ALA   2          HB1       ALA   2 -19.386   4.272  12.196
   12   2HB   ALA   2          HB2       ALA   2 -20.137   2.722  11.817
   13   3HB   ALA   2          HB3       ALA   2 -18.536   3.097  11.193
   14    H    HIS   3           H        HIS   3 -20.021   0.653  13.948
   15    HA   HIS   3           HA       HIS   3 -17.926  -1.284  13.470
   16   1HB   HIS   3          HB2       HIS   3 -20.584  -1.541  14.864
   17   2HB   HIS   3          HB1       HIS   3 -19.549  -2.927  14.533
   18    HD1  HIS   3           HD1      HIS   3 -17.726  -3.381  16.210
   19    HD2  HIS   3           HD2      HIS   3 -19.324   0.433  16.584
   20    HE1  HIS   3           HE1      HIS   3 -16.669  -2.374  18.267
   21    H    HIS   4           H        HIS   4 -19.931   0.082  11.547
   22    HA   HIS   4           HA       HIS   4 -19.901  -2.169   9.731
   23   1HB   HIS   4          HB2       HIS   4 -22.316  -0.392  10.231
   24   2HB   HIS   4          HB1       HIS   4 -22.124  -1.351   8.777
   25    HD1  HIS   4           HD1      HIS   4 -24.226  -1.540  11.414
   26    HD2  HIS   4           HD2      HIS   4 -21.324  -4.197  10.077
   27    HE1  HIS   4           HE1      HIS   4 -24.893  -3.807  12.280
   28    H    HIS   5           H        HIS   5 -19.467  -1.509   7.652
   29    HA   HIS   5           HA       HIS   5 -18.454   1.207   7.444
   30   1HB   HIS   5          HB2       HIS   5 -18.129  -1.207   5.666
   31   2HB   HIS   5          HB1       HIS   5 -17.590   0.396   5.186
   32    HD1  HIS   5           HD1      HIS   5 -15.470   1.307   6.320
   33    HD2  HIS   5           HD2      HIS   5 -16.624  -2.445   7.652
   34    HE1  HIS   5           HE1      HIS   5 -13.516   0.406   7.663
   35    H    HIS   6           H        HIS   6 -18.735   2.198   5.192
   36    HA   HIS   6           HA       HIS   6 -21.588   2.445   4.812
   37   1HB   HIS   6          HB2       HIS   6 -20.074   4.441   4.986
   38   2HB   HIS   6          HB1       HIS   6 -19.292   3.932   3.501
   39    HD1  HIS   6           HD1      HIS   6 -20.032   6.359   2.624
   40    HD2  HIS   6           HD2      HIS   6 -23.125   3.700   3.367
   41    HE1  HIS   6           HE1      HIS   6 -22.060   7.336   1.532
   42    H    HIS   7           H        HIS   7 -22.654   1.803   2.940
   43    HA   HIS   7           HA       HIS   7 -21.478  -0.260   1.416
   44   1HB   HIS   7          HB2       HIS   7 -23.603  -0.310   0.145
   45   2HB   HIS   7          HB1       HIS   7 -23.855  -0.342   1.883
   46    HD1  HIS   7           HD1      HIS   7 -25.216   1.638   2.888
   47    HD2  HIS   7           HD2      HIS   7 -24.446   2.004  -1.178
   48    HE1  HIS   7           HE1      HIS   7 -26.674   3.513   2.059
   49    H    HIS   8           H        HIS   8 -21.282   3.046   1.003
   50    HA   HIS   8           HA       HIS   8 -20.761   2.815  -1.837
   51   1HB   HIS   8          HB2       HIS   8 -20.800   5.206   0.013
   52   2HB   HIS   8          HB1       HIS   8 -20.192   5.305  -1.637
   53    HD1  HIS   8           HD1      HIS   8 -23.318   5.520   0.303
   54    HD2  HIS   8           HD2      HIS   8 -22.214   4.691  -3.619
   55    HE1  HIS   8           HE1      HIS   8 -25.383   5.825  -1.078
   56    H    ASN   9           H        ASN   9 -18.813   2.929  -2.718
   57    HA   ASN   9           HA       ASN   9 -16.631   2.167  -0.973
   58   1HB   ASN   9          HB2       ASN   9 -16.892   2.213  -3.984
   59   2HB   ASN   9          HB1       ASN   9 -15.438   1.703  -3.144
   60   1HD2  ASN   9          HD21      ASN   9 -18.708   0.901  -3.965
   61   2HD2  ASN   9          HD22      ASN   9 -18.655  -0.739  -3.446
   62    H    GLN  10           H        GLN  10 -14.458   3.077  -1.401
   63    HA   GLN  10           HA       GLN  10 -14.627   5.879  -1.120
   64   1HB   GLN  10          HB2       GLN  10 -12.080   5.807  -1.110
   65   2HB   GLN  10          HB1       GLN  10 -12.899   4.898   0.145
   66   1HG   GLN  10          HG2       GLN  10 -12.469   2.844  -1.016
   67   2HG   GLN  10          HG1       GLN  10 -11.746   3.715  -2.377
   68   1HE2  GLN  10          HE21      GLN  10  -9.693   4.520  -2.163
   69   2HE2  GLN  10          HE22      GLN  10  -8.644   4.123  -0.861
   70    H    GLN  11           H        GLN  11 -14.165   7.502  -2.395
   71    HA   GLN  11           HA       GLN  11 -14.538   7.262  -5.162
   72   1HB   GLN  11          HB2       GLN  11 -15.078   9.296  -3.885
   73   2HB   GLN  11          HB1       GLN  11 -13.368   9.544  -3.564
   74   1HG   GLN  11          HG2       GLN  11 -14.085  11.041  -5.306
   75   2HG   GLN  11          HG1       GLN  11 -12.986   9.837  -5.969
   76   1HE2  GLN  11          HE21      GLN  11 -16.262  10.938  -5.849
   77   2HE2  GLN  11          HE22      GLN  11 -16.822  10.053  -7.218
   78    H    ASN  12           H        ASN  12 -11.649   7.733  -3.189
   79    HA   ASN  12           HA       ASN  12  -9.962   7.772  -5.475
   80   1HB   ASN  12          HB2       ASN  12  -9.275   7.491  -2.542
   81   2HB   ASN  12          HB1       ASN  12  -8.063   7.409  -3.813
   82   1HD2  ASN  12          HD21      ASN  12 -10.043   9.427  -1.906
   83   2HD2  ASN  12          HD22      ASN  12  -9.474  10.934  -2.534
   84    H    LYS  13           H        LYS  13  -9.700   6.174  -6.660
   85    HA   LYS  13           HA       LYS  13  -9.818   3.429  -5.730
   86   1HB   LYS  13          HB2       LYS  13  -9.130   4.642  -8.411
   87   2HB   LYS  13          HB1       LYS  13  -9.381   2.927  -8.112
   88   1HG   LYS  13          HG2       LYS  13 -11.694   3.252  -7.638
   89   2HG   LYS  13          HG1       LYS  13 -11.505   5.002  -7.633
   90   1HD   LYS  13          HD2       LYS  13 -11.005   3.259 -10.037
   91   2HD   LYS  13          HD1       LYS  13 -12.543   4.070  -9.712
   92   1HE   LYS  13          HE2       LYS  13 -11.392   6.236  -9.758
   93   2HE   LYS  13          HE1       LYS  13  -9.863   5.419 -10.086
   94   1HZ   LYS  13          HZ1       LYS  13 -12.241   5.385 -11.858
   95   2HZ   LYS  13          HZ2       LYS  13 -10.770   4.641 -12.181
   96   3HZ   LYS  13          HZ3       LYS  13 -10.859   6.305 -12.091
   97    H    LYS  14           H        LYS  14  -7.713   5.972  -6.327
   98    HA   LYS  14           HA       LYS  14  -5.272   4.449  -6.250
   99   1HB   LYS  14          HB2       LYS  14  -6.037   7.283  -6.689
  100   2HB   LYS  14          HB1       LYS  14  -4.441   6.964  -6.045
  101   1HG   LYS  14          HG2       LYS  14  -5.473   5.689  -8.563
  102   2HG   LYS  14          HG1       LYS  14  -4.606   7.225  -8.550
  103   1HD   LYS  14          HD2       LYS  14  -3.524   4.635  -7.424
  104   2HD   LYS  14          HD1       LYS  14  -3.142   5.260  -9.035
  105   1HE   LYS  14          HE2       LYS  14  -2.507   6.541  -6.361
  106   2HE   LYS  14          HE1       LYS  14  -1.383   5.723  -7.427
  107   1HZ   LYS  14          HZ1       LYS  14  -1.666   7.506  -9.077
  108   2HZ   LYS  14          HZ2       LYS  14  -1.297   8.208  -7.585
  109   3HZ   LYS  14          HZ3       LYS  14  -2.860   8.222  -8.134
  110    H    VAL  15           H        VAL  15  -3.646   5.670  -4.770
  111    HA   VAL  15           HA       VAL  15  -4.483   5.122  -2.098
  112    HB   VAL  15           HB       VAL  15  -2.206   4.772  -3.483
  113   1HG1  VAL  15          HG11      VAL  15  -1.723   7.353  -2.115
  114   2HG1  VAL  15          HG12      VAL  15  -1.653   7.032  -3.848
  115   3HG1  VAL  15          HG13      VAL  15  -0.437   6.327  -2.759
  116   1HG2  VAL  15          HG21      VAL  15  -2.656   3.796  -1.292
  117   2HG2  VAL  15          HG22      VAL  15  -2.168   5.322  -0.529
  118   3HG2  VAL  15          HG23      VAL  15  -0.998   4.370  -1.429
  119    H    GLU  16           H        GLU  16  -4.914   6.773  -0.530
  120    HA   GLU  16           HA       GLU  16  -4.514   9.494  -1.495
  121   1HB   GLU  16          HB2       GLU  16  -6.546  10.188  -0.193
  122   2HB   GLU  16          HB1       GLU  16  -6.874   9.139  -1.561
  123   1HG   GLU  16          HG2       GLU  16  -7.109   7.260  -0.111
  124   2HG   GLU  16          HG1       GLU  16  -6.655   8.226   1.279
  125    H    GLY  17           H        GLY  17  -5.015   7.746   1.570
  126   1HA   GLY  17          HA2       GLY  17  -2.699   8.913   2.691
  127   2HA   GLY  17          HA1       GLY  17  -4.160   9.648   3.340
  128    H    GLY  18           H        GLY  18  -2.143   7.024   3.304
  129   1HA   GLY  18          HA2       GLY  18  -2.316   5.944   5.621
  130   2HA   GLY  18          HA1       GLY  18  -3.898   5.437   5.037
  131    H    TYR  19           H        TYR  19  -3.424   3.222   5.136
  132    HA   TYR  19           HA       TYR  19  -1.409   2.260   3.187
  133   1HB   TYR  19          HB2       TYR  19  -2.513   0.757   5.520
  134   2HB   TYR  19          HB1       TYR  19  -1.071   0.398   4.574
  135    HD1  TYR  19           HD1      TYR  19   0.633   2.580   4.608
  136    HD2  TYR  19           HD2      TYR  19  -2.090   1.409   7.644
  137    HE1  TYR  19           HE1      TYR  19   1.962   3.814   6.269
  138    HE2  TYR  19           HE2      TYR  19  -0.832   2.591   9.283
  139    HH   TYR  19           HH       TYR  19   1.564   4.869   8.448
  140    H    GLU  20           H        GLU  20  -2.093   1.570   1.562
  141    HA   GLU  20           HA       GLU  20  -4.846   0.694   1.393
  142   1HB   GLU  20          HB2       GLU  20  -4.040   2.438  -0.152
  143   2HB   GLU  20          HB1       GLU  20  -2.765   1.362  -0.687
  144   1HG   GLU  20          HG2       GLU  20  -4.541  -0.218  -1.443
  145   2HG   GLU  20          HG1       GLU  20  -5.714   1.056  -1.102
  146    H    CYS  21           H        CYS  21  -5.188  -1.307   0.943
  147    HA   CYS  21           HA       CYS  21  -3.137  -3.345   1.035
  148   1HB   CYS  21          HB2       CYS  21  -5.981  -3.535   0.141
  149   2HB   CYS  21          HB1       CYS  21  -4.954  -4.918   0.520
  150    H    LYS  22           H        LYS  22  -2.308  -4.524  -0.765
  151    HA   LYS  22           HA       LYS  22  -2.863  -3.566  -3.408
  152   1HB   LYS  22          HB2       LYS  22  -0.611  -4.388  -2.903
  153   2HB   LYS  22          HB1       LYS  22  -1.244  -5.940  -2.385
  154   1HG   LYS  22          HG2       LYS  22  -1.752  -5.078  -5.181
  155   2HG   LYS  22          HG1       LYS  22  -0.111  -5.622  -4.764
  156   1HD   LYS  22          HD2       LYS  22  -0.892  -7.781  -4.267
  157   2HD   LYS  22          HD1       LYS  22  -2.560  -7.233  -4.105
  158   1HE   LYS  22          HE2       LYS  22  -2.323  -8.469  -6.142
  159   2HE   LYS  22          HE1       LYS  22  -2.619  -6.780  -6.527
  160   1HZ   LYS  22          HZ1       LYS  22  -0.964  -7.484  -7.966
  161   2HZ   LYS  22          HZ2       LYS  22  -0.158  -8.365  -6.854
  162   3HZ   LYS  22          HZ3       LYS  22  -0.025  -6.690  -6.802
  163    H    TYR  23           H        TYR  23  -4.337  -5.642  -1.268
  164    HA   TYR  23           HA       TYR  23  -5.193  -7.550  -3.286
  165   1HB   TYR  23          HB2       TYR  23  -5.857  -8.088  -0.463
  166   2HB   TYR  23          HB1       TYR  23  -5.138  -9.113  -1.709
  167    HD1  TYR  23           HD1      TYR  23  -2.655  -8.907  -2.182
  168    HD2  TYR  23           HD2      TYR  23  -4.516  -7.115   1.199
  169    HE1  TYR  23           HE1      TYR  23  -0.467  -8.710  -1.075
  170    HE2  TYR  23           HE2      TYR  23  -2.340  -6.914   2.306
  171    HH   TYR  23           HH       TYR  23  -0.153  -7.996   2.217
  172    H    CYS  24           H        CYS  24  -6.278  -4.718  -2.206
  173    HA   CYS  24           HA       CYS  24  -8.910  -5.148  -3.044
  174   1HB   CYS  24          HB2       CYS  24 -10.116  -4.733  -0.942
  175   2HB   CYS  24          HB1       CYS  24  -9.054  -6.140  -0.809
  176    H    THR  25           H        THR  25 -10.012  -3.086  -3.216
  177    HA   THR  25           HA       THR  25  -8.127  -0.896  -3.136
  178    HB   THR  25           HB       THR  25 -10.972  -0.928  -4.212
  179    HG1  THR  25           HG1      THR  25  -8.563  -1.835  -5.197
  180   1HG2  THR  25          HG21      THR  25  -8.647   0.951  -4.753
  181   2HG2  THR  25          HG22      THR  25 -10.057   1.329  -3.768
  182   3HG2  THR  25          HG23      THR  25 -10.243   1.044  -5.500
  183    H    PHE  26           H        PHE  26  -8.144  -1.056  -0.786
  184    HA   PHE  26           HA       PHE  26 -10.051   0.791   0.322
  185   1HB   PHE  26          HB2       PHE  26 -11.082  -1.496   0.654
  186   2HB   PHE  26          HB1       PHE  26  -9.675  -1.925   1.621
  187    HD1  PHE  26           HD1      PHE  26 -12.664   0.197   1.438
  188    HD2  PHE  26           HD2      PHE  26  -9.442  -1.135   3.883
  189    HE1  PHE  26           HE1      PHE  26 -13.770   1.154   3.413
  190    HE2  PHE  26           HE2      PHE  26 -10.546  -0.178   5.862
  191    HZ   PHE  26           HZ       PHE  26 -12.710   0.966   5.626
  192    H    GLN  27           H        GLN  27  -9.155   1.923   1.952
  193    HA   GLN  27           HA       GLN  27  -6.435   1.199   2.714
  194   1HB   GLN  27          HB2       GLN  27  -6.074   2.716   1.016
  195   2HB   GLN  27          HB1       GLN  27  -7.459   3.697   1.466
  196   1HG   GLN  27          HG2       GLN  27  -6.289   4.663   3.269
  197   2HG   GLN  27          HG1       GLN  27  -5.003   3.457   3.153
  198   1HE2  GLN  27          HE21      GLN  27  -3.500   3.706   1.755
  199   2HE2  GLN  27          HE22      GLN  27  -3.243   5.084   0.732
  200    H    THR  28           H        THR  28  -5.760   1.741   4.708
  201    HA   THR  28           HA       THR  28  -7.374   3.500   6.320
  202    HB   THR  28           HB       THR  28  -8.207   1.313   7.021
  203    HG1  THR  28           HG1      THR  28  -7.963   2.699   8.769
  204   1HG2  THR  28          HG21      THR  28  -6.739  -0.432   7.924
  205   2HG2  THR  28          HG22      THR  28  -5.345   0.575   7.641
  206   3HG2  THR  28          HG23      THR  28  -6.259  -0.052   6.266
  207    HA   PRO  29           HA       PRO  29  -3.186   4.961   7.057
  208   1HB   PRO  29          HB2       PRO  29  -3.908   6.978   8.745
  209   2HB   PRO  29          HB1       PRO  29  -3.998   7.086   6.979
  210   1HG   PRO  29          HG2       PRO  29  -6.161   6.517   8.953
  211   2HG   PRO  29          HG1       PRO  29  -6.195   7.537   7.500
  212   1HD   PRO  29          HD2       PRO  29  -7.251   5.045   7.521
  213   2HD   PRO  29          HD1       PRO  29  -6.458   5.712   6.076
  214    H    ASP  30           H        ASP  30  -5.172   3.400   9.148
  215    HA   ASP  30           HA       ASP  30  -3.282   3.651  11.352
  216   1HB   ASP  30          HB2       ASP  30  -6.061   2.510  11.225
  217   2HB   ASP  30          HB1       ASP  30  -5.002   2.282  12.613
  218    H    LEU  31           H        LEU  31  -1.663   2.316  11.209
  219    HA   LEU  31           HA       LEU  31  -1.382   0.067   9.670
  220   1HB   LEU  31          HB2       LEU  31   0.272   1.494  11.174
  221   2HB   LEU  31          HB1       LEU  31  -0.038   0.238  12.346
  222    HG   LEU  31           HG       LEU  31   2.028  -0.273  11.256
  223   1HD1  LEU  31          HD11      LEU  31   1.621  -2.423  10.196
  224   2HD1  LEU  31          HD12      LEU  31  -0.092  -1.978  10.074
  225   3HD1  LEU  31          HD13      LEU  31   0.642  -2.206  11.667
  226   1HD2  LEU  31          HD21      LEU  31   0.560  -0.038   8.659
  227   2HD2  LEU  31          HD22      LEU  31   2.254  -0.512   8.843
  228   3HD2  LEU  31          HD23      LEU  31   1.717   1.112   9.304
  229    H    ASN  32           H        ASN  32  -2.505   0.388  13.020
  230    HA   ASN  32           HA       ASN  32  -2.753  -2.150  13.983
  231   1HB   ASN  32          HB2       ASN  32  -3.421   0.202  14.981
  232   2HB   ASN  32          HB1       ASN  32  -4.936  -0.180  14.145
  233   1HD2  ASN  32          HD21      ASN  32  -4.978  -3.027  14.757
  234   2HD2  ASN  32          HD22      ASN  32  -5.267  -3.089  16.442
  235    H    MET  33           H        MET  33  -4.976  -0.280  11.983
  236    HA   MET  33           HA       MET  33  -6.913  -2.391  11.866
  237   1HB   MET  33          HB2       MET  33  -6.836   0.161  10.252
  238   2HB   MET  33          HB1       MET  33  -8.214  -0.894  10.487
  239   1HG   MET  33          HG2       MET  33  -6.849   0.758  12.570
  240   2HG   MET  33          HG1       MET  33  -8.412   1.107  11.827
  241   1HE   MET  33          HE1       MET  33  -7.951   1.059  14.984
  242   2HE   MET  33          HE2       MET  33  -9.405   0.203  15.498
  243   3HE   MET  33          HE3       MET  33  -9.493   1.395  14.205
  244    H    PHE  34           H        PHE  34  -4.466  -0.969   9.814
  245    HA   PHE  34           HA       PHE  34  -5.128  -2.251   7.439
  246   1HB   PHE  34          HB2       PHE  34  -3.535  -0.458   7.361
  247   2HB   PHE  34          HB1       PHE  34  -2.470  -1.263   8.482
  248    HD1  PHE  34           HD1      PHE  34  -0.784  -2.634   7.742
  249    HD2  PHE  34           HD2      PHE  34  -3.886  -1.570   4.987
  250    HE1  PHE  34           HE1      PHE  34   0.501  -3.640   5.880
  251    HE2  PHE  34           HE2      PHE  34  -2.609  -2.562   3.164
  252    HZ   PHE  34           HZ       PHE  34  -0.421  -3.600   3.595
  253    H    THR  35           H        THR  35  -2.779  -3.266   9.874
  254    HA   THR  35           HA       THR  35  -2.328  -5.704   8.485
  255    HB   THR  35           HB       THR  35  -0.508  -4.842   9.847
  256    HG1  THR  35           HG1      THR  35  -1.198  -7.323   9.795
  257   1HG2  THR  35          HG21      THR  35  -1.748  -3.786  11.594
  258   2HG2  THR  35          HG22      THR  35  -0.587  -4.910  12.313
  259   3HG2  THR  35          HG23      THR  35  -2.304  -5.339  12.220
  260    H    PHE  36           H        PHE  36  -4.596  -4.719  10.853
  261    HA   PHE  36           HA       PHE  36  -5.443  -7.315  11.647
  262   1HB   PHE  36          HB2       PHE  36  -6.142  -5.675  13.104
  263   2HB   PHE  36          HB1       PHE  36  -6.629  -4.545  11.859
  264    HD1  PHE  36           HD1      PHE  36  -7.463  -7.821  13.370
  265    HD2  PHE  36           HD2      PHE  36  -8.872  -4.431  11.262
  266    HE1  PHE  36           HE1      PHE  36  -9.790  -8.618  13.673
  267    HE2  PHE  36           HE2      PHE  36 -11.203  -5.198  11.543
  268    HZ   PHE  36           HZ       PHE  36 -11.662  -7.300  12.750
  269    H    HIS  37           H        HIS  37  -6.683  -4.962   9.373
  270    HA   HIS  37           HA       HIS  37  -8.689  -6.460   8.198
  271   1HB   HIS  37          HB2       HIS  37  -8.661  -4.128   7.947
  272   2HB   HIS  37          HB1       HIS  37  -7.009  -4.089   7.406
  273    HD1  HIS  37           HD1      HIS  37 -10.394  -3.759   6.226
  274    HD2  HIS  37           HD2      HIS  37  -6.819  -5.159   4.666
  275    HE1  HIS  37           HE1      HIS  37 -10.653  -3.631   3.740
  276    H    VAL  38           H        VAL  38  -5.248  -6.388   7.662
  277    HA   VAL  38           HA       VAL  38  -5.350  -8.023   5.342
  278    HB   VAL  38           HB       VAL  38  -3.101  -7.273   7.192
  279   1HG1  VAL  38          HG11      VAL  38  -1.553  -8.309   5.531
  280   2HG1  VAL  38          HG12      VAL  38  -2.950  -8.894   4.620
  281   3HG1  VAL  38          HG13      VAL  38  -2.633  -9.514   6.240
  282   1HG2  VAL  38          HG21      VAL  38  -3.719  -6.531   4.341
  283   2HG2  VAL  38          HG22      VAL  38  -2.300  -5.990   5.246
  284   3HG2  VAL  38          HG23      VAL  38  -3.923  -5.511   5.765
  285    H    ASP  39           H        ASP  39  -4.519  -8.676   8.746
  286    HA   ASP  39           HA       ASP  39  -4.047 -11.427   8.323
  287   1HB   ASP  39          HB2       ASP  39  -3.239 -10.209  10.308
  288   2HB   ASP  39          HB1       ASP  39  -4.916  -9.991  10.802
  289    H    SER  40           H        SER  40  -6.887  -9.621   8.807
  290    HA   SER  40           HA       SER  40  -8.467 -11.979   9.385
  291   1HB   SER  40          HB2       SER  40  -8.829  -9.808  10.567
  292   2HB   SER  40          HB1       SER  40  -9.381  -9.128   9.048
  293    HG   SER  40           HG       SER  40 -11.089 -10.438   9.019
  294    H    GLU  41           H        GLU  41  -8.117  -9.602   6.738
  295    HA   GLU  41           HA       GLU  41 -10.246 -11.099   5.346
  296   1HB   GLU  41          HB2       GLU  41  -9.335  -8.304   4.711
  297   2HB   GLU  41          HB1       GLU  41 -10.761  -9.128   4.102
  298   1HG   GLU  41          HG2       GLU  41 -10.249  -8.323   6.942
  299   2HG   GLU  41          HG1       GLU  41 -11.315  -7.475   5.824
  300    H    HIS  42           H        HIS  42  -6.910 -10.453   5.183
  301    HA   HIS  42           HA       HIS  42  -6.732 -11.872   2.595
  302   1HB   HIS  42          HB2       HIS  42  -4.825  -9.580   3.052
  303   2HB   HIS  42          HB1       HIS  42  -5.324 -10.328   1.554
  304    HD1  HIS  42           HD1      HIS  42  -7.914  -9.557   0.806
  305    HD2  HIS  42           HD2      HIS  42  -5.831  -7.159   3.489
  306    HE1  HIS  42           HE1      HIS  42  -9.092  -7.350   0.814
  307    HA   PRO  43           HA       PRO  43  -4.002 -12.807   6.355
  308   1HB   PRO  43          HB2       PRO  43  -4.432 -15.521   6.449
  309   2HB   PRO  43          HB1       PRO  43  -5.380 -14.298   7.319
  310   1HG   PRO  43          HG2       PRO  43  -5.990 -15.648   4.701
  311   2HG   PRO  43          HG1       PRO  43  -7.087 -15.325   6.064
  312   1HD   PRO  43          HD2       PRO  43  -7.049 -13.812   3.860
  313   2HD   PRO  43          HD1       PRO  43  -7.334 -13.118   5.470
  314    H    ASN  44           H        ASN  44  -4.196 -15.266   3.742
  315    HA   ASN  44           HA       ASN  44  -1.274 -15.155   3.744
  316   1HB   ASN  44          HB2       ASN  44  -3.064 -17.503   3.072
  317   2HB   ASN  44          HB1       ASN  44  -1.331 -17.485   2.792
  318   1HD2  ASN  44          HD21      ASN  44  -0.871 -19.115   4.177
  319   2HD2  ASN  44          HD22      ASN  44  -1.040 -19.017   5.892
  320    H    VAL  45           H        VAL  45  -0.721 -13.834   2.224
  321    HA   VAL  45           HA       VAL  45  -2.029 -14.117  -0.358
  322    HB   VAL  45           HB       VAL  45  -1.288 -11.745  -0.818
  323   1HG1  VAL  45          HG11      VAL  45  -3.578 -12.271  -0.314
  324   2HG1  VAL  45          HG12      VAL  45  -3.138 -10.753   0.474
  325   3HG1  VAL  45          HG13      VAL  45  -3.242 -12.244   1.416
  326   1HG2  VAL  45          HG21      VAL  45  -0.875 -10.310   1.116
  327   2HG2  VAL  45          HG22      VAL  45   0.401 -11.521   0.933
  328   3HG2  VAL  45          HG23      VAL  45  -0.844 -11.724   2.170
  329    H    VAL  46           H        VAL  46  -0.924 -14.888  -1.896
  330    HA   VAL  46           HA       VAL  46   1.685 -13.925  -2.341
  331    HB   VAL  46           HB       VAL  46   2.264 -16.017  -1.232
  332   1HG1  VAL  46          HG11      VAL  46   0.204 -17.230  -1.378
  333   2HG1  VAL  46          HG12      VAL  46   1.520 -18.221  -2.009
  334   3HG1  VAL  46          HG13      VAL  46   0.403 -17.428  -3.119
  335   1HG2  VAL  46          HG21      VAL  46   3.674 -15.516  -3.138
  336   2HG2  VAL  46          HG22      VAL  46   2.566 -16.365  -4.212
  337   3HG2  VAL  46          HG23      VAL  46   3.470 -17.262  -2.996
  338    H    LEU  47           H        LEU  47   0.968 -12.756  -3.976
  339    HA   LEU  47           HA       LEU  47  -0.801 -14.041  -5.917
  340   1HB   LEU  47          HB2       LEU  47  -0.308 -11.103  -5.478
  341   2HB   LEU  47          HB1       LEU  47  -1.510 -11.804  -6.543
  342    HG   LEU  47           HG       LEU  47  -1.486 -12.020  -3.526
  343   1HD1  LEU  47          HD11      LEU  47  -3.260 -10.441  -5.361
  344   2HD1  LEU  47          HD12      LEU  47  -2.047  -9.800  -4.247
  345   3HD1  LEU  47          HD13      LEU  47  -3.478 -10.618  -3.622
  346   1HD2  LEU  47          HD21      LEU  47  -3.512 -13.016  -5.530
  347   2HD2  LEU  47          HD22      LEU  47  -3.726 -12.994  -3.782
  348   3HD2  LEU  47          HD23      LEU  47  -2.474 -14.007  -4.497
  349    H    ASN  48           H        ASN  48   1.622 -11.412  -6.212
  350    HA   ASN  48           HA       ASN  48   3.074 -12.624  -8.314
  351   1HB   ASN  48          HB2       ASN  48   2.334 -10.955 -10.092
  352   2HB   ASN  48          HB1       ASN  48   1.133 -12.171  -9.699
  353   1HD2  ASN  48          HD21      ASN  48  -0.502 -10.864 -10.496
  354   2HD2  ASN  48          HD22      ASN  48  -1.098  -9.497  -9.628
  355    H    SER  49           H        SER  49   3.740  -9.951  -9.527
  356    HA   SER  49           HA       SER  49   5.377  -9.065  -7.302
  357   1HB   SER  49          HB2       SER  49   5.508  -8.282 -10.227
  358   2HB   SER  49          HB1       SER  49   6.712  -7.958  -8.981
  359    HG   SER  49           HG       SER  49   6.362 -10.526  -8.876
  360    H    SER  50           H        SER  50   5.379  -6.874  -6.585
  361    HA   SER  50           HA       SER  50   3.696  -4.868  -7.555
  362   1HB   SER  50          HB2       SER  50   3.038  -6.400  -5.035
  363   2HB   SER  50          HB1       SER  50   2.396  -4.818  -5.450
  364    HG   SER  50           HG       SER  50   2.174  -6.665  -7.433
  365    H    TYR  51           H        TYR  51   3.819  -3.122  -5.672
  366    HA   TYR  51           HA       TYR  51   6.546  -3.216  -4.601
  367   1HB   TYR  51          HB2       TYR  51   4.935  -1.024  -5.800
  368   2HB   TYR  51          HB1       TYR  51   6.115  -0.651  -4.564
  369    HD1  TYR  51           HD1      TYR  51   6.808  -3.309  -7.026
  370    HD2  TYR  51           HD2      TYR  51   7.269   0.789  -6.031
  371    HE1  TYR  51           HE1      TYR  51   8.524  -3.078  -8.770
  372    HE2  TYR  51           HE2      TYR  51   8.984   1.028  -7.762
  373    HH   TYR  51           HH       TYR  51  10.481  -0.246  -9.021
  374    H    VAL  52           H        VAL  52   6.860  -2.616  -2.552
  375    HA   VAL  52           HA       VAL  52   4.540  -1.837  -0.931
  376    HB   VAL  52           HB       VAL  52   5.006  -4.253  -0.608
  377   1HG1  VAL  52          HG11      VAL  52   7.677  -3.364   0.329
  378   2HG1  VAL  52          HG12      VAL  52   7.313  -4.227  -1.179
  379   3HG1  VAL  52          HG13      VAL  52   7.031  -5.006   0.377
  380   1HG2  VAL  52          HG21      VAL  52   5.829  -2.640   1.789
  381   2HG2  VAL  52          HG22      VAL  52   5.351  -4.336   1.804
  382   3HG2  VAL  52          HG23      VAL  52   4.187  -3.099   1.335
  383    H    CYS  53           H        CYS  53   4.989  -0.298   0.551
  384    HA   CYS  53           HA       CYS  53   7.608   1.012   0.516
  385   1HB   CYS  53          HB2       CYS  53   5.631   2.390   0.646
  386   2HB   CYS  53          HB1       CYS  53   5.038   1.529   2.050
  387    H    VAL  54           H        VAL  54   9.121  -0.262   1.537
  388    HA   VAL  54           HA       VAL  54   8.658  -2.110   3.551
  389    HB   VAL  54           HB       VAL  54  11.184  -0.793   3.954
  390   1HG1  VAL  54          HG11      VAL  54  12.067  -2.932   3.434
  391   2HG1  VAL  54          HG12      VAL  54  10.494  -3.373   2.770
  392   3HG1  VAL  54          HG13      VAL  54  10.658  -3.093   4.526
  393   1HG2  VAL  54          HG21      VAL  54  10.452  -1.446   1.132
  394   2HG2  VAL  54          HG22      VAL  54  12.111  -1.437   1.710
  395   3HG2  VAL  54          HG23      VAL  54  11.138   0.027   1.783
  396    H    GLU  55           H        GLU  55   9.116   1.274   3.654
  397    HA   GLU  55           HA       GLU  55   9.827   1.669   6.312
  398   1HB   GLU  55          HB2       GLU  55   8.161   3.548   4.645
  399   2HB   GLU  55          HB1       GLU  55   9.233   3.966   5.972
  400   1HG   GLU  55          HG2       GLU  55  10.143   2.817   3.340
  401   2HG   GLU  55          HG1       GLU  55  10.105   4.529   3.731
  402    H    CYS  56           H        CYS  56   6.801   1.386   4.683
  403    HA   CYS  56           HA       CYS  56   5.291   1.771   7.212
  404   1HB   CYS  56          HB2       CYS  56   4.262   1.598   4.409
  405   2HB   CYS  56          HB1       CYS  56   3.373   2.159   5.820
  406    H    ASN  57           H        ASN  57   6.382  -0.562   5.107
  407    HA   ASN  57           HA       ASN  57   5.782  -2.514   4.311
  408   1HB   ASN  57          HB2       ASN  57   5.253  -2.704   7.196
  409   2HB   ASN  57          HB1       ASN  57   4.828  -4.117   6.191
  410   1HD2  ASN  57          HD21      ASN  57   7.099  -3.656   4.362
  411   2HD2  ASN  57          HD22      ASN  57   8.458  -4.166   5.270
  412    H    PHE  58           H        PHE  58   4.289  -1.319   3.001
  413    HA   PHE  58           HA       PHE  58   1.632  -2.474   3.300
  414   1HB   PHE  58          HB2       PHE  58   0.420  -0.534   3.395
  415   2HB   PHE  58          HB1       PHE  58   1.904   0.168   4.009
  416    HD1  PHE  58           HD1      PHE  58  -0.375  -0.089   1.190
  417    HD2  PHE  58           HD2      PHE  58   3.172   1.701   2.602
  418    HE1  PHE  58           HE1      PHE  58  -0.511   1.579  -0.651
  419    HE2  PHE  58           HE2      PHE  58   3.046   3.405   0.726
  420    HZ   PHE  58           HZ       PHE  58   1.209   3.300  -0.871
  421    H    LEU  59           H        LEU  59   0.951  -3.336   1.527
  422    HA   LEU  59           HA       LEU  59   2.584  -3.043  -0.859
  423   1HB   LEU  59          HB2       LEU  59   1.045  -5.180   0.382
  424   2HB   LEU  59          HB1       LEU  59   0.760  -5.039  -1.334
  425    HG   LEU  59           HG       LEU  59   3.478  -5.373  -0.098
  426   1HD1  LEU  59          HD11      LEU  59   1.657  -7.353  -1.469
  427   2HD1  LEU  59          HD12      LEU  59   1.962  -7.292   0.260
  428   3HD1  LEU  59          HD13      LEU  59   3.277  -7.707  -0.844
  429   1HD2  LEU  59          HD21      LEU  59   4.119  -5.935  -2.429
  430   2HD2  LEU  59          HD22      LEU  59   3.542  -4.289  -2.296
  431   3HD2  LEU  59          HD23      LEU  59   2.502  -5.531  -2.974
  432    H    THR  60           H        THR  60   1.752  -2.165  -2.639
  433    HA   THR  60           HA       THR  60  -1.121  -1.803  -2.785
  434    HB   THR  60           HB       THR  60  -0.335   0.329  -2.160
  435    HG1  THR  60           HG1      THR  60  -1.666   0.932  -3.662
  436   1HG2  THR  60          HG21      THR  60   1.586   1.478  -3.137
  437   2HG2  THR  60          HG22      THR  60   1.808   0.167  -4.287
  438   3HG2  THR  60          HG23      THR  60   2.058  -0.116  -2.573
  439    H    LYS  61           H        LYS  61  -1.867  -1.564  -5.003
  440    HA   LYS  61           HA       LYS  61  -0.689  -3.669  -6.537
  441   1HB   LYS  61          HB2       LYS  61  -3.144  -3.333  -6.268
  442   2HB   LYS  61          HB1       LYS  61  -3.017  -1.895  -7.267
  443   1HG   LYS  61          HG2       LYS  61  -2.293  -3.240  -9.154
  444   2HG   LYS  61          HG1       LYS  61  -2.333  -4.695  -8.157
  445   1HD   LYS  61          HD2       LYS  61  -4.751  -4.334  -7.784
  446   2HD   LYS  61          HD1       LYS  61  -4.684  -2.942  -8.867
  447   1HE   LYS  61          HE2       LYS  61  -3.967  -4.416 -10.696
  448   2HE   LYS  61          HE1       LYS  61  -4.023  -5.794  -9.605
  449   1HZ   LYS  61          HZ1       LYS  61  -6.028  -5.691 -10.937
  450   2HZ   LYS  61          HZ2       LYS  61  -6.333  -4.123 -10.418
  451   3HZ   LYS  61          HZ3       LYS  61  -6.418  -5.387  -9.325
  452    H    ARG  62           H        ARG  62  -0.597  -0.216  -6.680
  453    HA   ARG  62           HA       ARG  62   0.786  -0.490  -9.261
  454   1HB   ARG  62          HB2       ARG  62   0.145   1.705  -9.953
  455   2HB   ARG  62          HB1       ARG  62  -1.311   0.907  -9.406
  456   1HG   ARG  62          HG2       ARG  62   0.262   2.850  -7.727
  457   2HG   ARG  62          HG1       ARG  62  -1.043   3.337  -8.792
  458   1HD   ARG  62          HD2       ARG  62  -1.277   1.461  -6.435
  459   2HD   ARG  62          HD1       ARG  62  -1.747   3.167  -6.507
  460    HE   ARG  62           HE       ARG  62  -3.008   1.565  -8.522
  461   1HH1  ARG  62          HH11      ARG  62  -3.243   2.516  -5.108
  462   2HH1  ARG  62          HH12      ARG  62  -4.888   2.363  -5.028
  463   1HH2  ARG  62          HH21      ARG  62  -5.340   1.365  -8.414
  464   2HH2  ARG  62          HH22      ARG  62  -6.111   1.768  -6.944
  465    H    TYR  63           H        TYR  63   2.743   0.517  -9.570
  466    HA   TYR  63           HA       TYR  63   4.359   0.772  -7.262
  467   1HB   TYR  63          HB2       TYR  63   6.189   1.233  -8.757
  468   2HB   TYR  63          HB1       TYR  63   5.167   0.049  -9.553
  469    HD1  TYR  63           HD1      TYR  63   6.722   3.270  -9.791
  470    HD2  TYR  63           HD2      TYR  63   3.565   0.897 -11.371
  471    HE1  TYR  63           HE1      TYR  63   6.599   4.756 -11.738
  472    HE2  TYR  63           HE2      TYR  63   3.438   2.377 -13.329
  473    HH   TYR  63           HH       TYR  63   4.007   4.738 -13.841
  474    H    ASP  64           H        ASP  64   2.391   2.915  -8.929
  475    HA   ASP  64           HA       ASP  64   3.676   5.420  -8.649
  476   1HB   ASP  64          HB2       ASP  64   0.709   4.942  -8.662
  477   2HB   ASP  64          HB1       ASP  64   1.571   6.399  -9.142
  478    H    ALA  65           H        ALA  65   1.630   3.615  -6.418
  479    HA   ALA  65           HA       ALA  65   1.035   5.793  -4.685
  480   1HB   ALA  65          HB1       ALA  65  -0.297   3.813  -4.640
  481   2HB   ALA  65          HB2       ALA  65   0.508   3.928  -3.066
  482   3HB   ALA  65          HB3       ALA  65   1.115   2.836  -4.321
  483    H    LEU  66           H        LEU  66   3.766   3.770  -5.047
  484    HA   LEU  66           HA       LEU  66   4.969   4.482  -2.540
  485   1HB   LEU  66          HB2       LEU  66   6.229   3.165  -4.928
  486   2HB   LEU  66          HB1       LEU  66   6.936   3.301  -3.339
  487    HG   LEU  66           HG       LEU  66   6.222   1.131  -3.518
  488   1HD1  LEU  66          HD11      LEU  66   5.607   2.137  -1.398
  489   2HD1  LEU  66          HD12      LEU  66   4.456   0.874  -1.859
  490   3HD1  LEU  66          HD13      LEU  66   4.032   2.574  -2.069
  491   1HD2  LEU  66          HD21      LEU  66   4.000   0.435  -4.245
  492   2HD2  LEU  66          HD22      LEU  66   4.864   1.378  -5.474
  493   3HD2  LEU  66          HD23      LEU  66   3.589   2.133  -4.528
  494    H    SER  67           H        SER  67   4.947   5.560  -5.759
  495    HA   SER  67           HA       SER  67   7.379   7.126  -5.675
  496   1HB   SER  67          HB2       SER  67   6.084   6.063  -7.699
  497   2HB   SER  67          HB1       SER  67   5.124   7.509  -7.605
  498    HG   SER  67           HG       SER  67   7.927   7.674  -7.704
  499    H    GLU  68           H        GLU  68   3.926   7.675  -5.493
  500    HA   GLU  68           HA       GLU  68   4.154  10.499  -4.927
  501   1HB   GLU  68          HB2       GLU  68   1.775   9.064  -3.950
  502   2HB   GLU  68          HB1       GLU  68   1.881  10.579  -4.833
  503   1HG   GLU  68          HG2       GLU  68   2.480   9.162  -6.873
  504   2HG   GLU  68          HG1       GLU  68   2.108   7.810  -5.891
  505    H    HIS  69           H        HIS  69   4.393   7.679  -3.200
  506    HA   HIS  69           HA       HIS  69   3.481   8.221  -0.652
  507   1HB   HIS  69          HB2       HIS  69   4.510   6.115  -1.651
  508   2HB   HIS  69          HB1       HIS  69   6.043   6.771  -1.023
  509    HD1  HIS  69           HD1      HIS  69   2.558   6.016   0.304
  510    HD2  HIS  69           HD2      HIS  69   6.536   5.854   1.321
  511    HE1  HIS  69           HE1      HIS  69   2.617   5.053   2.632
  512    H    ASN  70           H        ASN  70   6.924   8.723  -1.613
  513    HA   ASN  70           HA       ASN  70   7.466  10.314   0.705
  514   1HB   ASN  70          HB2       ASN  70   9.630  10.780  -0.404
  515   2HB   ASN  70          HB1       ASN  70   9.280   9.069  -0.240
  516   1HD2  ASN  70          HD21      ASN  70  11.101  10.099  -1.856
  517   2HD2  ASN  70          HD22      ASN  70  10.688   9.781  -3.525
  518    H    LEU  71           H        LEU  71   5.860  10.994  -2.053
  519    HA   LEU  71           HA       LEU  71   6.526  13.785  -2.132
  520   1HB   LEU  71          HB2       LEU  71   5.907  13.060  -4.233
  521   2HB   LEU  71          HB1       LEU  71   4.771  11.902  -3.601
  522    HG   LEU  71           HG       LEU  71   3.128  13.594  -3.299
  523   1HD1  LEU  71          HD11      LEU  71   3.503  15.925  -4.185
  524   2HD1  LEU  71          HD12      LEU  71   5.189  15.506  -4.489
  525   3HD1  LEU  71          HD13      LEU  71   4.583  15.564  -2.838
  526   1HD2  LEU  71          HD21      LEU  71   2.724  14.156  -5.668
  527   2HD2  LEU  71          HD22      LEU  71   3.192  12.478  -5.409
  528   3HD2  LEU  71          HD23      LEU  71   4.367  13.633  -6.037
  529    H    LYS  72           H        LYS  72   3.783  11.836  -1.069
  530    HA   LYS  72           HA       LYS  72   2.830  14.178   0.389
  531   1HB   LYS  72          HB2       LYS  72   0.662  12.518   0.349
  532   2HB   LYS  72          HB1       LYS  72   0.905  13.894  -0.743
  533   1HG   LYS  72          HG2       LYS  72   2.066  12.155  -2.218
  534   2HG   LYS  72          HG1       LYS  72   1.370  10.950  -1.185
  535   1HD   LYS  72          HD2       LYS  72  -0.154  13.031  -2.754
  536   2HD   LYS  72          HD1       LYS  72  -0.079  11.296  -3.073
  537   1HE   LYS  72          HE2       LYS  72  -1.244  10.847  -0.962
  538   2HE   LYS  72          HE1       LYS  72  -1.252  12.565  -0.599
  539   1HZ   LYS  72          HZ1       LYS  72  -2.621  11.332  -2.921
  540   2HZ   LYS  72          HZ2       LYS  72  -2.661  12.955  -2.478
  541   3HZ   LYS  72          HZ3       LYS  72  -3.377  11.809  -1.488
  542    H    TYR  73           H        TYR  73   3.363  10.822   0.761
  543    HA   TYR  73           HA       TYR  73   2.323  10.686   3.455
  544   1HB   TYR  73          HB2       TYR  73   3.781   8.722   1.732
  545   2HB   TYR  73          HB1       TYR  73   3.226   8.331   3.359
  546    HD1  TYR  73           HD1      TYR  73   1.803   9.878   0.273
  547    HD2  TYR  73           HD2      TYR  73   1.328   7.038   3.375
  548    HE1  TYR  73           HE1      TYR  73  -0.284   9.187  -0.711
  549    HE2  TYR  73           HE2      TYR  73  -0.777   6.318   2.406
  550    HH   TYR  73           HH       TYR  73  -2.551   7.473   0.948
  551    H    HIS  74           H        HIS  74   5.551  10.190   1.970
  552    HA   HIS  74           HA       HIS  74   6.748  11.039   4.577
  553   1HB   HIS  74          HB2       HIS  74   8.006   9.349   2.390
  554   2HB   HIS  74          HB1       HIS  74   8.849   9.868   3.834
  555    HD1  HIS  74           HD1      HIS  74   8.650   8.234   5.873
  556    HD2  HIS  74           HD2      HIS  74   6.187   7.336   2.676
  557    HE1  HIS  74           HE1      HIS  74   7.884   5.878   6.270
  558    HA   PRO  75           HA       PRO  75   7.657  14.160   1.222
  559   1HB   PRO  75          HB2       PRO  75   6.910  16.364   2.507
  560   2HB   PRO  75          HB1       PRO  75   5.723  15.316   1.711
  561   1HG   PRO  75          HG2       PRO  75   6.491  15.387   4.628
  562   2HG   PRO  75          HG1       PRO  75   4.867  15.324   3.900
  563   1HD   PRO  75          HD2       PRO  75   6.115  13.121   4.849
  564   2HD   PRO  75          HD1       PRO  75   5.024  13.110   3.455
  565    H    GLY  76           H        GLY  76   9.327  15.488   0.950
  566   1HA   GLY  76          HA2       GLY  76  10.763  17.080   2.473
  567   2HA   GLY  76          HA1       GLY  76  11.331  15.524   3.062
  568    H    GLU  77           H        GLU  77  11.435  14.056   0.800
  569    HA   GLU  77           HA       GLU  77  13.008  15.430  -1.184
  570   1HB   GLU  77          HB2       GLU  77  14.984  13.951  -0.867
  571   2HB   GLU  77          HB1       GLU  77  14.726  15.017   0.501
  572   1HG   GLU  77          HG2       GLU  77  15.031  13.134   1.733
  573   2HG   GLU  77          HG1       GLU  77  13.358  12.822   1.253
  574    H    GLU  78           H        GLU  78  13.803  13.616  -2.795
  575    HA   GLU  78           HA       GLU  78  11.755  11.531  -2.806
  576   1HB   GLU  78          HB2       GLU  78  11.138  13.399  -4.342
  577   2HB   GLU  78          HB1       GLU  78  12.660  13.051  -5.188
  578   1HG   GLU  78          HG2       GLU  78  11.888  10.846  -5.742
  579   2HG   GLU  78          HG1       GLU  78  10.395  11.098  -4.843
  580    H    ASN  79           H        ASN  79  13.318  10.094  -2.099
  581    HA   ASN  79           HA       ASN  79  15.016   9.064  -4.238
  582   1HB   ASN  79          HB2       ASN  79  15.903   9.755  -1.454
  583   2HB   ASN  79          HB1       ASN  79  16.896   8.801  -2.573
  584   1HD2  ASN  79          HD21      ASN  79  15.596  11.824  -1.773
  585   2HD2  ASN  79          HD22      ASN  79  16.432  12.859  -2.885
  586    H    PHE  80           H        PHE  80  13.628   7.397  -4.318
  587    HA   PHE  80           HA       PHE  80  13.433   5.685  -1.955
  588   1HB   PHE  80          HB2       PHE  80  11.602   6.343  -4.119
  589   2HB   PHE  80          HB1       PHE  80  11.807   4.616  -3.923
  590    HD1  PHE  80           HD1      PHE  80  11.594   3.773  -1.427
  591    HD2  PHE  80           HD2      PHE  80   9.982   7.406  -2.888
  592    HE1  PHE  80           HE1      PHE  80   9.871   3.697   0.301
  593    HE2  PHE  80           HE2      PHE  80   8.279   7.361  -1.111
  594    HZ   PHE  80           HZ       PHE  80   8.217   5.486   0.466
  595    H    LYS  81           H        LYS  81  14.130   3.640  -2.073
  596    HA   LYS  81           HA       LYS  81  15.723   2.917  -4.442
  597   1HB   LYS  81          HB2       LYS  81  17.353   2.103  -3.002
  598   2HB   LYS  81          HB1       LYS  81  16.565   3.262  -1.917
  599   1HG   LYS  81          HG2       LYS  81  15.277   1.585  -0.887
  600   2HG   LYS  81          HG1       LYS  81  15.810   0.376  -2.045
  601   1HD   LYS  81          HD2       LYS  81  18.170   0.916  -1.213
  602   2HD   LYS  81          HD1       LYS  81  17.325   1.684   0.146
  603   1HE   LYS  81          HE2       LYS  81  16.109  -0.384   0.551
  604   2HE   LYS  81          HE1       LYS  81  16.974  -1.133  -0.786
  605   1HZ   LYS  81          HZ1       LYS  81  17.935  -1.677   1.404
  606   2HZ   LYS  81          HZ2       LYS  81  18.285  -0.039   1.655
  607   3HZ   LYS  81          HZ3       LYS  81  19.038  -0.880   0.413
  608    H    LEU  82           H        LEU  82  15.758   0.391  -4.684
  609    HA   LEU  82           HA       LEU  82  13.218  -0.666  -3.788
  610   1HB   LEU  82          HB2       LEU  82  12.837  -1.747  -5.969
  611   2HB   LEU  82          HB1       LEU  82  12.788  -0.006  -6.073
  612    HG   LEU  82           HG       LEU  82  15.245  -1.550  -6.805
  613   1HD1  LEU  82          HD11      LEU  82  12.927  -0.734  -8.608
  614   2HD1  LEU  82          HD12      LEU  82  13.321  -2.387  -8.148
  615   3HD1  LEU  82          HD13      LEU  82  14.434  -1.465  -9.161
  616   1HD2  LEU  82          HD21      LEU  82  14.203   1.153  -7.673
  617   2HD2  LEU  82          HD22      LEU  82  15.704   0.413  -8.225
  618   3HD2  LEU  82          HD23      LEU  82  15.509   0.858  -6.529
  619    H    THR  83           H        THR  83  13.352  -2.606  -2.948
  620    HA   THR  83           HA       THR  83  15.673  -4.218  -3.526
  621    HB   THR  83           HB       THR  83  16.247  -2.997  -1.551
  622    HG1  THR  83           HG1      THR  83  16.454  -4.659  -0.013
  623   1HG2  THR  83          HG21      THR  83  14.932  -2.998   0.538
  624   2HG2  THR  83          HG22      THR  83  13.675  -3.929  -0.280
  625   3HG2  THR  83          HG23      THR  83  14.027  -2.282  -0.804
  626    H    MET  84           H        MET  84  14.802  -6.317  -4.079
  627    HA   MET  84           HA       MET  84  11.977  -6.630  -3.318
  628   1HB   MET  84          HB2       MET  84  12.659  -7.000  -5.685
  629   2HB   MET  84          HB1       MET  84  13.716  -8.284  -5.105
  630   1HG   MET  84          HG2       MET  84  11.764  -9.520  -4.292
  631   2HG   MET  84          HG1       MET  84  10.710  -8.255  -4.926
  632   1HE   MET  84          HE1       MET  84  14.013  -9.757  -6.511
  633   2HE   MET  84          HE2       MET  84  13.333 -11.010  -7.537
  634   3HE   MET  84          HE3       MET  84  13.210 -11.149  -5.782
  635    H    VAL  85           H        VAL  85  11.886  -7.323  -1.348
  636    HA   VAL  85           HA       VAL  85  12.770 -10.000  -0.878
  637    HB   VAL  85           HB       VAL  85  13.413  -9.141   1.573
  638   1HG1  VAL  85          HG11      VAL  85  15.256  -8.840  -0.800
  639   2HG1  VAL  85          HG12      VAL  85  14.943 -10.338   0.068
  640   3HG1  VAL  85          HG13      VAL  85  15.782  -9.010   0.877
  641   1HG2  VAL  85          HG21      VAL  85  14.086  -6.741  -0.152
  642   2HG2  VAL  85          HG22      VAL  85  14.598  -6.969   1.518
  643   3HG2  VAL  85          HG23      VAL  85  12.883  -6.771   1.136
  644    H    LYS  86           H        LYS  86  10.703 -10.843  -0.553
  645    HA   LYS  86           HA       LYS  86   9.357  -9.593   1.692
  646   1HB   LYS  86          HB2       LYS  86   8.302  -8.877  -0.581
  647   2HB   LYS  86          HB1       LYS  86   7.663 -10.539  -0.599
  648   1HG   LYS  86          HG2       LYS  86   6.035  -9.042   0.164
  649   2HG   LYS  86          HG1       LYS  86   6.511 -10.145   1.446
  650   1HD   LYS  86          HD2       LYS  86   7.710  -8.547   2.644
  651   2HD   LYS  86          HD1       LYS  86   7.952  -7.525   1.234
  652   1HE   LYS  86          HE2       LYS  86   5.757  -6.581   1.448
  653   2HE   LYS  86          HE1       LYS  86   5.238  -7.836   2.575
  654   1HZ   LYS  86          HZ1       LYS  86   5.771  -5.748   3.618
  655   2HZ   LYS  86          HZ2       LYS  86   7.383  -5.853   3.014
  656   3HZ   LYS  86          HZ3       LYS  86   6.810  -6.974   4.135
  657    H    ARG  87           H        ARG  87   9.259 -11.062   3.161
  658    HA   ARG  87           HA       ARG  87   9.392 -13.769   2.173
  659   1HB   ARG  87          HB2       ARG  87  10.428 -12.642   4.791
  660   2HB   ARG  87          HB1       ARG  87  10.553 -14.312   4.269
  661   1HG   ARG  87          HG2       ARG  87  12.698 -13.407   3.807
  662   2HG   ARG  87          HG1       ARG  87  11.855 -13.431   2.258
  663   1HD   ARG  87          HD2       ARG  87  13.052 -11.337   2.449
  664   2HD   ARG  87          HD1       ARG  87  11.326 -11.024   2.523
  665    HE   ARG  87           HE       ARG  87  12.679 -11.289   5.063
  666   1HH1  ARG  87          HH11      ARG  87  11.420  -8.914   2.643
  667   2HH1  ARG  87          HH12      ARG  87  11.614  -7.607   3.656
  668   1HH2  ARG  87          HH21      ARG  87  12.893  -9.395   6.431
  669   2HH2  ARG  87          HH22      ARG  87  12.457  -7.853   5.866
  670    H    ASN  88           H        ASN  88   8.172 -15.374   3.215
  671    HA   ASN  88           HA       ASN  88   6.372 -16.320   4.231
  672   1HB   ASN  88          HB2       ASN  88   6.155 -13.725   5.792
  673   2HB   ASN  88          HB1       ASN  88   5.202 -15.162   6.118
  674   1HD2  ASN  88          HD21      ASN  88   7.093 -13.663   7.729
  675   2HD2  ASN  88          HD22      ASN  88   8.285 -14.775   8.269
  676    H    ASN  89           H        ASN  89   6.349 -14.305   2.010
  677    HA   ASN  89           HA       ASN  89   3.468 -14.251   1.518
  678   1HB   ASN  89          HB2       ASN  89   5.247 -11.773   1.356
  679   2HB   ASN  89          HB1       ASN  89   3.614 -11.866   0.740
  680   1HD2  ASN  89          HD21      ASN  89   5.601 -11.495   3.528
  681   2HD2  ASN  89          HD22      ASN  89   4.321 -11.092   4.618
  682    H    GLN  90           H        GLN  90   4.071 -12.444  -0.810
  683    HA   GLN  90           HA       GLN  90   5.407 -14.375  -2.522
  684   1HB   GLN  90          HB2       GLN  90   4.647 -12.943  -4.335
  685   2HB   GLN  90          HB1       GLN  90   3.254 -13.418  -3.333
  686   1HG   GLN  90          HG2       GLN  90   4.673 -10.848  -3.143
  687   2HG   GLN  90          HG1       GLN  90   3.337 -11.097  -4.274
  688   1HE2  GLN  90          HE21      GLN  90   4.276 -10.481  -1.043
  689   2HE2  GLN  90          HE22      GLN  90   2.675 -10.407  -0.381
  690    H    THR  91           H        THR  91   6.936 -13.250  -4.153
  691    HA   THR  91           HA       THR  91   8.482 -11.419  -2.568
  692    HB   THR  91           HB       THR  91  10.222 -11.877  -4.483
  693    HG1  THR  91           HG1      THR  91   9.658 -13.332  -5.857
  694   1HG2  THR  91          HG21      THR  91   9.489 -14.031  -2.464
  695   2HG2  THR  91          HG22      THR  91  10.493 -12.640  -2.118
  696   3HG2  THR  91          HG23      THR  91  11.051 -13.864  -3.251
  697    H    ILE  92           H        ILE  92   8.158  -9.519  -2.804
  698    HA   ILE  92           HA       ILE  92   7.470  -8.279  -5.293
  699    HB   ILE  92           HB       ILE  92   5.964  -6.729  -3.909
  700   1HG1  ILE  92          HG12      ILE  92   4.811  -8.170  -2.041
  701   2HG1  ILE  92          HG11      ILE  92   6.374  -8.939  -2.019
  702   1HG2  ILE  92          HG21      ILE  92   5.134  -9.527  -4.513
  703   2HG2  ILE  92          HG22      ILE  92   4.963  -8.080  -5.516
  704   3HG2  ILE  92          HG23      ILE  92   4.024  -8.246  -4.045
  705   1HD1  ILE  92          HD11      ILE  92   7.531  -6.920  -1.594
  706   2HD1  ILE  92          HD12      ILE  92   6.258  -7.109  -0.394
  707   3HD1  ILE  92          HD13      ILE  92   6.058  -5.980  -1.731
  708    H    PHE  93           H        PHE  93   7.870  -5.897  -5.215
  709    HA   PHE  93           HA       PHE  93  10.607  -5.748  -4.250
  710   1HB   PHE  93          HB2       PHE  93   8.984  -3.884  -5.975
  711   2HB   PHE  93          HB1       PHE  93  10.698  -3.737  -5.663
  712    HD1  PHE  93           HD1      PHE  93   8.099  -5.570  -7.467
  713    HD2  PHE  93           HD2      PHE  93  12.256  -5.145  -6.768
  714    HE1  PHE  93           HE1      PHE  93   8.552  -6.899  -9.489
  715    HE2  PHE  93           HE2      PHE  93  12.735  -6.481  -8.796
  716    HZ   PHE  93           HZ       PHE  93  10.872  -7.354 -10.154
  717    H    GLU  94           H        GLU  94  11.045  -4.671  -2.437
  718    HA   GLU  94           HA       GLU  94   8.994  -3.034  -1.266
  719   1HB   GLU  94          HB2       GLU  94  11.633  -3.957  -0.058
  720   2HB   GLU  94          HB1       GLU  94  10.289  -3.203   0.773
  721   1HG   GLU  94          HG2       GLU  94   8.993  -5.264  -0.107
  722   2HG   GLU  94          HG1       GLU  94  10.590  -6.012  -0.109
  723    H    GLN  95           H        GLN  95   9.359  -0.929  -0.927
  724    HA   GLN  95           HA       GLN  95  11.739   0.162  -2.260
  725   1HB   GLN  95          HB2       GLN  95   9.385   0.352  -3.359
  726   2HB   GLN  95          HB1       GLN  95   9.072   1.561  -2.120
  727   1HG   GLN  95          HG2       GLN  95  10.874   2.912  -2.903
  728   2HG   GLN  95          HG1       GLN  95  11.393   1.649  -4.010
  729   1HE2  GLN  95          HE21      GLN  95   9.134   4.188  -3.388
  730   2HE2  GLN  95          HE22      GLN  95   8.484   4.250  -4.984
  731    H    THR  96           H        THR  96  13.070   1.039  -0.756
  732    HA   THR  96           HA       THR  96  11.901   2.205   1.682
  733    HB   THR  96           HB       THR  96  14.735   1.868   1.836
  734    HG1  THR  96           HG1      THR  96  14.369  -0.608   1.810
  735   1HG2  THR  96          HG21      THR  96  14.123   0.428   3.775
  736   2HG2  THR  96          HG22      THR  96  12.440   0.473   3.248
  737   3HG2  THR  96          HG23      THR  96  13.220   1.941   3.766
  738    H    ILE  97           H        ILE  97  13.029   4.080   2.530
  739    HA   ILE  97           HA       ILE  97  14.118   5.802   0.386
  740    HB   ILE  97           HB       ILE  97  13.124   6.723   3.099
  741   1HG1  ILE  97          HG12      ILE  97  11.387   6.713   0.674
  742   2HG1  ILE  97          HG11      ILE  97  11.446   5.262   1.643
  743   1HG2  ILE  97          HG21      ILE  97  13.152   8.024   0.365
  744   2HG2  ILE  97          HG22      ILE  97  14.446   8.184   1.541
  745   3HG2  ILE  97          HG23      ILE  97  12.848   8.806   1.926
  746   1HD1  ILE  97          HD11      ILE  97  10.337   7.968   2.304
  747   2HD1  ILE  97          HD12      ILE  97  10.787   6.825   3.578
  748   3HD1  ILE  97          HD13      ILE  97   9.575   6.375   2.402
  749    H    ASN  98           H        ASN  98  15.892   7.017   0.938
  750    HA   ASN  98           HA       ASN  98  17.652   5.681   2.828
  751   1HB   ASN  98          HB2       ASN  98  19.400   7.130   1.656
  752   2HB   ASN  98          HB1       ASN  98  18.655   5.867   0.675
  753   1HD2  ASN  98          HD21      ASN  98  17.191   9.031   1.498
  754   2HD2  ASN  98          HD22      ASN  98  17.151   9.598  -0.095
  755    H    ASP  99           H        ASP  99  15.458   7.914   3.263
  756    HA   ASP  99           HA       ASP  99  17.067   9.483   5.104
  757   1HB   ASP  99          HB2       ASP  99  17.245  10.418   2.738
  758   2HB   ASP  99          HB1       ASP  99  15.608  10.960   2.990
  759    H    LEU 100           H        LEU 100  13.957   9.453   3.375
  760    HA   LEU 100           HA       LEU 100  12.492  10.651   5.565
  761   1HB   LEU 100          HB2       LEU 100  11.359   9.272   3.128
  762   2HB   LEU 100          HB1       LEU 100  10.641  10.464   4.173
  763    HG   LEU 100           HG       LEU 100  13.061  11.322   2.745
  764   1HD1  LEU 100          HD11      LEU 100  10.379  10.766   1.493
  765   2HD1  LEU 100          HD12      LEU 100  11.966  10.157   0.970
  766   3HD1  LEU 100          HD13      LEU 100  11.577  11.850   0.794
  767   1HD2  LEU 100          HD21      LEU 100  11.721  12.734   4.308
  768   2HD2  LEU 100          HD22      LEU 100  10.368  12.568   3.150
  769   3HD2  LEU 100          HD23      LEU 100  11.847  13.361   2.661
  770    H    THR 101           H        THR 101  13.870   7.970   5.672
  771    HA   THR 101           HA       THR 101  12.245   5.765   5.830
  772    HB   THR 101           HB       THR 101  14.631   6.395   7.561
  773    HG1  THR 101           HG1      THR 101  14.707   5.464   4.891
  774   1HG2  THR 101          HG21      THR 101  15.190   4.052   7.110
  775   2HG2  THR 101          HG22      THR 101  13.771   3.899   6.086
  776   3HG2  THR 101          HG23      THR 101  13.577   4.154   7.826
  777    H    PHE 102           H        PHE 102  12.601   8.448   7.988
  778    HA   PHE 102           HA       PHE 102  11.600   7.232  10.355
  779   1HB   PHE 102          HB2       PHE 102  11.438   9.559  11.229
  780   2HB   PHE 102          HB1       PHE 102  13.012   9.195  10.544
  781    HD1  PHE 102           HD1      PHE 102  13.752  10.278   8.500
  782    HD2  PHE 102           HD2      PHE 102   9.963  11.162  10.179
  783    HE1  PHE 102           HE1      PHE 102  13.603  12.283   7.082
  784    HE2  PHE 102           HE2      PHE 102   9.797  13.171   8.760
  785    HZ   PHE 102           HZ       PHE 102  11.619  13.733   7.210
  Start of MODEL   10
    1    HA   MET   1           HA       MET   1 -19.454   1.336 -13.621
    2   1HB   MET   1          HB2       MET   1 -21.298  -0.989 -13.070
    3   2HB   MET   1          HB1       MET   1 -19.596  -0.963 -12.657
    4   1HG   MET   1          HG2       MET   1 -19.977   0.844 -11.105
    5   2HG   MET   1          HG1       MET   1 -21.681   0.902 -11.535
    6   1HE   MET   1          HE1       MET   1 -23.365  -1.144 -11.086
    7   2HE   MET   1          HE2       MET   1 -22.918  -2.599 -10.198
    8   3HE   MET   1          HE3       MET   1 -22.273  -2.325 -11.816
    9    H    ALA   2           H        ALA   2 -17.988   0.726 -15.057
   10    HA   ALA   2           HA       ALA   2 -18.572  -1.563 -16.741
   11   1HB   ALA   2          HB1       ALA   2 -17.566  -0.443 -18.668
   12   2HB   ALA   2          HB2       ALA   2 -17.377   1.036 -17.723
   13   3HB   ALA   2          HB3       ALA   2 -18.990   0.438 -18.111
   14    H    HIS   3           H        HIS   3 -17.276  -2.772 -15.446
   15    HA   HIS   3           HA       HIS   3 -14.532  -1.935 -14.948
   16   1HB   HIS   3          HB2       HIS   3 -16.020  -4.426 -14.065
   17   2HB   HIS   3          HB1       HIS   3 -14.383  -4.008 -13.587
   18    HD1  HIS   3           HD1      HIS   3 -17.713  -3.863 -12.282
   19    HD2  HIS   3           HD2      HIS   3 -14.435  -1.301 -12.241
   20    HE1  HIS   3           HE1      HIS   3 -18.102  -2.259 -10.394
   21    H    HIS   4           H        HIS   4 -16.317  -3.756 -17.132
   22    HA   HIS   4           HA       HIS   4 -13.977  -5.280 -17.998
   23   1HB   HIS   4          HB2       HIS   4 -16.890  -5.515 -18.808
   24   2HB   HIS   4          HB1       HIS   4 -15.591  -6.459 -19.525
   25    HD1  HIS   4           HD1      HIS   4 -14.988  -8.576 -18.356
   26    HD2  HIS   4           HD2      HIS   4 -17.315  -6.079 -16.002
   27    HE1  HIS   4           HE1      HIS   4 -15.516  -9.875 -16.253
   28    H    HIS   5           H        HIS   5 -12.964  -3.412 -18.712
   29    HA   HIS   5           HA       HIS   5 -12.373  -1.730 -20.080
   30   1HB   HIS   5          HB2       HIS   5 -13.753  -3.522 -22.072
   31   2HB   HIS   5          HB1       HIS   5 -12.987  -2.015 -22.564
   32    HD1  HIS   5           HD1      HIS   5 -10.368  -1.911 -22.386
   33    HD2  HIS   5           HD2      HIS   5 -12.050  -5.589 -21.454
   34    HE1  HIS   5           HE1      HIS   5  -8.463  -3.556 -22.344
   35    H    HIS   6           H        HIS   6 -13.614  -0.347 -22.208
   36    HA   HIS   6           HA       HIS   6 -15.042   1.329 -22.655
   37   1HB   HIS   6          HB2       HIS   6 -16.906  -0.280 -22.197
   38   2HB   HIS   6          HB1       HIS   6 -16.831   0.134 -20.497
   39    HD1  HIS   6           HD1      HIS   6 -18.568   1.824 -19.804
   40    HD2  HIS   6           HD2      HIS   6 -17.639   2.061 -23.850
   41    HE1  HIS   6           HE1      HIS   6 -20.208   3.435 -20.807
   42    H    HIS   7           H        HIS   7 -14.228   0.645 -19.441
   43    HA   HIS   7           HA       HIS   7 -12.944   3.127 -19.049
   44   1HB   HIS   7          HB2       HIS   7 -15.281   3.652 -18.269
   45   2HB   HIS   7          HB1       HIS   7 -15.193   2.284 -17.168
   46    HD1  HIS   7           HD1      HIS   7 -15.224   3.450 -14.943
   47    HD2  HIS   7           HD2      HIS   7 -12.470   5.082 -17.567
   48    HE1  HIS   7           HE1      HIS   7 -13.942   5.161 -13.624
   49    H    HIS   8           H        HIS   8 -11.302   1.502 -19.216
   50    HA   HIS   8           HA       HIS   8 -11.348  -0.795 -17.472
   51   1HB   HIS   8          HB2       HIS   8 -10.418  -0.868 -19.805
   52   2HB   HIS   8          HB1       HIS   8  -9.109   0.175 -19.268
   53    HD1  HIS   8           HD1      HIS   8  -7.096  -0.993 -18.164
   54    HD2  HIS   8           HD2      HIS   8 -10.390  -3.470 -18.667
   55    HE1  HIS   8           HE1      HIS   8  -6.294  -3.316 -17.667
   56    H    ASN   9           H        ASN   9  -9.053   1.889 -17.907
   57    HA   ASN   9           HA       ASN   9  -8.019   1.309 -15.262
   58   1HB   ASN   9          HB2       ASN   9  -6.453   1.891 -17.143
   59   2HB   ASN   9          HB1       ASN   9  -7.138   3.514 -17.142
   60   1HD2  ASN   9          HD21      ASN   9  -5.165   4.434 -16.596
   61   2HD2  ASN   9          HD22      ASN   9  -4.483   4.289 -15.025
   62    H    GLN  10           H        GLN  10  -9.468   1.882 -13.885
   63    HA   GLN  10           HA       GLN  10 -11.007   4.319 -14.241
   64   1HB   GLN  10          HB2       GLN  10 -11.212   2.282 -12.045
   65   2HB   GLN  10          HB1       GLN  10 -12.414   3.472 -12.529
   66   1HG   GLN  10          HG2       GLN  10 -12.605   2.347 -14.702
   67   2HG   GLN  10          HG1       GLN  10 -11.485   1.114 -14.136
   68   1HE2  GLN  10          HE21      GLN  10 -14.142   0.803 -15.036
   69   2HE2  GLN  10          HE22      GLN  10 -15.047   0.131 -13.734
   70    H    GLN  11           H        GLN  11  -8.404   3.085 -12.414
   71    HA   GLN  11           HA       GLN  11  -6.972   3.906 -10.897
   72   1HB   GLN  11          HB2       GLN  11  -8.467   6.559 -11.034
   73   2HB   GLN  11          HB1       GLN  11  -6.883   6.308 -10.323
   74   1HG   GLN  11          HG2       GLN  11  -7.551   6.010 -13.257
   75   2HG   GLN  11          HG1       GLN  11  -6.797   7.420 -12.531
   76   1HE2  GLN  11          HE21      GLN  11  -5.006   7.218 -13.863
   77   2HE2  GLN  11          HE22      GLN  11  -3.815   5.989 -13.664
   78    H    ASN  12           H        ASN  12 -10.236   4.976 -10.339
   79    HA   ASN  12           HA       ASN  12 -11.751   4.699  -8.741
   80   1HB   ASN  12          HB2       ASN  12 -10.045   2.384  -7.772
   81   2HB   ASN  12          HB1       ASN  12 -11.718   2.682  -7.329
   82   1HD2  ASN  12          HD21      ASN  12 -13.341   2.278  -8.874
   83   2HD2  ASN  12          HD22      ASN  12 -13.029   1.361 -10.301
   84    H    LYS  13           H        LYS  13  -9.472   3.501  -6.427
   85    HA   LYS  13           HA       LYS  13  -9.939   5.950  -4.951
   86   1HB   LYS  13          HB2       LYS  13 -10.275   3.665  -3.896
   87   2HB   LYS  13          HB1       LYS  13  -8.528   3.478  -3.939
   88   1HG   LYS  13          HG2       LYS  13  -8.226   5.356  -2.479
   89   2HG   LYS  13          HG1       LYS  13  -9.944   5.739  -2.534
   90   1HD   LYS  13          HD2       LYS  13 -10.358   3.450  -1.555
   91   2HD   LYS  13          HD1       LYS  13  -8.623   3.337  -1.284
   92   1HE   LYS  13          HE2       LYS  13  -9.788   4.107   0.736
   93   2HE   LYS  13          HE1       LYS  13  -8.692   5.339   0.116
   94   1HZ   LYS  13          HZ1       LYS  13 -10.502   6.568  -0.764
   95   2HZ   LYS  13          HZ2       LYS  13 -10.967   6.169   0.800
   96   3HZ   LYS  13          HZ3       LYS  13 -11.599   5.326  -0.504
   97    H    LYS  14           H        LYS  14  -7.530   4.288  -6.735
   98    HA   LYS  14           HA       LYS  14  -5.403   4.658  -7.315
   99   1HB   LYS  14          HB2       LYS  14  -6.352   6.940  -7.895
  100   2HB   LYS  14          HB1       LYS  14  -5.909   7.499  -6.307
  101   1HG   LYS  14          HG2       LYS  14  -3.911   6.574  -8.378
  102   2HG   LYS  14          HG1       LYS  14  -4.422   8.246  -8.191
  103   1HD   LYS  14          HD2       LYS  14  -3.598   8.193  -5.866
  104   2HD   LYS  14          HD1       LYS  14  -3.053   6.539  -6.126
  105   1HE   LYS  14          HE2       LYS  14  -1.184   8.002  -6.340
  106   2HE   LYS  14          HE1       LYS  14  -1.592   7.377  -7.931
  107   1HZ   LYS  14          HZ1       LYS  14  -2.639   9.487  -8.472
  108   2HZ   LYS  14          HZ2       LYS  14  -1.067   9.755  -7.855
  109   3HZ   LYS  14          HZ3       LYS  14  -2.383  10.031  -6.890
  110    H    VAL  15           H        VAL  15  -5.413   6.740  -4.642
  111    HA   VAL  15           HA       VAL  15  -4.796   5.277  -2.536
  112    HB   VAL  15           HB       VAL  15  -2.523   5.018  -4.006
  113   1HG1  VAL  15          HG11      VAL  15  -0.824   6.649  -3.422
  114   2HG1  VAL  15          HG12      VAL  15  -2.053   7.630  -2.623
  115   3HG1  VAL  15          HG13      VAL  15  -2.124   7.390  -4.373
  116   1HG2  VAL  15          HG21      VAL  15  -2.607   5.663  -1.112
  117   2HG2  VAL  15          HG22      VAL  15  -1.276   4.810  -1.915
  118   3HG2  VAL  15          HG23      VAL  15  -2.916   4.098  -1.860
  119    H    GLU  16           H        GLU  16  -4.882   6.884  -0.835
  120    HA   GLU  16           HA       GLU  16  -4.657   9.594  -1.823
  121   1HB   GLU  16          HB2       GLU  16  -6.794  10.236  -0.617
  122   2HB   GLU  16          HB1       GLU  16  -6.978   9.293  -2.088
  123   1HG   GLU  16          HG2       GLU  16  -7.234   7.273  -0.701
  124   2HG   GLU  16          HG1       GLU  16  -7.140   8.277   0.730
  125    H    GLY  17           H        GLY  17  -5.325   7.790   1.153
  126   1HA   GLY  17          HA2       GLY  17  -3.021   8.951   2.272
  127   2HA   GLY  17          HA1       GLY  17  -4.482   9.645   2.957
  128    H    GLY  18           H        GLY  18  -2.514   6.986   2.650
  129   1HA   GLY  18          HA2       GLY  18  -2.561   5.920   4.990
  130   2HA   GLY  18          HA1       GLY  18  -4.153   5.388   4.447
  131    H    TYR  19           H        TYR  19  -3.447   3.261   4.681
  132    HA   TYR  19           HA       TYR  19  -1.470   2.329   2.691
  133   1HB   TYR  19          HB2       TYR  19  -2.409   0.871   5.146
  134   2HB   TYR  19          HB1       TYR  19  -0.960   0.579   4.194
  135    HD1  TYR  19           HD1      TYR  19  -1.968   1.634   7.262
  136    HD2  TYR  19           HD2      TYR  19   0.536   2.945   4.086
  137    HE1  TYR  19           HE1      TYR  19  -0.776   3.048   8.815
  138    HE2  TYR  19           HE2      TYR  19   1.769   4.381   5.655
  139    HH   TYR  19           HH       TYR  19   1.369   5.491   7.792
  140    H    GLU  20           H        GLU  20  -2.215   1.650   1.060
  141    HA   GLU  20           HA       GLU  20  -4.887   0.580   0.946
  142   1HB   GLU  20          HB2       GLU  20  -4.120   2.088  -0.871
  143   2HB   GLU  20          HB1       GLU  20  -2.772   1.007  -1.196
  144   1HG   GLU  20          HG2       GLU  20  -4.485  -0.791  -1.642
  145   2HG   GLU  20          HG1       GLU  20  -5.696   0.476  -1.596
  146    H    CYS  21           H        CYS  21  -5.205  -1.503   0.798
  147    HA   CYS  21           HA       CYS  21  -2.997  -3.398   0.707
  148   1HB   CYS  21          HB2       CYS  21  -5.928  -3.933   0.348
  149   2HB   CYS  21          HB1       CYS  21  -4.686  -5.136   0.671
  150    H    LYS  22           H        LYS  22  -2.338  -4.354  -1.129
  151    HA   LYS  22           HA       LYS  22  -3.082  -3.427  -3.681
  152   1HB   LYS  22          HB2       LYS  22  -0.843  -4.228  -3.156
  153   2HB   LYS  22          HB1       LYS  22  -1.450  -5.828  -2.785
  154   1HG   LYS  22          HG2       LYS  22  -1.630  -4.633  -5.543
  155   2HG   LYS  22          HG1       LYS  22  -0.188  -5.468  -4.978
  156   1HD   LYS  22          HD2       LYS  22  -1.508  -7.461  -4.568
  157   2HD   LYS  22          HD1       LYS  22  -2.965  -6.640  -5.146
  158   1HE   LYS  22          HE2       LYS  22  -1.778  -6.281  -7.329
  159   2HE   LYS  22          HE1       LYS  22  -0.477  -7.290  -6.687
  160   1HZ   LYS  22          HZ1       LYS  22  -2.111  -9.096  -6.462
  161   2HZ   LYS  22          HZ2       LYS  22  -1.881  -8.608  -8.056
  162   3HZ   LYS  22          HZ3       LYS  22  -3.265  -8.128  -7.226
  163    H    TYR  23           H        TYR  23  -4.381  -5.806  -1.632
  164    HA   TYR  23           HA       TYR  23  -5.597  -7.245  -3.842
  165   1HB   TYR  23          HB2       TYR  23  -5.888  -8.722  -1.438
  166   2HB   TYR  23          HB1       TYR  23  -4.915  -9.110  -2.849
  167    HD1  TYR  23           HD1      TYR  23  -4.871  -7.888   0.588
  168    HD2  TYR  23           HD2      TYR  23  -2.476  -8.488  -2.896
  169    HE1  TYR  23           HE1      TYR  23  -2.847  -7.648   1.937
  170    HE2  TYR  23           HE2      TYR  23  -0.448  -8.255  -1.533
  171    HH   TYR  23           HH       TYR  23  -0.499  -8.375   1.829
  172    H    CYS  24           H        CYS  24  -6.523  -4.762  -2.049
  173    HA   CYS  24           HA       CYS  24  -9.245  -5.500  -2.440
  174   1HB   CYS  24          HB2       CYS  24 -10.064  -5.182  -0.153
  175   2HB   CYS  24          HB1       CYS  24  -8.839  -6.448  -0.211
  176    H    THR  25           H        THR  25 -10.720  -3.605  -1.954
  177    HA   THR  25           HA       THR  25  -9.330  -1.199  -2.791
  178    HB   THR  25           HB       THR  25 -11.420  -1.920  -3.983
  179    HG1  THR  25           HG1      THR  25 -11.427   0.569  -2.638
  180   1HG2  THR  25          HG21      THR  25 -12.686  -2.789  -2.044
  181   2HG2  THR  25          HG22      THR  25 -13.613  -1.566  -2.911
  182   3HG2  THR  25          HG23      THR  25 -12.807  -1.152  -1.401
  183    H    PHE  26           H        PHE  26  -9.481  -2.401   0.064
  184    HA   PHE  26           HA       PHE  26 -10.556  -0.057   1.417
  185   1HB   PHE  26          HB2       PHE  26  -9.907  -2.793   2.522
  186   2HB   PHE  26          HB1       PHE  26 -10.512  -1.441   3.477
  187    HD1  PHE  26           HD1      PHE  26 -11.377  -4.122   1.233
  188    HD2  PHE  26           HD2      PHE  26 -12.770  -0.525   3.009
  189    HE1  PHE  26           HE1      PHE  26 -13.678  -4.730   0.644
  190    HE2  PHE  26           HE2      PHE  26 -15.080  -1.129   2.428
  191    HZ   PHE  26           HZ       PHE  26 -15.537  -3.236   1.243
  192    H    GLN  27           H        GLN  27  -9.335   1.364   2.247
  193    HA   GLN  27           HA       GLN  27  -6.511   0.814   2.762
  194   1HB   GLN  27          HB2       GLN  27  -6.382   2.179   0.866
  195   2HB   GLN  27          HB1       GLN  27  -7.839   3.068   1.291
  196   1HG   GLN  27          HG2       GLN  27  -6.650   4.373   2.893
  197   2HG   GLN  27          HG1       GLN  27  -5.240   3.334   2.786
  198   1HE2  GLN  27          HE21      GLN  27  -3.869   3.637   1.242
  199   2HE2  GLN  27          HE22      GLN  27  -3.852   4.920   0.082
  200    H    THR  28           H        THR  28  -5.679   1.725   4.576
  201    HA   THR  28           HA       THR  28  -7.310   3.530   6.088
  202    HB   THR  28           HB       THR  28  -8.021   1.440   7.085
  203    HG1  THR  28           HG1      THR  28  -7.858   2.504   8.875
  204   1HG2  THR  28          HG21      THR  28  -5.091   0.805   7.524
  205   2HG2  THR  28          HG22      THR  28  -6.130   0.015   6.344
  206   3HG2  THR  28          HG23      THR  28  -6.444  -0.177   8.068
  207    HA   PRO  29           HA       PRO  29  -3.168   5.145   6.663
  208   1HB   PRO  29          HB2       PRO  29  -3.889   7.249   8.233
  209   2HB   PRO  29          HB1       PRO  29  -4.036   7.242   6.468
  210   1HG   PRO  29          HG2       PRO  29  -6.135   6.740   8.539
  211   2HG   PRO  29          HG1       PRO  29  -6.246   7.677   7.042
  212   1HD   PRO  29          HD2       PRO  29  -7.214   5.151   7.227
  213   2HD   PRO  29          HD1       PRO  29  -6.492   5.772   5.722
  214    H    ASP  30           H        ASP  30  -5.116   3.620   8.881
  215    HA   ASP  30           HA       ASP  30  -3.236   4.027  11.075
  216   1HB   ASP  30          HB2       ASP  30  -5.856   2.537  10.912
  217   2HB   ASP  30          HB1       ASP  30  -4.783   2.449  12.300
  218    H    LEU  31           H        LEU  31  -1.471   2.836  10.954
  219    HA   LEU  31           HA       LEU  31  -0.979   0.675   9.370
  220   1HB   LEU  31          HB2       LEU  31   0.538   2.226  10.840
  221   2HB   LEU  31          HB1       LEU  31   0.349   0.973  12.041
  222    HG   LEU  31           HG       LEU  31   2.451   0.646  10.933
  223   1HD1  LEU  31          HD11      LEU  31   0.474  -1.313   9.863
  224   2HD1  LEU  31          HD12      LEU  31   1.290  -1.421  11.426
  225   3HD1  LEU  31          HD13      LEU  31   2.220  -1.575   9.918
  226   1HD2  LEU  31          HD21      LEU  31   2.004   1.929   8.961
  227   2HD2  LEU  31          HD22      LEU  31   0.896   0.698   8.382
  228   3HD2  LEU  31          HD23      LEU  31   2.627   0.333   8.510
  229    H    ASN  32           H        ASN  32  -2.056   0.734  12.818
  230    HA   ASN  32           HA       ASN  32  -1.876  -1.968  13.351
  231   1HB   ASN  32          HB2       ASN  32  -2.332  -0.140  15.040
  232   2HB   ASN  32          HB1       ASN  32  -3.946  -0.050  14.303
  233   1HD2  ASN  32          HD21      ASN  32  -5.480  -1.599  14.712
  234   2HD2  ASN  32          HD22      ASN  32  -5.208  -2.797  15.909
  235    H    MET  33           H        MET  33  -4.434   0.020  12.005
  236    HA   MET  33           HA       MET  33  -6.300  -2.131  11.930
  237   1HB   MET  33          HB2       MET  33  -6.417   0.462  10.405
  238   2HB   MET  33          HB1       MET  33  -7.758  -0.635  10.708
  239   1HG   MET  33          HG2       MET  33  -6.214   0.950  12.690
  240   2HG   MET  33          HG1       MET  33  -7.886   1.255  12.199
  241   1HE   MET  33          HE1       MET  33  -9.883  -0.491  12.778
  242   2HE   MET  33          HE2       MET  33  -9.651  -1.965  13.721
  243   3HE   MET  33          HE3       MET  33  -8.943  -1.828  12.115
  244    H    PHE  34           H        PHE  34  -3.993  -0.727   9.759
  245    HA   PHE  34           HA       PHE  34  -4.812  -2.061   7.433
  246   1HB   PHE  34          HB2       PHE  34  -3.298  -0.217   7.215
  247   2HB   PHE  34          HB1       PHE  34  -2.131  -0.938   8.286
  248    HD1  PHE  34           HD1      PHE  34  -3.812  -1.518   4.951
  249    HD2  PHE  34           HD2      PHE  34  -0.396  -2.200   7.434
  250    HE1  PHE  34           HE1      PHE  34  -2.656  -2.544   3.068
  251    HE2  PHE  34           HE2      PHE  34   0.767  -3.233   5.518
  252    HZ   PHE  34           HZ       PHE  34  -0.369  -3.405   3.337
  253    H    THR  35           H        THR  35  -2.272  -2.893   9.746
  254    HA   THR  35           HA       THR  35  -1.805  -5.383   8.467
  255    HB   THR  35           HB       THR  35   0.052  -4.422   9.669
  256    HG1  THR  35           HG1      THR  35   0.720  -6.303  10.176
  257   1HG2  THR  35          HG21      THR  35   0.084  -4.226  12.124
  258   2HG2  THR  35          HG22      THR  35  -1.634  -4.672  12.156
  259   3HG2  THR  35          HG23      THR  35  -1.111  -3.188  11.347
  260    H    PHE  36           H        PHE  36  -3.914  -4.359  10.973
  261    HA   PHE  36           HA       PHE  36  -4.700  -6.908  11.916
  262   1HB   PHE  36          HB2       PHE  36  -5.335  -5.066  13.281
  263   2HB   PHE  36          HB1       PHE  36  -6.043  -4.189  11.967
  264    HD1  PHE  36           HD1      PHE  36  -6.435  -7.502  13.599
  265    HD2  PHE  36           HD2      PHE  36  -8.311  -4.101  11.921
  266    HE1  PHE  36           HE1      PHE  36  -8.639  -8.419  14.248
  267    HE2  PHE  36           HE2      PHE  36 -10.529  -4.991  12.548
  268    HZ   PHE  36           HZ       PHE  36 -10.691  -7.153  13.711
  269    H    HIS  37           H        HIS  37  -6.258  -4.729   9.594
  270    HA   HIS  37           HA       HIS  37  -8.215  -6.504   8.718
  271   1HB   HIS  37          HB2       HIS  37  -8.714  -4.339   8.197
  272   2HB   HIS  37          HB1       HIS  37  -7.061  -3.913   7.831
  273    HD1  HIS  37           HD1      HIS  37 -10.085  -5.633   6.223
  274    HD2  HIS  37           HD2      HIS  37  -6.483  -3.826   5.199
  275    HE1  HIS  37           HE1      HIS  37 -10.158  -5.333   3.745
  276    H    VAL  38           H        VAL  38  -4.909  -6.112   7.756
  277    HA   VAL  38           HA       VAL  38  -5.094  -7.828   5.506
  278    HB   VAL  38           HB       VAL  38  -2.763  -6.800   7.113
  279   1HG1  VAL  38          HG11      VAL  38  -1.256  -7.805   5.391
  280   2HG1  VAL  38          HG12      VAL  38  -2.654  -8.569   4.635
  281   3HG1  VAL  38          HG13      VAL  38  -2.156  -9.053   6.258
  282   1HG2  VAL  38          HG21      VAL  38  -3.658  -6.321   4.276
  283   2HG2  VAL  38          HG22      VAL  38  -2.245  -5.585   5.037
  284   3HG2  VAL  38          HG23      VAL  38  -3.868  -5.230   5.643
  285    H    ASP  39           H        ASP  39  -3.871  -8.311   8.836
  286    HA   ASP  39           HA       ASP  39  -3.200 -11.020   8.487
  287   1HB   ASP  39          HB2       ASP  39  -2.405  -9.594  10.353
  288   2HB   ASP  39          HB1       ASP  39  -4.028  -9.595  11.024
  289    H    SER  40           H        SER  40  -6.146  -9.432   9.119
  290    HA   SER  40           HA       SER  40  -7.579 -11.780   9.985
  291   1HB   SER  40          HB2       SER  40  -8.095  -9.565  10.898
  292   2HB   SER  40          HB1       SER  40  -8.500  -8.989   9.298
  293    HG   SER  40           HG       SER  40 -10.401  -9.540   9.796
  294    H    GLU  41           H        GLU  41  -7.429  -9.808   7.053
  295    HA   GLU  41           HA       GLU  41  -9.446 -11.610   5.926
  296   1HB   GLU  41          HB2       GLU  41  -8.744  -8.803   5.160
  297   2HB   GLU  41          HB1       GLU  41  -9.937  -9.801   4.327
  298   1HG   GLU  41          HG2       GLU  41 -11.228 -10.008   6.352
  299   2HG   GLU  41          HG1       GLU  41  -9.987  -9.124   7.238
  300    H    HIS  42           H        HIS  42  -6.261 -10.318   5.216
  301    HA   HIS  42           HA       HIS  42  -5.946 -12.381   3.244
  302   1HB   HIS  42          HB2       HIS  42  -4.684 -10.237   2.060
  303   2HB   HIS  42          HB1       HIS  42  -6.143 -10.999   1.420
  304    HD1  HIS  42           HD1      HIS  42  -8.365  -9.565   1.768
  305    HD2  HIS  42           HD2      HIS  42  -4.905  -7.692   3.147
  306    HE1  HIS  42           HE1      HIS  42  -8.986  -7.186   2.128
  307    HA   PRO  43           HA       PRO  43  -2.441 -11.569   6.248
  308   1HB   PRO  43          HB2       PRO  43  -2.062 -14.166   6.950
  309   2HB   PRO  43          HB1       PRO  43  -3.216 -13.092   7.753
  310   1HG   PRO  43          HG2       PRO  43  -3.701 -15.087   5.567
  311   2HG   PRO  43          HG1       PRO  43  -4.612 -14.851   7.070
  312   1HD   PRO  43          HD2       PRO  43  -5.516 -13.836   4.796
  313   2HD   PRO  43          HD1       PRO  43  -5.612 -12.898   6.305
  314    H    ASN  44           H        ASN  44  -2.626 -14.027   3.681
  315    HA   ASN  44           HA       ASN  44   0.324 -13.833   3.543
  316   1HB   ASN  44          HB2       ASN  44  -0.540 -16.066   4.355
  317   2HB   ASN  44          HB1       ASN  44  -1.224 -16.303   2.754
  318   1HD2  ASN  44          HD21      ASN  44   1.677 -16.070   4.595
  319   2HD2  ASN  44          HD22      ASN  44   2.764 -16.664   3.409
  320    H    VAL  45           H        VAL  45  -2.566 -14.513   1.628
  321    HA   VAL  45           HA       VAL  45  -3.206 -14.061  -0.480
  322    HB   VAL  45           HB       VAL  45  -0.856 -12.128  -0.637
  323   1HG1  VAL  45          HG11      VAL  45  -1.963 -12.497  -2.794
  324   2HG1  VAL  45          HG12      VAL  45  -2.288 -10.866  -2.190
  325   3HG1  VAL  45          HG13      VAL  45  -3.518 -12.123  -2.048
  326   1HG2  VAL  45          HG21      VAL  45  -2.114 -11.764   1.334
  327   2HG2  VAL  45          HG22      VAL  45  -3.612 -11.731   0.389
  328   3HG2  VAL  45          HG23      VAL  45  -2.399 -10.442   0.178
  329    H    VAL  46           H        VAL  46  -2.478 -14.275  -2.848
  330    HA   VAL  46           HA       VAL  46  -0.419 -16.203  -2.706
  331    HB   VAL  46           HB       VAL  46  -1.141 -17.090  -4.956
  332   1HG1  VAL  46          HG11      VAL  46  -3.240 -16.995  -2.795
  333   2HG1  VAL  46          HG12      VAL  46  -1.914 -18.151  -2.928
  334   3HG1  VAL  46          HG13      VAL  46  -3.206 -18.145  -4.129
  335   1HG2  VAL  46          HG21      VAL  46  -3.354 -16.399  -5.806
  336   2HG2  VAL  46          HG22      VAL  46  -2.173 -15.095  -5.858
  337   3HG2  VAL  46          HG23      VAL  46  -3.403 -15.120  -4.591
  338    H    LEU  47           H        LEU  47   0.850 -16.411  -4.952
  339    HA   LEU  47           HA       LEU  47   2.652 -14.307  -4.919
  340   1HB   LEU  47          HB2       LEU  47   2.290 -16.412  -7.050
  341   2HB   LEU  47          HB1       LEU  47   3.651 -15.328  -6.961
  342    HG   LEU  47           HG       LEU  47   4.392 -17.393  -6.151
  343   1HD1  LEU  47          HD11      LEU  47   5.241 -15.567  -4.870
  344   2HD1  LEU  47          HD12      LEU  47   5.036 -16.983  -3.844
  345   3HD1  LEU  47          HD13      LEU  47   3.872 -15.664  -3.760
  346   1HD2  LEU  47          HD21      LEU  47   2.045 -17.499  -4.250
  347   2HD2  LEU  47          HD22      LEU  47   3.349 -18.682  -4.351
  348   3HD2  LEU  47          HD23      LEU  47   2.243 -18.473  -5.708
  349    H    ASN  48           H        ASN  48   3.211 -12.658  -6.297
  350    HA   ASN  48           HA       ASN  48   1.965 -11.981  -8.698
  351   1HB   ASN  48          HB2       ASN  48   0.607 -10.045  -8.009
  352   2HB   ASN  48          HB1       ASN  48  -0.014 -11.505  -7.253
  353   1HD2  ASN  48          HD21      ASN  48   0.172 -11.733  -4.969
  354   2HD2  ASN  48          HD22      ASN  48   0.586 -10.412  -3.972
  355    H    SER  49           H        SER  49   2.705  -9.736  -9.383
  356    HA   SER  49           HA       SER  49   5.170  -9.003  -7.972
  357   1HB   SER  49          HB2       SER  49   4.390  -8.533 -10.869
  358   2HB   SER  49          HB1       SER  49   5.936  -8.111 -10.135
  359    HG   SER  49           HG       SER  49   4.847 -10.709 -10.385
  360    H    SER  50           H        SER  50   4.959  -7.152  -6.779
  361    HA   SER  50           HA       SER  50   3.418  -4.938  -7.750
  362   1HB   SER  50          HB2       SER  50   2.927  -6.390  -5.162
  363   2HB   SER  50          HB1       SER  50   2.212  -4.851  -5.612
  364    HG   SER  50           HG       SER  50   1.564  -7.402  -6.322
  365    H    TYR  51           H        TYR  51   3.654  -3.172  -5.949
  366    HA   TYR  51           HA       TYR  51   6.402  -3.185  -4.922
  367   1HB   TYR  51          HB2       TYR  51   4.806  -1.176  -6.379
  368   2HB   TYR  51          HB1       TYR  51   5.748  -0.580  -5.030
  369    HD1  TYR  51           HD1      TYR  51   6.627  -3.233  -7.513
  370    HD2  TYR  51           HD2      TYR  51   7.417   0.663  -6.006
  371    HE1  TYR  51           HE1      TYR  51   8.597  -3.079  -8.972
  372    HE2  TYR  51           HE2      TYR  51   9.402   0.821  -7.461
  373    HH   TYR  51           HH       TYR  51  10.047  -1.478  -9.959
  374    H    VAL  52           H        VAL  52   6.703  -2.616  -2.843
  375    HA   VAL  52           HA       VAL  52   4.378  -1.742  -1.273
  376    HB   VAL  52           HB       VAL  52   4.800  -4.171  -0.924
  377   1HG1  VAL  52          HG11      VAL  52   7.454  -3.330   0.114
  378   2HG1  VAL  52          HG12      VAL  52   7.131  -4.197  -1.404
  379   3HG1  VAL  52          HG13      VAL  52   6.765  -4.957   0.138
  380   1HG2  VAL  52          HG21      VAL  52   5.564  -2.541   1.466
  381   2HG2  VAL  52          HG22      VAL  52   5.038  -4.227   1.485
  382   3HG2  VAL  52          HG23      VAL  52   3.932  -2.964   0.952
  383    H    CYS  53           H        CYS  53   4.779  -0.155   0.167
  384    HA   CYS  53           HA       CYS  53   7.427   1.116   0.262
  385   1HB   CYS  53          HB2       CYS  53   5.510   2.563   0.313
  386   2HB   CYS  53          HB1       CYS  53   4.766   1.667   1.619
  387    H    VAL  54           H        VAL  54   8.828  -0.233   1.315
  388    HA   VAL  54           HA       VAL  54   8.229  -2.124   3.221
  389    HB   VAL  54           HB       VAL  54  10.743  -0.821   3.786
  390   1HG1  VAL  54          HG11      VAL  54  10.191  -3.104   4.340
  391   2HG1  VAL  54          HG12      VAL  54  11.619  -2.965   3.265
  392   3HG1  VAL  54          HG13      VAL  54  10.050  -3.405   2.594
  393   1HG2  VAL  54          HG21      VAL  54  10.088  -1.451   0.952
  394   2HG2  VAL  54          HG22      VAL  54  11.736  -1.503   1.569
  395   3HG2  VAL  54          HG23      VAL  54  10.804  -0.007   1.630
  396    H    GLU  55           H        GLU  55   8.853   1.240   3.519
  397    HA   GLU  55           HA       GLU  55   9.377   1.532   6.187
  398   1HB   GLU  55          HB2       GLU  55   7.767   3.463   4.540
  399   2HB   GLU  55          HB1       GLU  55   8.801   3.847   5.909
  400   1HG   GLU  55          HG2       GLU  55   9.760   2.779   3.252
  401   2HG   GLU  55          HG1       GLU  55   9.787   4.464   3.743
  402    H    CYS  56           H        CYS  56   6.401   1.392   4.443
  403    HA   CYS  56           HA       CYS  56   4.782   1.580   6.975
  404   1HB   CYS  56          HB2       CYS  56   3.762   1.498   4.158
  405   2HB   CYS  56          HB1       CYS  56   2.913   2.099   5.588
  406    H    ASN  57           H        ASN  57   5.933  -0.473   4.675
  407    HA   ASN  57           HA       ASN  57   5.621  -2.434   3.793
  408   1HB   ASN  57          HB2       ASN  57   5.916  -2.873   6.365
  409   2HB   ASN  57          HB1       ASN  57   4.296  -3.502   6.195
  410   1HD2  ASN  57          HD21      ASN  57   7.264  -3.616   4.825
  411   2HD2  ASN  57          HD22      ASN  57   7.216  -5.283   4.348
  412    H    PHE  58           H        PHE  58   4.032  -0.977   2.780
  413    HA   PHE  58           HA       PHE  58   1.470  -2.298   2.956
  414   1HB   PHE  58          HB2       PHE  58   0.197  -0.395   2.950
  415   2HB   PHE  58          HB1       PHE  58   1.663   0.301   3.625
  416    HD1  PHE  58           HD1      PHE  58  -0.534   0.093   0.751
  417    HD2  PHE  58           HD2      PHE  58   2.958   1.901   2.292
  418    HE1  PHE  58           HE1      PHE  58  -0.631   1.814  -1.053
  419    HE2  PHE  58           HE2      PHE  58   2.882   3.601   0.470
  420    HZ   PHE  58           HZ       PHE  58   1.082   3.545  -1.184
  421    H    LEU  59           H        LEU  59   0.730  -3.166   1.126
  422    HA   LEU  59           HA       LEU  59   2.364  -2.908  -1.251
  423   1HB   LEU  59          HB2       LEU  59   0.681  -5.002  -0.079
  424   2HB   LEU  59          HB1       LEU  59   0.573  -4.887  -1.819
  425    HG   LEU  59           HG       LEU  59   3.183  -5.216  -0.348
  426   1HD1  LEU  59          HD11      LEU  59   1.475  -7.216  -1.801
  427   2HD1  LEU  59          HD12      LEU  59   1.580  -7.098  -0.044
  428   3HD1  LEU  59          HD13      LEU  59   3.009  -7.546  -0.984
  429   1HD2  LEU  59          HD21      LEU  59   3.362  -4.211  -2.575
  430   2HD2  LEU  59          HD22      LEU  59   2.354  -5.485  -3.237
  431   3HD2  LEU  59          HD23      LEU  59   3.943  -5.874  -2.598
  432    H    THR  60           H        THR  60   1.533  -1.985  -3.049
  433    HA   THR  60           HA       THR  60  -1.303  -1.333  -2.998
  434    HB   THR  60           HB       THR  60  -0.287   0.665  -2.446
  435    HG1  THR  60           HG1      THR  60  -1.789   0.985  -4.072
  436   1HG2  THR  60          HG21      THR  60   1.730   0.300  -4.661
  437   2HG2  THR  60          HG22      THR  60   2.009   0.100  -2.934
  438   3HG2  THR  60          HG23      THR  60   1.635   1.686  -3.570
  439    H    LYS  61           H        LYS  61  -2.170  -0.752  -5.126
  440    HA   LYS  61           HA       LYS  61  -1.649  -2.943  -6.964
  441   1HB   LYS  61          HB2       LYS  61  -3.565  -0.641  -7.256
  442   2HB   LYS  61          HB1       LYS  61  -3.602  -2.162  -8.121
  443   1HG   LYS  61          HG2       LYS  61  -4.172  -3.337  -6.090
  444   2HG   LYS  61          HG1       LYS  61  -4.040  -1.836  -5.171
  445   1HD   LYS  61          HD2       LYS  61  -5.823  -0.864  -6.612
  446   2HD   LYS  61          HD1       LYS  61  -6.008  -2.445  -7.373
  447   1HE   LYS  61          HE2       LYS  61  -7.683  -2.104  -5.622
  448   2HE   LYS  61          HE1       LYS  61  -6.579  -3.423  -5.224
  449   1HZ   LYS  61          HZ1       LYS  61  -5.402  -2.011  -3.736
  450   2HZ   LYS  61          HZ2       LYS  61  -7.006  -1.901  -3.319
  451   3HZ   LYS  61          HZ3       LYS  61  -6.245  -0.654  -4.196
  452    H    ARG  62           H        ARG  62  -0.289   0.033  -6.594
  453    HA   ARG  62           HA       ARG  62   0.298   0.320  -9.445
  454   1HB   ARG  62          HB2       ARG  62  -0.091   2.760  -9.211
  455   2HB   ARG  62          HB1       ARG  62  -1.544   1.779  -9.086
  456   1HG   ARG  62          HG2       ARG  62  -1.450   1.974  -6.636
  457   2HG   ARG  62          HG1       ARG  62  -0.023   2.999  -6.791
  458   1HD   ARG  62          HD2       ARG  62  -2.061   4.306  -6.476
  459   2HD   ARG  62          HD1       ARG  62  -1.312   4.629  -8.037
  460    HE   ARG  62           HE       ARG  62  -3.592   2.843  -7.639
  461   1HH1  ARG  62          HH11      ARG  62  -1.891   5.352  -9.514
  462   2HH1  ARG  62          HH12      ARG  62  -3.044   5.469 -10.739
  463   1HH2  ARG  62          HH21      ARG  62  -5.216   2.915  -9.412
  464   2HH2  ARG  62          HH22      ARG  62  -4.950   3.993 -10.705
  465    H    TYR  63           H        TYR  63   2.243   1.415  -9.872
  466    HA   TYR  63           HA       TYR  63   4.172   1.207  -7.735
  467   1HB   TYR  63          HB2       TYR  63   4.480   1.892 -10.668
  468   2HB   TYR  63          HB1       TYR  63   5.826   1.841  -9.546
  469    HD1  TYR  63           HD1      TYR  63   3.412  -0.713  -8.800
  470    HD2  TYR  63           HD2      TYR  63   6.670   0.230 -11.371
  471    HE1  TYR  63           HE1      TYR  63   3.703  -3.100  -9.293
  472    HE2  TYR  63           HE2      TYR  63   6.969  -2.154 -11.869
  473    HH   TYR  63           HH       TYR  63   4.633  -4.482 -11.014
  474    H    ASP  64           H        ASP  64   2.270   3.596  -9.165
  475    HA   ASP  64           HA       ASP  64   3.957   5.818  -8.594
  476   1HB   ASP  64          HB2       ASP  64   1.918   7.165  -8.975
  477   2HB   ASP  64          HB1       ASP  64   2.480   6.213 -10.366
  478    H    ALA  65           H        ALA  65   1.546   4.194  -6.739
  479    HA   ALA  65           HA       ALA  65   1.115   6.231  -4.817
  480   1HB   ALA  65          HB1       ALA  65   0.985   3.240  -4.487
  481   2HB   ALA  65          HB2       ALA  65  -0.360   4.310  -4.899
  482   3HB   ALA  65          HB3       ALA  65   0.386   4.403  -3.312
  483    H    LEU  66           H        LEU  66   3.724   4.095  -5.307
  484    HA   LEU  66           HA       LEU  66   4.985   4.540  -2.730
  485   1HB   LEU  66          HB2       LEU  66   6.152   3.480  -5.251
  486   2HB   LEU  66          HB1       LEU  66   6.925   3.402  -3.682
  487    HG   LEU  66           HG       LEU  66   6.175   1.267  -3.998
  488   1HD1  LEU  66          HD11      LEU  66   3.911   2.583  -2.552
  489   2HD1  LEU  66          HD12      LEU  66   5.443   2.063  -1.834
  490   3HD1  LEU  66          HD13      LEU  66   4.311   0.866  -2.481
  491   1HD2  LEU  66          HD21      LEU  66   3.619   2.369  -5.097
  492   2HD2  LEU  66          HD22      LEU  66   3.992   0.652  -4.901
  493   3HD2  LEU  66          HD23      LEU  66   4.951   1.661  -5.997
  494    H    SER  67           H        SER  67   5.006   5.873  -5.847
  495    HA   SER  67           HA       SER  67   7.521   7.289  -5.762
  496   1HB   SER  67          HB2       SER  67   5.070   7.220  -7.360
  497   2HB   SER  67          HB1       SER  67   6.308   8.410  -7.771
  498    HG   SER  67           HG       SER  67   6.322   5.525  -7.814
  499    H    GLU  68           H        GLU  68   4.126   8.166  -5.535
  500    HA   GLU  68           HA       GLU  68   4.709  10.857  -4.801
  501   1HB   GLU  68          HB2       GLU  68   2.090   9.766  -4.055
  502   2HB   GLU  68          HB1       GLU  68   2.538  11.255  -4.889
  503   1HG   GLU  68          HG2       GLU  68   3.030   9.770  -6.907
  504   2HG   GLU  68          HG1       GLU  68   2.262   8.509  -6.014
  505    H    HIS  69           H        HIS  69   4.537   7.936  -3.206
  506    HA   HIS  69           HA       HIS  69   3.505   8.414  -0.727
  507   1HB   HIS  69          HB2       HIS  69   4.512   6.302  -1.694
  508   2HB   HIS  69          HB1       HIS  69   6.043   6.903  -1.032
  509    HD1  HIS  69           HD1      HIS  69   2.584   5.905   0.125
  510    HD2  HIS  69           HD2      HIS  69   6.439   6.401   1.483
  511    HE1  HIS  69           HE1      HIS  69   2.568   5.059   2.499
  512    H    ASN  70           H        ASN  70   7.002   8.851  -1.457
  513    HA   ASN  70           HA       ASN  70   7.571  10.237   1.004
  514   1HB   ASN  70          HB2       ASN  70   9.762  10.692  -0.061
  515   2HB   ASN  70          HB1       ASN  70   9.337   8.993  -0.053
  516   1HD2  ASN  70          HD21      ASN  70  11.184  10.140  -1.624
  517   2HD2  ASN  70          HD22      ASN  70  10.682   9.961  -3.311
  518    H    LEU  71           H        LEU  71   6.144  11.198  -1.780
  519    HA   LEU  71           HA       LEU  71   6.919  13.948  -1.639
  520   1HB   LEU  71          HB2       LEU  71   6.373  13.345  -3.782
  521   2HB   LEU  71          HB1       LEU  71   5.111  12.247  -3.288
  522    HG   LEU  71           HG       LEU  71   3.630  14.108  -2.924
  523   1HD1  LEU  71          HD11      LEU  71   5.283  15.899  -2.425
  524   2HD1  LEU  71          HD12      LEU  71   4.285  16.382  -3.798
  525   3HD1  LEU  71          HD13      LEU  71   5.918  15.776  -4.065
  526   1HD2  LEU  71          HD21      LEU  71   4.904  14.026  -5.643
  527   2HD2  LEU  71          HD22      LEU  71   3.318  14.711  -5.278
  528   3HD2  LEU  71          HD23      LEU  71   3.612  12.992  -5.030
  529    H    LYS  72           H        LYS  72   4.016  12.077  -0.870
  530    HA   LYS  72           HA       LYS  72   3.044  14.369   0.672
  531   1HB   LYS  72          HB2       LYS  72   0.841  12.814   0.341
  532   2HB   LYS  72          HB1       LYS  72   1.223  14.245  -0.642
  533   1HG   LYS  72          HG2       LYS  72   2.464  12.545  -2.110
  534   2HG   LYS  72          HG1       LYS  72   1.618  11.306  -1.228
  535   1HD   LYS  72          HD2       LYS  72   0.384  13.544  -2.817
  536   2HD   LYS  72          HD1       LYS  72   0.432  11.832  -3.241
  537   1HE   LYS  72          HE2       LYS  72  -1.003  11.305  -1.331
  538   2HE   LYS  72          HE1       LYS  72  -0.979  12.997  -0.851
  539   1HZ   LYS  72          HZ1       LYS  72  -2.104  13.588  -2.843
  540   2HZ   LYS  72          HZ2       LYS  72  -2.995  12.372  -2.082
  541   3HZ   LYS  72          HZ3       LYS  72  -2.044  12.011  -3.420
  542    H    TYR  73           H        TYR  73   3.449  10.983   0.865
  543    HA   TYR  73           HA       TYR  73   2.223  10.738   3.482
  544   1HB   TYR  73          HB2       TYR  73   3.683   8.799   1.727
  545   2HB   TYR  73          HB1       TYR  73   2.996   8.341   3.286
  546    HD1  TYR  73           HD1      TYR  73   1.856  10.153   0.210
  547    HD2  TYR  73           HD2      TYR  73   1.045   7.125   3.070
  548    HE1  TYR  73           HE1      TYR  73  -0.158   9.613  -0.973
  549    HE2  TYR  73           HE2      TYR  73  -1.012   6.546   1.876
  550    HH   TYR  73           HH       TYR  73  -2.608   7.863   0.357
  551    H    HIS  74           H        HIS  74   5.513  10.159   2.131
  552    HA   HIS  74           HA       HIS  74   6.569  10.718   4.858
  553   1HB   HIS  74          HB2       HIS  74   7.799   9.044   2.654
  554   2HB   HIS  74          HB1       HIS  74   8.636   9.434   4.150
  555    HD1  HIS  74           HD1      HIS  74   6.114   8.675   6.040
  556    HD2  HIS  74           HD2      HIS  74   7.752   6.401   2.981
  557    HE1  HIS  74           HE1      HIS  74   5.368   6.306   6.468
  558    HA   PRO  75           HA       PRO  75   7.918  14.087   1.928
  559   1HB   PRO  75          HB2       PRO  75   7.301  16.189   3.465
  560   2HB   PRO  75          HB1       PRO  75   6.081  15.357   2.485
  561   1HG   PRO  75          HG2       PRO  75   6.698  15.004   5.405
  562   2HG   PRO  75          HG1       PRO  75   5.111  15.189   4.628
  563   1HD   PRO  75          HD2       PRO  75   6.094  12.752   5.305
  564   2HD   PRO  75          HD1       PRO  75   5.099  13.023   3.859
  565    H    GLY  76           H        GLY  76   9.743  15.197   1.850
  566   1HA   GLY  76          HA2       GLY  76  11.236  16.456   3.655
  567   2HA   GLY  76          HA1       GLY  76  11.709  14.778   3.920
  568    H    GLU  77           H        GLU  77  11.595  13.813   1.348
  569    HA   GLU  77           HA       GLU  77  13.036  15.401  -0.508
  570   1HB   GLU  77          HB2       GLU  77  15.092  13.999  -0.533
  571   2HB   GLU  77          HB1       GLU  77  14.939  14.941   0.944
  572   1HG   GLU  77          HG2       GLU  77  14.257  12.999   2.176
  573   2HG   GLU  77          HG1       GLU  77  14.150  12.047   0.701
  574    H    GLU  78           H        GLU  78  13.771  13.865  -2.373
  575    HA   GLU  78           HA       GLU  78  11.822  11.683  -2.498
  576   1HB   GLU  78          HB2       GLU  78  11.353  13.625  -3.987
  577   2HB   GLU  78          HB1       GLU  78  12.937  13.322  -4.720
  578   1HG   GLU  78          HG2       GLU  78  12.175  11.144  -5.480
  579   2HG   GLU  78          HG1       GLU  78  10.598  11.414  -4.740
  580    H    ASN  79           H        ASN  79  13.201  10.097  -1.807
  581    HA   ASN  79           HA       ASN  79  15.166   9.158  -3.731
  582   1HB   ASN  79          HB2       ASN  79  15.898   9.745  -0.850
  583   2HB   ASN  79          HB1       ASN  79  16.905   8.810  -1.961
  584   1HD2  ASN  79          HD21      ASN  79  15.635  11.854  -1.161
  585   2HD2  ASN  79          HD22      ASN  79  16.550  12.868  -2.223
  586    H    PHE  80           H        PHE  80  13.808   7.491  -4.038
  587    HA   PHE  80           HA       PHE  80  13.403   5.674  -1.773
  588   1HB   PHE  80          HB2       PHE  80  11.662   6.531  -3.945
  589   2HB   PHE  80          HB1       PHE  80  11.828   4.789  -3.871
  590    HD1  PHE  80           HD1      PHE  80  10.041   7.524  -2.729
  591    HD2  PHE  80           HD2      PHE  80  11.532   3.792  -1.444
  592    HE1  PHE  80           HE1      PHE  80   8.237   7.389  -1.023
  593    HE2  PHE  80           HE2      PHE  80   9.742   3.631   0.229
  594    HZ   PHE  80           HZ       PHE  80   8.091   5.431   0.435
  595    H    LYS  81           H        LYS  81  14.096   3.623  -1.957
  596    HA   LYS  81           HA       LYS  81  15.760   2.956  -4.297
  597   1HB   LYS  81          HB2       LYS  81  17.316   2.045  -2.828
  598   2HB   LYS  81          HB1       LYS  81  16.536   3.216  -1.751
  599   1HG   LYS  81          HG2       LYS  81  15.143   1.554  -0.795
  600   2HG   LYS  81          HG1       LYS  81  15.696   0.355  -1.946
  601   1HD   LYS  81          HD2       LYS  81  18.028   0.835  -1.002
  602   2HD   LYS  81          HD1       LYS  81  17.143   1.552   0.360
  603   1HE   LYS  81          HE2       LYS  81  15.880  -0.516   0.624
  604   2HE   LYS  81          HE1       LYS  81  16.771  -1.208  -0.728
  605   1HZ   LYS  81          HZ1       LYS  81  18.822  -0.933   0.579
  606   2HZ   LYS  81          HZ2       LYS  81  17.746  -1.984   1.293
  607   3HZ   LYS  81          HZ3       LYS  81  17.917  -0.417   1.912
  608    H    LEU  82           H        LEU  82  15.793   0.466  -4.613
  609    HA   LEU  82           HA       LEU  82  13.214  -0.638  -3.851
  610   1HB   LEU  82          HB2       LEU  82  13.049  -1.834  -5.974
  611   2HB   LEU  82          HB1       LEU  82  13.069  -0.106  -6.228
  612    HG   LEU  82           HG       LEU  82  15.586  -1.704  -6.526
  613   1HD1  LEU  82          HD11      LEU  82  15.039  -1.928  -8.916
  614   2HD1  LEU  82          HD12      LEU  82  13.431  -1.262  -8.606
  615   3HD1  LEU  82          HD13      LEU  82  13.897  -2.810  -7.906
  616   1HD2  LEU  82          HD21      LEU  82  15.745   0.747  -6.512
  617   2HD2  LEU  82          HD22      LEU  82  14.580   0.835  -7.833
  618   3HD2  LEU  82          HD23      LEU  82  16.155   0.087  -8.093
  619    H    THR  83           H        THR  83  13.228  -2.685  -3.185
  620    HA   THR  83           HA       THR  83  15.605  -4.292  -3.456
  621    HB   THR  83           HB       THR  83  16.058  -3.087  -1.401
  622    HG1  THR  83           HG1      THR  83  16.076  -4.752   0.115
  623   1HG2  THR  83          HG21      THR  83  13.360  -3.950  -0.379
  624   2HG2  THR  83          HG22      THR  83  13.763  -2.323  -0.920
  625   3HG2  THR  83          HG23      THR  83  14.545  -2.992   0.515
  626    H    MET  84           H        MET  84  14.837  -6.433  -3.941
  627    HA   MET  84           HA       MET  84  11.920  -6.703  -3.533
  628   1HB   MET  84          HB2       MET  84  13.547  -8.846  -4.859
  629   2HB   MET  84          HB1       MET  84  11.899  -8.341  -5.161
  630   1HG   MET  84          HG2       MET  84  13.140  -7.816  -7.088
  631   2HG   MET  84          HG1       MET  84  12.799  -6.310  -6.240
  632   1HE   MET  84          HE1       MET  84  15.610  -8.924  -5.186
  633   2HE   MET  84          HE2       MET  84  16.948  -8.377  -6.197
  634   3HE   MET  84          HE3       MET  84  15.502  -9.062  -6.939
  635    H    VAL  85           H        VAL  85  11.647  -7.344  -1.483
  636    HA   VAL  85           HA       VAL  85  12.525  -9.984  -0.876
  637    HB   VAL  85           HB       VAL  85  13.052  -9.113   1.597
  638   1HG1  VAL  85          HG11      VAL  85  14.652 -10.335   0.183
  639   2HG1  VAL  85          HG12      VAL  85  15.442  -9.041   1.084
  640   3HG1  VAL  85          HG13      VAL  85  15.074  -8.830  -0.626
  641   1HG2  VAL  85          HG21      VAL  85  12.581  -6.760   1.164
  642   2HG2  VAL  85          HG22      VAL  85  13.806  -6.745  -0.109
  643   3HG2  VAL  85          HG23      VAL  85  14.289  -6.984   1.570
  644    H    LYS  86           H        LYS  86  10.458 -10.859  -0.551
  645    HA   LYS  86           HA       LYS  86   9.131  -9.487   1.614
  646   1HB   LYS  86          HB2       LYS  86   8.067  -8.848  -0.646
  647   2HB   LYS  86          HB1       LYS  86   7.390 -10.479  -0.618
  648   1HG   LYS  86          HG2       LYS  86   5.752  -9.073   0.164
  649   2HG   LYS  86          HG1       LYS  86   6.373  -9.919   1.588
  650   1HD   LYS  86          HD2       LYS  86   7.625  -8.008   2.296
  651   2HD   LYS  86          HD1       LYS  86   7.403  -7.200   0.760
  652   1HE   LYS  86          HE2       LYS  86   5.901  -6.063   2.168
  653   2HE   LYS  86          HE1       LYS  86   4.927  -7.223   1.307
  654   1HZ   LYS  86          HZ1       LYS  86   5.972  -7.696   4.056
  655   2HZ   LYS  86          HZ2       LYS  86   4.827  -8.653   3.270
  656   3HZ   LYS  86          HZ3       LYS  86   4.467  -7.079   3.724
  657    H    ARG  87           H        ARG  87   9.053 -10.817   3.114
  658    HA   ARG  87           HA       ARG  87   9.226 -13.621   2.403
  659   1HB   ARG  87          HB2       ARG  87  10.050 -12.196   4.942
  660   2HB   ARG  87          HB1       ARG  87  10.265 -13.912   4.627
  661   1HG   ARG  87          HG2       ARG  87  12.407 -12.997   4.180
  662   2HG   ARG  87          HG1       ARG  87  11.635 -13.160   2.594
  663   1HD   ARG  87          HD2       ARG  87  12.791 -11.014   2.757
  664   2HD   ARG  87          HD1       ARG  87  11.056 -10.809   2.579
  665    HE   ARG  87           HE       ARG  87  11.971 -10.773   5.303
  666   1HH1  ARG  87          HH11      ARG  87  11.154  -8.715   2.484
  667   2HH1  ARG  87          HH12      ARG  87  11.160  -7.286   3.306
  668   1HH2  ARG  87          HH21      ARG  87  11.979  -8.711   6.498
  669   2HH2  ARG  87          HH22      ARG  87  11.672  -7.270   5.647
  670    H    ASN  88           H        ASN  88   8.076 -15.117   3.710
  671    HA   ASN  88           HA       ASN  88   6.246 -15.986   4.713
  672   1HB   ASN  88          HB2       ASN  88   6.535 -14.225   6.531
  673   2HB   ASN  88          HB1       ASN  88   5.514 -13.155   5.595
  674   1HD2  ASN  88          HD21      ASN  88   5.166 -14.141   8.288
  675   2HD2  ASN  88          HD22      ASN  88   3.673 -14.995   8.324
  676    H    ASN  89           H        ASN  89   5.535 -12.901   3.341
  677    HA   ASN  89           HA       ASN  89   3.014 -13.535   2.092
  678   1HB   ASN  89          HB2       ASN  89   4.928 -11.252   1.543
  679   2HB   ASN  89          HB1       ASN  89   3.238 -11.311   1.104
  680   1HD2  ASN  89          HD21      ASN  89   5.541 -10.732   3.653
  681   2HD2  ASN  89          HD22      ASN  89   4.397 -10.117   4.786
  682    H    GLN  90           H        GLN  90   3.648 -12.108  -0.400
  683    HA   GLN  90           HA       GLN  90   4.851 -14.277  -1.910
  684   1HB   GLN  90          HB2       GLN  90   3.918 -13.208  -3.818
  685   2HB   GLN  90          HB1       GLN  90   2.628 -13.338  -2.608
  686   1HG   GLN  90          HG2       GLN  90   4.215 -10.868  -3.103
  687   2HG   GLN  90          HG1       GLN  90   2.746 -11.232  -4.011
  688   1HE2  GLN  90          HE21      GLN  90   4.111 -10.233  -1.036
  689   2HE2  GLN  90          HE22      GLN  90   2.598  -9.799  -0.276
  690    H    THR  91           H        THR  91   6.328 -13.418  -3.724
  691    HA   THR  91           HA       THR  91   8.013 -11.493  -2.392
  692    HB   THR  91           HB       THR  91   9.441 -12.422  -4.604
  693    HG1  THR  91           HG1      THR  91   8.421 -14.680  -3.295
  694   1HG2  THR  91          HG21      THR  91   9.470 -13.393  -1.696
  695   2HG2  THR  91          HG22      THR  91  10.356 -12.029  -2.322
  696   3HG2  THR  91          HG23      THR  91  10.755 -13.649  -2.867
  697    H    ILE  92           H        ILE  92   7.853  -9.642  -2.804
  698    HA   ILE  92           HA       ILE  92   7.222  -8.515  -5.352
  699    HB   ILE  92           HB       ILE  92   5.755  -6.824  -4.101
  700   1HG1  ILE  92          HG12      ILE  92   4.496  -8.083  -2.175
  701   2HG1  ILE  92          HG11      ILE  92   6.015  -8.935  -2.077
  702   1HG2  ILE  92          HG21      ILE  92   4.805  -8.359  -5.683
  703   2HG2  ILE  92          HG22      ILE  92   3.735  -8.206  -4.295
  704   3HG2  ILE  92          HG23      ILE  92   4.769  -9.631  -4.477
  705   1HD1  ILE  92          HD11      ILE  92   5.883  -5.948  -2.001
  706   2HD1  ILE  92          HD12      ILE  92   7.273  -6.976  -1.683
  707   3HD1  ILE  92          HD13      ILE  92   5.897  -6.981  -0.586
  708    H    PHE  93           H        PHE  93   7.654  -6.080  -5.365
  709    HA   PHE  93           HA       PHE  93  10.410  -5.860  -4.430
  710   1HB   PHE  93          HB2       PHE  93   8.681  -3.991  -6.025
  711   2HB   PHE  93          HB1       PHE  93  10.395  -3.819  -5.771
  712    HD1  PHE  93           HD1      PHE  93   7.784  -5.817  -7.428
  713    HD2  PHE  93           HD2      PHE  93  11.873  -4.851  -7.134
  714    HE1  PHE  93           HE1      PHE  93   8.161  -6.917  -9.597
  715    HE2  PHE  93           HE2      PHE  93  12.307  -5.963  -9.319
  716    HZ   PHE  93           HZ       PHE  93  10.433  -6.987 -10.546
  717    H    GLU  94           H        GLU  94  10.886  -4.654  -2.663
  718    HA   GLU  94           HA       GLU  94   8.808  -3.022  -1.509
  719   1HB   GLU  94          HB2       GLU  94  11.423  -3.947  -0.274
  720   2HB   GLU  94          HB1       GLU  94  10.073  -3.190   0.540
  721   1HG   GLU  94          HG2       GLU  94   8.764  -5.241  -0.276
  722   2HG   GLU  94          HG1       GLU  94  10.355  -5.989  -0.389
  723    H    GLN  95           H        GLN  95   9.210  -0.887  -1.139
  724    HA   GLN  95           HA       GLN  95  11.650   0.188  -2.406
  725   1HB   GLN  95          HB2       GLN  95   9.303   0.464  -3.550
  726   2HB   GLN  95          HB1       GLN  95   9.014   1.647  -2.282
  727   1HG   GLN  95          HG2       GLN  95  10.908   2.935  -3.001
  728   2HG   GLN  95          HG1       GLN  95  11.312   1.704  -4.189
  729   1HE2  GLN  95          HE21      GLN  95   9.186   4.339  -3.366
  730   2HE2  GLN  95          HE22      GLN  95   8.506   4.494  -4.943
  731    H    THR  96           H        THR  96  12.951   1.026  -0.844
  732    HA   THR  96           HA       THR  96  11.697   2.081   1.610
  733    HB   THR  96           HB       THR  96  14.522   1.600   1.858
  734    HG1  THR  96           HG1      THR  96  14.146  -0.798   1.797
  735   1HG2  THR  96          HG21      THR  96  12.069   0.421   3.197
  736   2HG2  THR  96          HG22      THR  96  12.982   1.794   3.744
  737   3HG2  THR  96          HG23      THR  96  13.719   0.188   3.764
  738    H    ILE  97           H        ILE  97  12.863   3.850   2.649
  739    HA   ILE  97           HA       ILE  97  14.145   5.615   0.682
  740    HB   ILE  97           HB       ILE  97  12.927   6.432   3.334
  741   1HG1  ILE  97          HG12      ILE  97  11.483   6.596   0.726
  742   2HG1  ILE  97          HG11      ILE  97  11.378   5.117   1.674
  743   1HG2  ILE  97          HG21      ILE  97  13.218   7.884   0.694
  744   2HG2  ILE  97          HG22      ILE  97  14.478   7.879   1.910
  745   3HG2  ILE  97          HG23      ILE  97  12.922   8.599   2.291
  746   1HD1  ILE  97          HD11      ILE  97  10.549   6.644   3.548
  747   2HD1  ILE  97          HD12      ILE  97   9.524   6.251   2.200
  748   3HD1  ILE  97          HD13      ILE  97  10.273   7.844   2.246
  749    H    ASN  98           H        ASN  98  15.924   6.773   1.467
  750    HA   ASN  98           HA       ASN  98  17.488   5.323   3.461
  751   1HB   ASN  98          HB2       ASN  98  19.342   6.827   2.529
  752   2HB   ASN  98          HB1       ASN  98  18.709   5.586   1.445
  753   1HD2  ASN  98          HD21      ASN  98  17.091   8.700   2.156
  754   2HD2  ASN  98          HD22      ASN  98  17.285   9.315   0.572
  755    H    ASP  99           H        ASP  99  15.305   7.517   3.787
  756    HA   ASP  99           HA       ASP  99  16.784   9.151   5.713
  757   1HB   ASP  99          HB2       ASP  99  16.950  10.189   3.498
  758   2HB   ASP  99          HB1       ASP  99  15.219  10.294   3.451
  759    H    LEU 100           H        LEU 100  13.729   9.039   3.957
  760    HA   LEU 100           HA       LEU 100  12.142  10.044   6.125
  761   1HB   LEU 100          HB2       LEU 100  11.189   8.783   3.579
  762   2HB   LEU 100          HB1       LEU 100  10.451  10.019   4.581
  763    HG   LEU 100           HG       LEU 100  13.044  10.693   3.268
  764   1HD1  LEU 100          HD11      LEU 100  11.658   9.658   1.474
  765   2HD1  LEU 100          HD12      LEU 100  11.911  11.379   1.266
  766   3HD1  LEU 100          HD13      LEU 100  10.373  10.786   1.903
  767   1HD2  LEU 100          HD21      LEU 100  12.066  12.833   3.184
  768   2HD2  LEU 100          HD22      LEU 100  11.863  12.193   4.834
  769   3HD2  LEU 100          HD23      LEU 100  10.514  12.187   3.668
  770    H    THR 101           H        THR 101  13.582   7.333   6.014
  771    HA   THR 101           HA       THR 101  12.014   5.093   6.010
  772    HB   THR 101           HB       THR 101  14.263   5.663   7.918
  773    HG1  THR 101           HG1      THR 101  14.612   4.970   5.189
  774   1HG2  THR 101          HG21      THR 101  13.276   3.391   7.947
  775   2HG2  THR 101          HG22      THR 101  14.931   3.365   7.342
  776   3HG2  THR 101          HG23      THR 101  13.583   3.245   6.215
  777    H    PHE 102           H        PHE 102  12.554   7.553   8.438
  778    HA   PHE 102           HA       PHE 102  10.855   6.090  10.344
  779   1HB   PHE 102          HB2       PHE 102  13.031   8.082  11.009
  780   2HB   PHE 102          HB1       PHE 102  12.080   7.134  12.149
  781    HD1  PHE 102           HD1      PHE 102  15.042   7.280  10.189
  782    HD2  PHE 102           HD2      PHE 102  12.325   4.589  12.047
  783    HE1  PHE 102           HE1      PHE 102  16.742   5.515  10.095
  784    HE2  PHE 102           HE2      PHE 102  14.027   2.811  11.963
  785    HZ   PHE 102           HZ       PHE 102  16.240   3.273  10.982
  Start of MODEL   11
    1    HA   MET   1           HA       MET   1  -3.659  15.952 -24.008
    2   1HB   MET   1          HB2       MET   1  -2.575  16.255 -21.181
    3   2HB   MET   1          HB1       MET   1  -2.584  17.511 -22.397
    4   1HG   MET   1          HG2       MET   1  -4.331  17.977 -20.861
    5   2HG   MET   1          HG1       MET   1  -5.084  17.417 -22.351
    6   1HE   MET   1          HE1       MET   1  -7.354  17.159 -20.950
    7   2HE   MET   1          HE2       MET   1  -6.522  17.659 -19.479
    8   3HE   MET   1          HE3       MET   1  -7.484  16.184 -19.487
    9    H    ALA   2           H        ALA   2  -1.619  16.828 -24.756
   10    HA   ALA   2           HA       ALA   2   0.464  14.937 -25.012
   11   1HB   ALA   2          HB1       ALA   2   0.043  16.674 -26.687
   12   2HB   ALA   2          HB2       ALA   2   1.695  16.785 -26.078
   13   3HB   ALA   2          HB3       ALA   2   0.468  17.920 -25.515
   14    H    HIS   3           H        HIS   3  -0.127  17.690 -23.010
   15    HA   HIS   3           HA       HIS   3   2.402  17.642 -21.641
   16   1HB   HIS   3          HB2       HIS   3  -0.206  19.009 -20.883
   17   2HB   HIS   3          HB1       HIS   3   1.364  19.317 -20.163
   18    HD1  HIS   3           HD1      HIS   3   2.525  21.336 -21.111
   19    HD2  HIS   3           HD2      HIS   3  -0.207  19.686 -23.767
   20    HE1  HIS   3           HE1      HIS   3   2.459  22.870 -23.112
   21    H    HIS   4           H        HIS   4   2.818  16.390 -19.865
   22    HA   HIS   4           HA       HIS   4   0.583  14.809 -18.840
   23   1HB   HIS   4          HB2       HIS   4   2.213  13.211 -17.971
   24   2HB   HIS   4          HB1       HIS   4   2.584  13.539 -19.650
   25    HD1  HIS   4           HD1      HIS   4   4.937  14.696 -20.121
   26    HD2  HIS   4           HD2      HIS   4   4.106  13.977 -16.108
   27    HE1  HIS   4           HE1      HIS   4   7.100  14.978 -18.900
   28    H    HIS   5           H        HIS   5   1.262  17.594 -18.229
   29    HA   HIS   5           HA       HIS   5   2.370  17.980 -15.710
   30   1HB   HIS   5          HB2       HIS   5   1.997  19.809 -17.314
   31   2HB   HIS   5          HB1       HIS   5   0.261  19.665 -17.077
   32    HD1  HIS   5           HD1      HIS   5  -0.574  21.528 -15.596
   33    HD2  HIS   5           HD2      HIS   5   3.259  20.275 -14.560
   34    HE1  HIS   5           HE1      HIS   5   0.120  22.947 -13.652
   35    H    HIS   6           H        HIS   6  -0.891  16.949 -16.490
   36    HA   HIS   6           HA       HIS   6  -1.780  17.439 -13.793
   37   1HB   HIS   6          HB2       HIS   6  -3.193  15.996 -16.047
   38   2HB   HIS   6          HB1       HIS   6  -3.900  16.380 -14.487
   39    HD1  HIS   6           HD1      HIS   6  -3.596  17.694 -17.811
   40    HD2  HIS   6           HD2      HIS   6  -3.923  19.289 -14.004
   41    HE1  HIS   6           HE1      HIS   6  -4.439  20.066 -18.108
   42    H    HIS   7           H        HIS   7   0.247  15.299 -14.971
   43    HA   HIS   7           HA       HIS   7   1.200  13.425 -14.286
   44   1HB   HIS   7          HB2       HIS   7   0.860  14.333 -11.979
   45   2HB   HIS   7          HB1       HIS   7  -0.690  13.507 -11.898
   46    HD1  HIS   7           HD1      HIS   7  -0.566  11.231 -10.773
   47    HD2  HIS   7           HD2      HIS   7   3.076  12.491 -12.323
   48    HE1  HIS   7           HE1      HIS   7   1.098   9.450 -10.174
   49    H    HIS   8           H        HIS   8  -2.003  12.811 -13.096
   50    HA   HIS   8           HA       HIS   8  -3.158  11.424 -15.189
   51   1HB   HIS   8          HB2       HIS   8  -1.222   9.765 -14.585
   52   2HB   HIS   8          HB1       HIS   8  -2.075   9.498 -13.073
   53    HD1  HIS   8           HD1      HIS   8  -2.011   8.430 -16.629
   54    HD2  HIS   8           HD2      HIS   8  -4.628   8.184 -13.410
   55    HE1  HIS   8           HE1      HIS   8  -3.703   6.678 -17.231
   56    H    ASN   9           H        ASN   9  -3.767  13.398 -13.325
   57    HA   ASN   9           HA       ASN   9  -5.035  12.161 -11.055
   58   1HB   ASN   9          HB2       ASN   9  -3.760  14.314 -10.847
   59   2HB   ASN   9          HB1       ASN   9  -5.033  15.089 -11.787
   60   1HD2  ASN   9          HD21      ASN   9  -5.595  16.457 -10.113
   61   2HD2  ASN   9          HD22      ASN   9  -6.425  15.900  -8.702
   62    H    GLN  10           H        GLN  10  -6.238  11.105 -12.958
   63    HA   GLN  10           HA       GLN  10  -8.921  12.329 -13.118
   64   1HB   GLN  10          HB2       GLN  10  -9.286  10.775 -15.053
   65   2HB   GLN  10          HB1       GLN  10  -8.011  11.942 -15.365
   66   1HG   GLN  10          HG2       GLN  10  -6.315  10.289 -14.976
   67   2HG   GLN  10          HG1       GLN  10  -7.513   9.121 -14.436
   68   1HE2  GLN  10          HE21      GLN  10  -6.856   7.665 -15.953
   69   2HE2  GLN  10          HE22      GLN  10  -7.213   7.794 -17.631
   70    H    GLN  11           H        GLN  11  -7.253  10.690 -11.226
   71    HA   GLN  11           HA       GLN  11  -9.029   8.403 -10.862
   72   1HB   GLN  11          HB2       GLN  11  -6.101   8.549 -11.045
   73   2HB   GLN  11          HB1       GLN  11  -6.743   7.539  -9.759
   74   1HG   GLN  11          HG2       GLN  11  -7.547   7.314 -12.639
   75   2HG   GLN  11          HG1       GLN  11  -6.303   6.324 -11.867
   76   1HE2  GLN  11          HE21      GLN  11  -8.913   5.603 -12.993
   77   2HE2  GLN  11          HE22      GLN  11  -9.732   4.757 -11.722
   78    H    ASN  12           H        ASN  12 -10.241   8.981  -9.165
   79    HA   ASN  12           HA       ASN  12  -8.826   9.849  -6.768
   80   1HB   ASN  12          HB2       ASN  12 -11.072  10.313  -5.782
   81   2HB   ASN  12          HB1       ASN  12 -10.795  11.218  -7.258
   82   1HD2  ASN  12          HD21      ASN  12 -12.972  11.540  -7.541
   83   2HD2  ASN  12          HD22      ASN  12 -14.058  10.308  -8.060
   84    H    LYS  13           H        LYS  13  -9.716   7.108  -8.282
   85    HA   LYS  13           HA       LYS  13 -10.508   5.519  -5.996
   86   1HB   LYS  13          HB2       LYS  13  -9.728   4.694  -8.797
   87   2HB   LYS  13          HB1       LYS  13 -10.422   3.630  -7.597
   88   1HG   LYS  13          HG2       LYS  13 -11.782   6.033  -8.806
   89   2HG   LYS  13          HG1       LYS  13 -12.027   4.372  -9.318
   90   1HD   LYS  13          HD2       LYS  13 -12.626   5.392  -6.528
   91   2HD   LYS  13          HD1       LYS  13 -13.810   5.325  -7.823
   92   1HE   LYS  13          HE2       LYS  13 -14.184   3.402  -6.486
   93   2HE   LYS  13          HE1       LYS  13 -13.388   2.835  -7.940
   94   1HZ   LYS  13          HZ1       LYS  13 -12.565   1.819  -5.876
   95   2HZ   LYS  13          HZ2       LYS  13 -12.005   3.303  -5.343
   96   3HZ   LYS  13          HZ3       LYS  13 -11.336   2.575  -6.716
   97    H    LYS  14           H        LYS  14  -7.726   6.786  -7.080
   98    HA   LYS  14           HA       LYS  14  -6.067   4.552  -6.351
   99   1HB   LYS  14          HB2       LYS  14  -4.154   5.900  -7.083
  100   2HB   LYS  14          HB1       LYS  14  -5.380   5.839  -8.320
  101   1HG   LYS  14          HG2       LYS  14  -4.662   8.042  -8.395
  102   2HG   LYS  14          HG1       LYS  14  -6.122   8.140  -7.410
  103   1HD   LYS  14          HD2       LYS  14  -4.497   9.461  -6.286
  104   2HD   LYS  14          HD1       LYS  14  -4.594   7.932  -5.406
  105   1HE   LYS  14          HE2       LYS  14  -2.304   8.517  -5.606
  106   2HE   LYS  14          HE1       LYS  14  -2.592   7.135  -6.649
  107   1HZ   LYS  14          HZ1       LYS  14  -2.544   8.578  -8.574
  108   2HZ   LYS  14          HZ2       LYS  14  -1.219   8.967  -7.544
  109   3HZ   LYS  14          HZ3       LYS  14  -2.534   9.944  -7.569
  110    H    VAL  15           H        VAL  15  -4.240   4.990  -4.903
  111    HA   VAL  15           HA       VAL  15  -4.848   5.164  -2.319
  112    HB   VAL  15           HB       VAL  15  -2.678   4.679  -3.651
  113   1HG1  VAL  15          HG11      VAL  15  -0.836   6.288  -3.217
  114   2HG1  VAL  15          HG12      VAL  15  -2.096   7.453  -2.802
  115   3HG1  VAL  15          HG13      VAL  15  -2.043   6.763  -4.425
  116   1HG2  VAL  15          HG21      VAL  15  -2.935   3.994  -1.360
  117   2HG2  VAL  15          HG22      VAL  15  -2.564   5.632  -0.813
  118   3HG2  VAL  15          HG23      VAL  15  -1.317   4.670  -1.586
  119    H    GLU  16           H        GLU  16  -5.476   6.717  -0.832
  120    HA   GLU  16           HA       GLU  16  -5.386   9.510  -1.682
  121   1HB   GLU  16          HB2       GLU  16  -6.659   8.337   0.767
  122   2HB   GLU  16          HB1       GLU  16  -6.907   9.942   0.106
  123   1HG   GLU  16          HG2       GLU  16  -7.936   8.960  -1.854
  124   2HG   GLU  16          HG1       GLU  16  -7.654   7.357  -1.165
  125    H    GLY  17           H        GLY  17  -5.128   8.130   1.560
  126   1HA   GLY  17          HA2       GLY  17  -2.474   9.291   1.835
  127   2HA   GLY  17          HA1       GLY  17  -3.745   9.910   2.898
  128    H    GLY  18           H        GLY  18  -4.408   6.767   2.325
  129   1HA   GLY  18          HA2       GLY  18  -2.978   6.035   4.750
  130   2HA   GLY  18          HA1       GLY  18  -4.540   5.352   4.283
  131    H    TYR  19           H        TYR  19  -3.730   3.261   4.408
  132    HA   TYR  19           HA       TYR  19  -1.694   2.574   2.406
  133   1HB   TYR  19          HB2       TYR  19  -2.623   0.877   4.708
  134   2HB   TYR  19          HB1       TYR  19  -1.153   0.694   3.753
  135    HD1  TYR  19           HD1      TYR  19  -2.222   1.540   6.857
  136    HD2  TYR  19           HD2      TYR  19   0.244   3.119   3.775
  137    HE1  TYR  19           HE1      TYR  19  -1.113   2.946   8.485
  138    HE2  TYR  19           HE2      TYR  19   1.384   4.547   5.419
  139    HH   TYR  19           HH       TYR  19   0.762   5.552   7.595
  140    H    GLU  20           H        GLU  20  -2.414   1.888   0.678
  141    HA   GLU  20           HA       GLU  20  -5.060   0.693   0.419
  142   1HB   GLU  20          HB2       GLU  20  -4.446   2.533  -1.076
  143   2HB   GLU  20          HB1       GLU  20  -2.977   1.690  -1.543
  144   1HG   GLU  20          HG2       GLU  20  -4.566  -0.144  -2.373
  145   2HG   GLU  20          HG1       GLU  20  -5.813   1.085  -2.252
  146    H    CYS  21           H        CYS  21  -5.015  -1.488   0.544
  147    HA   CYS  21           HA       CYS  21  -2.640  -3.059   0.232
  148   1HB   CYS  21          HB2       CYS  21  -5.509  -3.948   0.021
  149   2HB   CYS  21          HB1       CYS  21  -4.123  -5.014   0.104
  150    H    LYS  22           H        LYS  22  -2.034  -4.314  -1.488
  151    HA   LYS  22           HA       LYS  22  -2.919  -3.575  -4.070
  152   1HB   LYS  22          HB2       LYS  22  -0.610  -4.205  -3.756
  153   2HB   LYS  22          HB1       LYS  22  -1.070  -5.783  -3.148
  154   1HG   LYS  22          HG2       LYS  22  -2.010  -5.134  -5.867
  155   2HG   LYS  22          HG1       LYS  22  -0.270  -5.348  -5.677
  156   1HD   LYS  22          HD2       LYS  22  -0.537  -7.523  -4.835
  157   2HD   LYS  22          HD1       LYS  22  -2.268  -7.311  -4.604
  158   1HE   LYS  22          HE2       LYS  22  -1.639  -8.708  -6.619
  159   2HE   LYS  22          HE1       LYS  22  -2.690  -7.332  -6.957
  160   1HZ   LYS  22          HZ1       LYS  22   0.244  -7.216  -7.249
  161   2HZ   LYS  22          HZ2       LYS  22  -0.900  -6.156  -7.903
  162   3HZ   LYS  22          HZ3       LYS  22  -0.756  -7.718  -8.504
  163    H    TYR  23           H        TYR  23  -3.918  -5.990  -1.824
  164    HA   TYR  23           HA       TYR  23  -5.229  -7.443  -3.961
  165   1HB   TYR  23          HB2       TYR  23  -5.554  -8.939  -1.604
  166   2HB   TYR  23          HB1       TYR  23  -4.494  -9.291  -2.958
  167    HD1  TYR  23           HD1      TYR  23  -2.094  -8.764  -2.824
  168    HD2  TYR  23           HD2      TYR  23  -4.680  -8.034   0.469
  169    HE1  TYR  23           HE1      TYR  23  -0.141  -8.553  -1.347
  170    HE2  TYR  23           HE2      TYR  23  -2.730  -7.816   1.955
  171    HH   TYR  23           HH       TYR  23  -0.350  -8.621   1.997
  172    H    CYS  24           H        CYS  24  -5.988  -5.013  -2.000
  173    HA   CYS  24           HA       CYS  24  -8.745  -5.444  -2.441
  174   1HB   CYS  24          HB2       CYS  24  -9.518  -5.305  -0.113
  175   2HB   CYS  24          HB1       CYS  24  -8.386  -6.642  -0.298
  176    H    THR  25           H        THR  25  -9.752  -3.472  -2.661
  177    HA   THR  25           HA       THR  25  -7.939  -1.232  -2.750
  178    HB   THR  25           HB       THR  25 -10.890  -1.220  -3.491
  179    HG1  THR  25           HG1      THR  25 -10.126  -2.852  -4.681
  180   1HG2  THR  25          HG21      THR  25 -10.188   0.503  -5.088
  181   2HG2  THR  25          HG22      THR  25  -8.506   0.296  -4.595
  182   3HG2  THR  25          HG23      THR  25  -9.682   0.956  -3.457
  183    H    PHE  26           H        PHE  26  -9.278  -2.545  -0.282
  184    HA   PHE  26           HA       PHE  26 -10.610  -0.330   0.972
  185   1HB   PHE  26          HB2       PHE  26 -11.276  -2.653   1.529
  186   2HB   PHE  26          HB1       PHE  26  -9.653  -2.977   2.120
  187    HD1  PHE  26           HD1      PHE  26  -9.113  -2.559   4.361
  188    HD2  PHE  26           HD2      PHE  26 -12.626  -0.834   2.696
  189    HE1  PHE  26           HE1      PHE  26  -9.785  -1.788   6.596
  190    HE2  PHE  26           HE2      PHE  26 -13.305  -0.060   4.926
  191    HZ   PHE  26           HZ       PHE  26 -11.888  -0.535   6.879
  192    H    GLN  27           H        GLN  27  -9.463   1.286   1.566
  193    HA   GLN  27           HA       GLN  27  -6.693   0.889   2.356
  194   1HB   GLN  27          HB2       GLN  27  -6.582   2.275   0.512
  195   2HB   GLN  27          HB1       GLN  27  -8.087   3.094   0.913
  196   1HG   GLN  27          HG2       GLN  27  -7.017   4.403   2.576
  197   2HG   GLN  27          HG1       GLN  27  -5.580   3.385   2.492
  198   1HE2  GLN  27          HE21      GLN  27  -4.085   3.857   1.144
  199   2HE2  GLN  27          HE22      GLN  27  -4.090   5.125  -0.016
  200    H    THR  28           H        THR  28  -5.954   1.742   4.207
  201    HA   THR  28           HA       THR  28  -7.634   3.467   5.778
  202    HB   THR  28           HB       THR  28  -8.293   1.315   6.642
  203    HG1  THR  28           HG1      THR  28  -8.152   2.085   8.536
  204   1HG2  THR  28          HG21      THR  28  -5.362   0.734   7.061
  205   2HG2  THR  28          HG22      THR  28  -6.388  -0.028   5.845
  206   3HG2  THR  28          HG23      THR  28  -6.688  -0.305   7.563
  207    HA   PRO  29           HA       PRO  29  -3.487   5.140   6.403
  208   1HB   PRO  29          HB2       PRO  29  -4.198   7.201   8.012
  209   2HB   PRO  29          HB1       PRO  29  -4.445   7.206   6.255
  210   1HG   PRO  29          HG2       PRO  29  -6.408   6.572   8.430
  211   2HG   PRO  29          HG1       PRO  29  -6.623   7.599   7.000
  212   1HD   PRO  29          HD2       PRO  29  -7.533   5.055   7.076
  213   2HD   PRO  29          HD1       PRO  29  -6.891   5.774   5.578
  214    H    ASP  30           H        ASP  30  -5.422   3.575   8.586
  215    HA   ASP  30           HA       ASP  30  -3.606   3.951  10.829
  216   1HB   ASP  30          HB2       ASP  30  -6.176   2.384  10.576
  217   2HB   ASP  30          HB1       ASP  30  -5.246   2.562  12.057
  218    H    LEU  31           H        LEU  31  -1.834   2.738  10.668
  219    HA   LEU  31           HA       LEU  31  -1.382   0.565   9.076
  220   1HB   LEU  31          HB2       LEU  31   0.161   2.072  10.555
  221   2HB   LEU  31          HB1       LEU  31  -0.032   0.799  11.738
  222    HG   LEU  31           HG       LEU  31   2.046   0.452  10.596
  223   1HD1  LEU  31          HD11      LEU  31   1.774  -1.741   9.540
  224   2HD1  LEU  31          HD12      LEU  31   0.025  -1.454   9.508
  225   3HD1  LEU  31          HD13      LEU  31   0.858  -1.603  11.051
  226   1HD2  LEU  31          HD21      LEU  31   1.586   1.797   8.659
  227   2HD2  LEU  31          HD22      LEU  31   0.477   0.580   8.053
  228   3HD2  LEU  31          HD23      LEU  31   2.208   0.214   8.172
  229    H    ASN  32           H        ASN  32  -2.473   0.625  12.502
  230    HA   ASN  32           HA       ASN  32  -2.334  -2.119  12.885
  231   1HB   ASN  32          HB2       ASN  32  -2.727  -0.186  14.610
  232   2HB   ASN  32          HB1       ASN  32  -4.425  -0.442  14.196
  233   1HD2  ASN  32          HD21      ASN  32  -3.987  -3.397  13.809
  234   2HD2  ASN  32          HD22      ASN  32  -3.830  -4.008  15.387
  235    H    MET  33           H        MET  33  -4.925  -0.050  11.634
  236    HA   MET  33           HA       MET  33  -6.848  -2.172  11.458
  237   1HB   MET  33          HB2       MET  33  -6.771   0.389   9.853
  238   2HB   MET  33          HB1       MET  33  -8.155  -0.673  10.047
  239   1HG   MET  33          HG2       MET  33  -6.809   0.878  12.205
  240   2HG   MET  33          HG1       MET  33  -8.310   1.345  11.402
  241   1HE   MET  33          HE1       MET  33  -7.987   1.187  14.542
  242   2HE   MET  33          HE2       MET  33  -9.487   0.379  14.995
  243   3HE   MET  33          HE3       MET  33  -9.498   1.617  13.739
  244    H    PHE  34           H        PHE  34  -4.411  -0.817   9.407
  245    HA   PHE  34           HA       PHE  34  -5.078  -2.126   7.023
  246   1HB   PHE  34          HB2       PHE  34  -3.516  -0.297   6.967
  247   2HB   PHE  34          HB1       PHE  34  -2.434  -1.095   8.077
  248    HD1  PHE  34           HD1      PHE  34  -3.867  -1.341   4.654
  249    HD2  PHE  34           HD2      PHE  34  -0.722  -2.476   7.286
  250    HE1  PHE  34           HE1      PHE  34  -2.633  -2.297   2.756
  251    HE2  PHE  34           HE2      PHE  34   0.523  -3.433   5.385
  252    HZ   PHE  34           HZ       PHE  34  -0.435  -3.344   3.118
  253    H    THR  35           H        THR  35  -2.707  -3.002   9.479
  254    HA   THR  35           HA       THR  35  -2.210  -5.488   8.205
  255    HB   THR  35           HB       THR  35  -0.399  -4.441   9.455
  256    HG1  THR  35           HG1      THR  35   0.258  -6.395   9.698
  257   1HG2  THR  35          HG21      THR  35  -0.405  -4.356  11.924
  258   2HG2  THR  35          HG22      THR  35  -2.093  -4.892  11.912
  259   3HG2  THR  35          HG23      THR  35  -1.645  -3.343  11.188
  260    H    PHE  36           H        PHE  36  -4.421  -4.447  10.647
  261    HA   PHE  36           HA       PHE  36  -5.093  -6.979  11.676
  262   1HB   PHE  36          HB2       PHE  36  -5.827  -5.177  12.983
  263   2HB   PHE  36          HB1       PHE  36  -6.546  -4.343  11.619
  264    HD1  PHE  36           HD1      PHE  36  -8.824  -4.276  11.637
  265    HD2  PHE  36           HD2      PHE  36  -6.885  -7.664  13.284
  266    HE1  PHE  36           HE1      PHE  36 -11.024  -5.235  12.208
  267    HE2  PHE  36           HE2      PHE  36  -9.075  -8.642  13.875
  268    HZ   PHE  36           HZ       PHE  36 -11.145  -7.424  13.332
  269    H    HIS  37           H        HIS  37  -6.630  -5.022   9.131
  270    HA   HIS  37           HA       HIS  37  -8.474  -7.090   8.602
  271   1HB   HIS  37          HB2       HIS  37  -9.443  -5.727   6.939
  272   2HB   HIS  37          HB1       HIS  37  -8.692  -4.571   8.027
  273    HD1  HIS  37           HD1      HIS  37  -6.952  -3.007   7.020
  274    HD2  HIS  37           HD2      HIS  37  -8.140  -6.051   4.464
  275    HE1  HIS  37           HE1      HIS  37  -6.031  -2.395   4.740
  276    H    VAL  38           H        VAL  38  -5.289  -6.425   7.509
  277    HA   VAL  38           HA       VAL  38  -5.274  -8.223   5.330
  278    HB   VAL  38           HB       VAL  38  -3.056  -7.198   7.098
  279   1HG1  VAL  38          HG11      VAL  38  -1.453  -8.149   5.445
  280   2HG1  VAL  38          HG12      VAL  38  -2.804  -8.905   4.597
  281   3HG1  VAL  38          HG13      VAL  38  -2.400  -9.409   6.239
  282   1HG2  VAL  38          HG21      VAL  38  -3.775  -6.601   4.225
  283   2HG2  VAL  38          HG22      VAL  38  -2.388  -5.935   5.085
  284   3HG2  VAL  38          HG23      VAL  38  -4.024  -5.543   5.612
  285    H    ASP  39           H        ASP  39  -4.171  -8.597   8.699
  286    HA   ASP  39           HA       ASP  39  -3.522 -11.328   8.507
  287   1HB   ASP  39          HB2       ASP  39  -2.664  -9.915  10.296
  288   2HB   ASP  39          HB1       ASP  39  -4.287  -9.641  10.903
  289    H    SER  40           H        SER  40  -6.443  -9.738   8.927
  290    HA   SER  40           HA       SER  40  -7.910 -12.028   9.908
  291   1HB   SER  40          HB2       SER  40  -8.521  -9.751  10.636
  292   2HB   SER  40          HB1       SER  40  -8.915  -9.334   8.975
  293    HG   SER  40           HG       SER  40 -10.640 -10.721   9.014
  294    H    GLU  41           H        GLU  41  -7.754 -10.164   6.862
  295    HA   GLU  41           HA       GLU  41  -9.722 -12.045   5.747
  296   1HB   GLU  41          HB2       GLU  41  -8.800  -9.436   4.558
  297   2HB   GLU  41          HB1       GLU  41 -10.157 -10.419   4.033
  298   1HG   GLU  41          HG2       GLU  41  -9.913  -8.935   6.638
  299   2HG   GLU  41          HG1       GLU  41 -10.943  -8.512   5.275
  300    H    HIS  42           H        HIS  42  -6.474 -10.752   5.097
  301    HA   HIS  42           HA       HIS  42  -6.094 -12.875   3.221
  302   1HB   HIS  42          HB2       HIS  42  -4.601 -10.885   2.138
  303   2HB   HIS  42          HB1       HIS  42  -6.160 -11.394   1.491
  304    HD1  HIS  42           HD1      HIS  42  -8.184  -9.691   2.024
  305    HD2  HIS  42           HD2      HIS  42  -4.418  -8.294   3.127
  306    HE1  HIS  42           HE1      HIS  42  -8.464  -7.248   2.405
  307    HA   PRO  43           HA       PRO  43  -2.710 -12.404   6.389
  308   1HB   PRO  43          HB2       PRO  43  -2.754 -14.973   7.331
  309   2HB   PRO  43          HB1       PRO  43  -3.781 -13.699   7.994
  310   1HG   PRO  43          HG2       PRO  43  -4.455 -15.816   5.980
  311   2HG   PRO  43          HG1       PRO  43  -5.401 -15.267   7.375
  312   1HD   PRO  43          HD2       PRO  43  -5.913 -14.428   4.846
  313   2HD   PRO  43          HD1       PRO  43  -6.170 -13.393   6.265
  314    H    ASN  44           H        ASN  44  -3.614 -14.470   3.899
  315    HA   ASN  44           HA       ASN  44  -0.954 -14.989   2.878
  316   1HB   ASN  44          HB2       ASN  44  -1.785 -17.012   4.247
  317   2HB   ASN  44          HB1       ASN  44  -3.130 -17.104   3.124
  318   1HD2  ASN  44          HD21      ASN  44  -1.097 -19.021   3.739
  319   2HD2  ASN  44          HD22      ASN  44  -0.284 -19.410   2.261
  320    H    VAL  45           H        VAL  45  -1.234 -15.086   0.503
  321    HA   VAL  45           HA       VAL  45  -3.802 -14.818  -0.609
  322    HB   VAL  45           HB       VAL  45  -3.464 -12.646   0.589
  323   1HG1  VAL  45          HG11      VAL  45  -1.985 -10.951  -0.298
  324   2HG1  VAL  45          HG12      VAL  45  -1.241 -12.165  -1.344
  325   3HG1  VAL  45          HG13      VAL  45  -1.144 -12.327   0.414
  326   1HG2  VAL  45          HG21      VAL  45  -5.005 -12.730  -1.239
  327   2HG2  VAL  45          HG22      VAL  45  -3.702 -12.397  -2.396
  328   3HG2  VAL  45          HG23      VAL  45  -4.180 -11.170  -1.212
  329    H    VAL  46           H        VAL  46  -3.448 -14.083  -3.012
  330    HA   VAL  46           HA       VAL  46  -1.858 -15.879  -4.337
  331    HB   VAL  46           HB       VAL  46  -2.859 -13.209  -5.367
  332   1HG1  VAL  46          HG11      VAL  46  -1.132 -14.129  -6.833
  333   2HG1  VAL  46          HG12      VAL  46  -2.720 -14.220  -7.597
  334   3HG1  VAL  46          HG13      VAL  46  -1.997 -15.663  -6.886
  335   1HG2  VAL  46          HG21      VAL  46  -4.624 -14.622  -4.480
  336   2HG2  VAL  46          HG22      VAL  46  -4.078 -15.958  -5.494
  337   3HG2  VAL  46          HG23      VAL  46  -4.731 -14.493  -6.235
  338    H    LEU  47           H        LEU  47   0.171 -16.012  -4.974
  339    HA   LEU  47           HA       LEU  47   2.070 -14.064  -4.069
  340   1HB   LEU  47          HB2       LEU  47   2.537 -16.528  -5.751
  341   2HB   LEU  47          HB1       LEU  47   3.744 -15.632  -4.858
  342    HG   LEU  47           HG       LEU  47   1.512 -17.287  -3.671
  343   1HD1  LEU  47          HD11      LEU  47   3.288 -18.764  -2.910
  344   2HD1  LEU  47          HD12      LEU  47   4.469 -17.778  -3.772
  345   3HD1  LEU  47          HD13      LEU  47   3.221 -18.649  -4.668
  346   1HD2  LEU  47          HD21      LEU  47   2.604 -16.902  -1.512
  347   2HD2  LEU  47          HD22      LEU  47   2.024 -15.399  -2.223
  348   3HD2  LEU  47          HD23      LEU  47   3.743 -15.799  -2.287
  349    H    ASN  48           H        ASN  48   1.672 -12.249  -5.276
  350    HA   ASN  48           HA       ASN  48   2.117 -12.439  -8.187
  351   1HB   ASN  48          HB2       ASN  48  -0.239 -11.894  -7.469
  352   2HB   ASN  48          HB1       ASN  48   0.374 -10.439  -6.701
  353   1HD2  ASN  48          HD21      ASN  48  -0.308 -12.032  -9.717
  354   2HD2  ASN  48          HD22      ASN  48  -0.199 -10.649 -10.719
  355    H    SER  49           H        SER  49   2.823 -10.016  -9.019
  356    HA   SER  49           HA       SER  49   5.076  -9.289  -7.292
  357   1HB   SER  49          HB2       SER  49   4.687  -8.815 -10.250
  358   2HB   SER  49          HB1       SER  49   6.178  -8.611  -9.325
  359    HG   SER  49           HG       SER  49   5.468 -11.005  -8.771
  360    H    SER  50           H        SER  50   5.148  -7.176  -6.433
  361    HA   SER  50           HA       SER  50   3.609  -5.045  -7.482
  362   1HB   SER  50          HB2       SER  50   2.930  -6.444  -4.910
  363   2HB   SER  50          HB1       SER  50   2.308  -4.870  -5.401
  364    HG   SER  50           HG       SER  50   2.082  -6.619  -7.361
  365    H    TYR  51           H        TYR  51   3.773  -3.210  -5.714
  366    HA   TYR  51           HA       TYR  51   6.497  -3.230  -4.643
  367   1HB   TYR  51          HB2       TYR  51   4.888  -1.190  -6.055
  368   2HB   TYR  51          HB1       TYR  51   5.908  -0.634  -4.754
  369    HD1  TYR  51           HD1      TYR  51   6.735  -3.404  -7.099
  370    HD2  TYR  51           HD2      TYR  51   7.444   0.635  -5.972
  371    HE1  TYR  51           HE1      TYR  51   8.647  -3.317  -8.637
  372    HE2  TYR  51           HE2      TYR  51   9.369   0.725  -7.507
  373    HH   TYR  51           HH       TYR  51   9.960  -1.789  -9.786
  374    H    VAL  52           H        VAL  52   6.848  -2.576  -2.621
  375    HA   VAL  52           HA       VAL  52   4.544  -1.759  -0.983
  376    HB   VAL  52           HB       VAL  52   5.033  -4.171  -0.662
  377   1HG1  VAL  52          HG11      VAL  52   7.331  -4.145  -1.235
  378   2HG1  VAL  52          HG12      VAL  52   7.056  -4.897   0.327
  379   3HG1  VAL  52          HG13      VAL  52   7.709  -3.254   0.243
  380   1HG2  VAL  52          HG21      VAL  52   5.386  -4.229   1.753
  381   2HG2  VAL  52          HG22      VAL  52   4.193  -3.035   1.258
  382   3HG2  VAL  52          HG23      VAL  52   5.819  -2.516   1.714
  383    H    CYS  53           H        CYS  53   5.002  -0.172   0.472
  384    HA   CYS  53           HA       CYS  53   7.643   1.083   0.463
  385   1HB   CYS  53          HB2       CYS  53   5.744   2.507   0.566
  386   2HB   CYS  53          HB1       CYS  53   5.052   1.647   1.931
  387    H    VAL  54           H        VAL  54   9.113  -0.180   1.476
  388    HA   VAL  54           HA       VAL  54   8.632  -2.028   3.491
  389    HB   VAL  54           HB       VAL  54  11.191  -0.744   3.809
  390   1HG1  VAL  54          HG11      VAL  54  12.026  -2.894   3.326
  391   2HG1  VAL  54          HG12      VAL  54  10.449  -3.327   2.679
  392   3HG1  VAL  54          HG13      VAL  54  10.625  -3.029   4.432
  393   1HG2  VAL  54          HG21      VAL  54  10.307  -1.402   1.049
  394   2HG2  VAL  54          HG22      VAL  54  12.000  -1.478   1.538
  395   3HG2  VAL  54          HG23      VAL  54  11.104   0.035   1.658
  396    H    GLU  55           H        GLU  55   9.031   1.373   3.617
  397    HA   GLU  55           HA       GLU  55   9.815   1.642   6.266
  398   1HB   GLU  55          HB2       GLU  55   8.159   3.599   4.706
  399   2HB   GLU  55          HB1       GLU  55   9.273   3.973   6.019
  400   1HG   GLU  55          HG2       GLU  55  10.026   2.911   3.298
  401   2HG   GLU  55          HG1       GLU  55  10.174   4.578   3.828
  402    H    CYS  56           H        CYS  56   6.792   1.440   4.642
  403    HA   CYS  56           HA       CYS  56   5.249   1.723   7.191
  404   1HB   CYS  56          HB2       CYS  56   4.166   1.605   4.399
  405   2HB   CYS  56          HB1       CYS  56   3.331   2.194   5.842
  406    H    ASN  57           H        ASN  57   6.383  -0.538   5.031
  407    HA   ASN  57           HA       ASN  57   5.905  -2.564   4.279
  408   1HB   ASN  57          HB2       ASN  57   5.061  -2.635   7.098
  409   2HB   ASN  57          HB1       ASN  57   4.929  -4.131   6.125
  410   1HD2  ASN  57          HD21      ASN  57   7.452  -3.483   4.652
  411   2HD2  ASN  57          HD22      ASN  57   8.659  -3.787   5.838
  412    H    PHE  58           H        PHE  58   4.309  -1.179   2.962
  413    HA   PHE  58           HA       PHE  58   1.679  -2.409   3.249
  414   1HB   PHE  58          HB2       PHE  58   0.508  -0.473   3.448
  415   2HB   PHE  58          HB1       PHE  58   2.028   0.225   3.957
  416    HD1  PHE  58           HD1      PHE  58  -0.391  -0.058   1.251
  417    HD2  PHE  58           HD2      PHE  58   3.202   1.800   2.500
  418    HE1  PHE  58           HE1      PHE  58  -0.617   1.608  -0.572
  419    HE2  PHE  58           HE2      PHE  58   2.973   3.473   0.633
  420    HZ   PHE  58           HZ       PHE  58   1.077   3.347  -0.863
  421    H    LEU  59           H        LEU  59   0.997  -3.282   1.472
  422    HA   LEU  59           HA       LEU  59   2.555  -2.952  -0.960
  423   1HB   LEU  59          HB2       LEU  59   0.918  -5.092   0.213
  424   2HB   LEU  59          HB1       LEU  59   0.846  -4.962  -1.529
  425    HG   LEU  59           HG       LEU  59   3.436  -5.210  -0.048
  426   1HD1  LEU  59          HD11      LEU  59   3.282  -7.565  -0.596
  427   2HD1  LEU  59          HD12      LEU  59   1.747  -7.277  -1.415
  428   3HD1  LEU  59          HD13      LEU  59   1.854  -7.106   0.341
  429   1HD2  LEU  59          HD21      LEU  59   2.571  -5.603  -2.921
  430   2HD2  LEU  59          HD22      LEU  59   4.168  -5.940  -2.296
  431   3HD2  LEU  59          HD23      LEU  59   3.568  -4.286  -2.313
  432    H    THR  60           H        THR  60   1.636  -2.045  -2.747
  433    HA   THR  60           HA       THR  60  -1.206  -1.363  -2.553
  434    HB   THR  60           HB       THR  60  -0.243   0.679  -2.134
  435    HG1  THR  60           HG1      THR  60  -1.651   1.025  -3.939
  436   1HG2  THR  60          HG21      THR  60   1.868   0.183  -4.222
  437   2HG2  THR  60          HG22      THR  60   2.055  -0.011  -2.481
  438   3HG2  THR  60          HG23      THR  60   1.776   1.581  -3.144
  439    H    LYS  61           H        LYS  61  -2.248  -0.854  -4.571
  440    HA   LYS  61           HA       LYS  61  -1.975  -3.018  -6.400
  441   1HB   LYS  61          HB2       LYS  61  -3.648  -0.512  -6.591
  442   2HB   LYS  61          HB1       LYS  61  -3.878  -1.993  -7.505
  443   1HG   LYS  61          HG2       LYS  61  -4.536  -3.183  -5.539
  444   2HG   LYS  61          HG1       LYS  61  -4.080  -1.827  -4.507
  445   1HD   LYS  61          HD2       LYS  61  -6.489  -1.892  -4.759
  446   2HD   LYS  61          HD1       LYS  61  -5.848  -0.466  -5.567
  447   1HE   LYS  61          HE2       LYS  61  -5.976  -1.643  -7.712
  448   2HE   LYS  61          HE1       LYS  61  -6.629  -3.056  -6.888
  449   1HZ   LYS  61          HZ1       LYS  61  -8.524  -1.654  -6.183
  450   2HZ   LYS  61          HZ2       LYS  61  -8.397  -1.824  -7.843
  451   3HZ   LYS  61          HZ3       LYS  61  -7.909  -0.384  -7.126
  452    H    ARG  62           H        ARG  62  -0.600   0.075  -6.200
  453    HA   ARG  62           HA       ARG  62   0.020   0.136  -9.073
  454   1HB   ARG  62          HB2       ARG  62  -0.394   2.575  -8.996
  455   2HB   ARG  62          HB1       ARG  62  -1.834   1.590  -8.764
  456   1HG   ARG  62          HG2       ARG  62  -1.647   1.950  -6.319
  457   2HG   ARG  62          HG1       ARG  62  -0.277   3.020  -6.612
  458   1HD   ARG  62          HD2       ARG  62  -2.341   4.282  -6.313
  459   2HD   ARG  62          HD1       ARG  62  -1.698   4.500  -7.925
  460    HE   ARG  62           HE       ARG  62  -4.014   2.836  -7.195
  461   1HH1  ARG  62          HH11      ARG  62  -2.090   4.406  -9.789
  462   2HH1  ARG  62          HH12      ARG  62  -3.363   4.333 -10.907
  463   1HH2  ARG  62          HH21      ARG  62  -5.691   2.727  -8.773
  464   2HH2  ARG  62          HH22      ARG  62  -5.456   3.330 -10.352
  465    H    TYR  63           H        TYR  63   1.824   1.628  -9.570
  466    HA   TYR  63           HA       TYR  63   3.915   1.446  -7.591
  467   1HB   TYR  63          HB2       TYR  63   3.947   2.671 -10.360
  468   2HB   TYR  63          HB1       TYR  63   5.352   2.469  -9.336
  469    HD1  TYR  63           HD1      TYR  63   3.630   1.139 -12.043
  470    HD2  TYR  63           HD2      TYR  63   5.676  -0.077  -8.522
  471    HE1  TYR  63           HE1      TYR  63   4.048  -1.063 -13.053
  472    HE2  TYR  63           HE2      TYR  63   6.094  -2.280  -9.521
  473    HH   TYR  63           HH       TYR  63   5.125  -3.721 -11.265
  474    H    ASP  64           H        ASP  64   1.623   3.685  -8.698
  475    HA   ASP  64           HA       ASP  64   2.841   6.199  -8.352
  476   1HB   ASP  64          HB2       ASP  64  -0.031   5.693  -7.556
  477   2HB   ASP  64          HB1       ASP  64   0.670   7.189  -8.119
  478    H    ALA  65           H        ALA  65   1.155   4.232  -6.068
  479    HA   ALA  65           HA       ALA  65   1.052   6.107  -4.038
  480   1HB   ALA  65          HB1       ALA  65   0.479   4.215  -2.614
  481   2HB   ALA  65          HB2       ALA  65   0.993   3.119  -3.918
  482   3HB   ALA  65          HB3       ALA  65  -0.371   4.193  -4.162
  483    H    LEU  66           H        LEU  66   3.638   4.024  -5.027
  484    HA   LEU  66           HA       LEU  66   5.122   4.430  -2.577
  485   1HB   LEU  66          HB2       LEU  66   6.088   3.378  -5.186
  486   2HB   LEU  66          HB1       LEU  66   6.965   3.289  -3.668
  487    HG   LEU  66           HG       LEU  66   6.193   1.163  -3.943
  488   1HD1  LEU  66          HD11      LEU  66   4.037   2.473  -2.329
  489   2HD1  LEU  66          HD12      LEU  66   5.612   1.947  -1.728
  490   3HD1  LEU  66          HD13      LEU  66   4.435   0.757  -2.301
  491   1HD2  LEU  66          HD21      LEU  66   3.583   2.287  -4.914
  492   2HD2  LEU  66          HD22      LEU  66   3.942   0.567  -4.726
  493   3HD2  LEU  66          HD23      LEU  66   4.856   1.550  -5.874
  494    H    SER  67           H        SER  67   4.964   5.726  -5.808
  495    HA   SER  67           HA       SER  67   7.456   7.164  -5.810
  496   1HB   SER  67          HB2       SER  67   4.929   7.090  -7.307
  497   2HB   SER  67          HB1       SER  67   6.154   8.279  -7.761
  498    HG   SER  67           HG       SER  67   6.555   5.432  -7.551
  499    H    GLU  68           H        GLU  68   4.114   8.003  -5.397
  500    HA   GLU  68           HA       GLU  68   4.714  10.698  -4.709
  501   1HB   GLU  68          HB2       GLU  68   2.037   9.596  -4.047
  502   2HB   GLU  68          HB1       GLU  68   2.519  11.118  -4.747
  503   1HG   GLU  68          HG2       GLU  68   3.200   9.741  -6.819
  504   2HG   GLU  68          HG1       GLU  68   2.263   8.510  -6.078
  505    H    HIS  69           H        HIS  69   4.583   7.794  -3.113
  506    HA   HIS  69           HA       HIS  69   3.585   8.227  -0.612
  507   1HB   HIS  69          HB2       HIS  69   4.694   6.153  -1.551
  508   2HB   HIS  69          HB1       HIS  69   6.206   6.854  -0.938
  509    HD1  HIS  69           HD1      HIS  69   2.860   5.615   0.259
  510    HD2  HIS  69           HD2      HIS  69   6.641   6.507   1.610
  511    HE1  HIS  69           HE1      HIS  69   2.905   4.836   2.662
  512    H    ASN  70           H        ASN  70   7.045   8.784  -1.397
  513    HA   ASN  70           HA       ASN  70   7.592  10.227   1.008
  514   1HB   ASN  70          HB2       ASN  70   9.738  10.810  -0.130
  515   2HB   ASN  70          HB1       ASN  70   9.418   9.090  -0.014
  516   1HD2  ASN  70          HD21      ASN  70  11.182  10.149  -1.700
  517   2HD2  ASN  70          HD22      ASN  70  10.622   9.861  -3.355
  518    H    LEU  71           H        LEU  71   6.061  11.143  -1.729
  519    HA   LEU  71           HA       LEU  71   6.676  13.952  -1.556
  520   1HB   LEU  71          HB2       LEU  71   6.203  13.308  -3.728
  521   2HB   LEU  71          HB1       LEU  71   4.963  12.181  -3.247
  522    HG   LEU  71           HG       LEU  71   3.439  13.996  -2.864
  523   1HD1  LEU  71          HD11      LEU  71   5.668  15.754  -3.980
  524   2HD1  LEU  71          HD12      LEU  71   5.043  15.812  -2.330
  525   3HD1  LEU  71          HD13      LEU  71   4.017  16.297  -3.680
  526   1HD2  LEU  71          HD21      LEU  71   4.715  14.026  -5.585
  527   2HD2  LEU  71          HD22      LEU  71   3.097  14.613  -5.210
  528   3HD2  LEU  71          HD23      LEU  71   3.485  12.907  -5.008
  529    H    LYS  72           H        LYS  72   3.910  11.880  -0.824
  530    HA   LYS  72           HA       LYS  72   2.713  14.118   0.650
  531   1HB   LYS  72          HB2       LYS  72   0.667  12.291   0.343
  532   2HB   LYS  72          HB1       LYS  72   0.880  13.761  -0.595
  533   1HG   LYS  72          HG2       LYS  72   2.309  12.280  -2.117
  534   2HG   LYS  72          HG1       LYS  72   1.620  10.948  -1.229
  535   1HD   LYS  72          HD2       LYS  72  -0.009  13.012  -2.687
  536   2HD   LYS  72          HD1       LYS  72   0.446  11.429  -3.322
  537   1HE   LYS  72          HE2       LYS  72  -1.728  10.997  -2.512
  538   2HE   LYS  72          HE1       LYS  72  -0.665  10.555  -1.176
  539   1HZ   LYS  72          HZ1       LYS  72  -2.556  11.712  -0.461
  540   2HZ   LYS  72          HZ2       LYS  72  -2.160  13.077  -1.343
  541   3HZ   LYS  72          HZ3       LYS  72  -1.176  12.574  -0.051
  542    H    TYR  73           H        TYR  73   3.455  10.828   0.922
  543    HA   TYR  73           HA       TYR  73   2.244  10.511   3.545
  544   1HB   TYR  73          HB2       TYR  73   3.859   8.641   1.841
  545   2HB   TYR  73          HB1       TYR  73   3.115   8.164   3.373
  546    HD1  TYR  73           HD1      TYR  73   2.230   9.683   0.045
  547    HD2  TYR  73           HD2      TYR  73   1.030   7.128   3.235
  548    HE1  TYR  73           HE1      TYR  73   0.294   9.063  -1.198
  549    HE2  TYR  73           HE2      TYR  73  -0.998   6.535   1.951
  550    HH   TYR  73           HH       TYR  73  -2.342   7.750   0.190
  551    H    HIS  74           H        HIS  74   5.566  10.094   2.192
  552    HA   HIS  74           HA       HIS  74   6.667  10.806   4.875
  553   1HB   HIS  74          HB2       HIS  74   7.910   9.112   2.688
  554   2HB   HIS  74          HB1       HIS  74   8.777   9.596   4.133
  555    HD1  HIS  74           HD1      HIS  74   6.445   8.714   6.182
  556    HD2  HIS  74           HD2      HIS  74   7.961   6.506   3.019
  557    HE1  HIS  74           HE1      HIS  74   5.878   6.318   6.681
  558    HA   PRO  75           HA       PRO  75   7.818  14.058   1.723
  559   1HB   PRO  75          HB2       PRO  75   7.112  16.203   3.091
  560   2HB   PRO  75          HB1       PRO  75   5.909  15.233   2.214
  561   1HG   PRO  75          HG2       PRO  75   6.603  15.136   5.148
  562   2HG   PRO  75          HG1       PRO  75   4.991  15.198   4.401
  563   1HD   PRO  75          HD2       PRO  75   6.101  12.871   5.228
  564   2HD   PRO  75          HD1       PRO  75   5.061  12.991   3.796
  565    H    GLY  76           H        GLY  76   9.552  15.297   1.571
  566   1HA   GLY  76          HA2       GLY  76  10.960  16.736   3.312
  567   2HA   GLY  76          HA1       GLY  76  11.536  15.109   3.659
  568    H    GLU  77           H        GLU  77  11.656  13.927   1.357
  569    HA   GLU  77           HA       GLU  77  13.114  15.479  -0.599
  570   1HB   GLU  77          HB2       GLU  77  15.133  14.061  -0.432
  571   2HB   GLU  77          HB1       GLU  77  14.891  15.020   1.016
  572   1HG   GLU  77          HG2       GLU  77  15.091  13.162   2.204
  573   2HG   GLU  77          HG1       GLU  77  13.600  12.575   1.460
  574    H    GLU  78           H        GLU  78  13.911  13.776  -2.343
  575    HA   GLU  78           HA       GLU  78  11.781  11.758  -2.435
  576   1HB   GLU  78          HB2       GLU  78  11.183  13.830  -3.719
  577   2HB   GLU  78          HB1       GLU  78  12.595  13.488  -4.714
  578   1HG   GLU  78          HG2       GLU  78  11.654  11.490  -5.523
  579   2HG   GLU  78          HG1       GLU  78  10.303  11.576  -4.390
  580    H    ASN  79           H        ASN  79  13.289  10.156  -1.978
  581    HA   ASN  79           HA       ASN  79  14.894   9.264  -4.231
  582   1HB   ASN  79          HB2       ASN  79  16.012   9.802  -1.491
  583   2HB   ASN  79          HB1       ASN  79  16.916   8.957  -2.762
  584   1HD2  ASN  79          HD21      ASN  79  15.708  11.909  -1.562
  585   2HD2  ASN  79          HD22      ASN  79  16.454  13.020  -2.659
  586    H    PHE  80           H        PHE  80  13.591   7.488  -4.309
  587    HA   PHE  80           HA       PHE  80  13.484   5.760  -1.946
  588   1HB   PHE  80          HB2       PHE  80  11.616   6.347  -4.103
  589   2HB   PHE  80          HB1       PHE  80  11.867   4.627  -3.882
  590    HD1  PHE  80           HD1      PHE  80  10.069   7.479  -2.797
  591    HD2  PHE  80           HD2      PHE  80  11.581   3.754  -1.461
  592    HE1  PHE  80           HE1      PHE  80   8.362   7.418  -0.993
  593    HE2  PHE  80           HE2      PHE  80   9.876   3.679   0.289
  594    HZ   PHE  80           HZ       PHE  80   8.261   5.511   0.519
  595    H    LYS  81           H        LYS  81  14.124   3.632  -2.107
  596    HA   LYS  81           HA       LYS  81  15.791   2.944  -4.439
  597   1HB   LYS  81          HB2       LYS  81  17.391   2.116  -2.976
  598   2HB   LYS  81          HB1       LYS  81  16.594   3.271  -1.901
  599   1HG   LYS  81          HG2       LYS  81  15.256   1.577  -0.921
  600   2HG   LYS  81          HG1       LYS  81  15.836   0.386  -2.071
  601   1HD   LYS  81          HD2       LYS  81  18.156   0.941  -1.129
  602   2HD   LYS  81          HD1       LYS  81  17.241   1.653   0.210
  603   1HE   LYS  81          HE2       LYS  81  15.998  -0.458   0.447
  604   2HE   LYS  81          HE1       LYS  81  16.999  -1.153  -0.817
  605   1HZ   LYS  81          HZ1       LYS  81  18.016  -0.109   1.775
  606   2HZ   LYS  81          HZ2       LYS  81  18.945  -0.918   0.608
  607   3HZ   LYS  81          HZ3       LYS  81  17.734  -1.719   1.445
  608    H    LEU  82           H        LEU  82  15.877   0.457  -4.718
  609    HA   LEU  82           HA       LEU  82  13.317  -0.679  -3.950
  610   1HB   LEU  82          HB2       LEU  82  13.219  -1.912  -6.097
  611   2HB   LEU  82          HB1       LEU  82  13.077  -0.184  -6.293
  612    HG   LEU  82           HG       LEU  82  15.692  -1.607  -6.755
  613   1HD1  LEU  82          HD11      LEU  82  13.474  -1.062  -8.750
  614   2HD1  LEU  82          HD12      LEU  82  13.974  -2.655  -8.179
  615   3HD1  LEU  82          HD13      LEU  82  15.078  -1.679  -9.147
  616   1HD2  LEU  82          HD21      LEU  82  14.545   0.974  -7.835
  617   2HD2  LEU  82          HD22      LEU  82  16.141   0.321  -8.204
  618   3HD2  LEU  82          HD23      LEU  82  15.757   0.841  -6.563
  619    H    THR  83           H        THR  83  13.328  -2.689  -3.179
  620    HA   THR  83           HA       THR  83  15.669  -4.315  -3.492
  621    HB   THR  83           HB       THR  83  16.240  -3.123  -1.491
  622    HG1  THR  83           HG1      THR  83  15.226  -5.399  -0.274
  623   1HG2  THR  83          HG21      THR  83  13.998  -2.254  -0.900
  624   2HG2  THR  83          HG22      THR  83  14.843  -2.935   0.492
  625   3HG2  THR  83          HG23      THR  83  13.571  -3.859  -0.301
  626    H    MET  84           H        MET  84  14.704  -6.371  -4.135
  627    HA   MET  84           HA       MET  84  11.979  -6.658  -3.107
  628   1HB   MET  84          HB2       MET  84  12.087  -8.738  -4.720
  629   2HB   MET  84          HB1       MET  84  11.510  -7.174  -5.285
  630   1HG   MET  84          HG2       MET  84  12.930  -7.896  -6.958
  631   2HG   MET  84          HG1       MET  84  13.935  -6.825  -5.999
  632   1HE   MET  84          HE1       MET  84  16.460  -9.522  -7.320
  633   2HE   MET  84          HE2       MET  84  16.112  -7.798  -7.191
  634   3HE   MET  84          HE3       MET  84  15.070  -8.835  -8.162
  635    H    VAL  85           H        VAL  85  11.858  -7.444  -1.392
  636    HA   VAL  85           HA       VAL  85  12.670 -10.127  -0.916
  637    HB   VAL  85           HB       VAL  85  13.477  -9.326   1.484
  638   1HG1  VAL  85          HG11      VAL  85  14.927 -10.471  -0.088
  639   2HG1  VAL  85          HG12      VAL  85  15.820  -9.086   0.577
  640   3HG1  VAL  85          HG13      VAL  85  15.071  -9.000  -1.033
  641   1HG2  VAL  85          HG21      VAL  85  14.048  -6.880  -0.206
  642   2HG2  VAL  85          HG22      VAL  85  14.647  -7.149   1.432
  643   3HG2  VAL  85          HG23      VAL  85  12.914  -6.939   1.143
  644    H    LYS  86           H        LYS  86  10.576 -10.941  -0.369
  645    HA   LYS  86           HA       LYS  86   9.386  -9.396   1.768
  646   1HB   LYS  86          HB2       LYS  86   8.267  -8.814  -0.461
  647   2HB   LYS  86          HB1       LYS  86   7.561 -10.439  -0.351
  648   1HG   LYS  86          HG2       LYS  86   5.979  -8.897   0.421
  649   2HG   LYS  86          HG1       LYS  86   6.565  -9.884   1.752
  650   1HD   LYS  86          HD2       LYS  86   7.836  -8.195   2.702
  651   2HD   LYS  86          HD1       LYS  86   7.898  -7.264   1.216
  652   1HE   LYS  86          HE2       LYS  86   5.673  -6.423   1.553
  653   2HE   LYS  86          HE1       LYS  86   5.338  -7.616   2.804
  654   1HZ   LYS  86          HZ1       LYS  86   5.839  -5.447   3.677
  655   2HZ   LYS  86          HZ2       LYS  86   7.422  -5.529   2.957
  656   3HZ   LYS  86          HZ3       LYS  86   6.976  -6.590   4.166
  657    H    ARG  87           H        ARG  87   9.051 -10.553   3.382
  658    HA   ARG  87           HA       ARG  87   8.978 -13.414   2.943
  659   1HB   ARG  87          HB2       ARG  87  10.224 -11.890   5.251
  660   2HB   ARG  87          HB1       ARG  87  10.218 -13.640   5.058
  661   1HG   ARG  87          HG2       ARG  87  12.385 -13.033   4.333
  662   2HG   ARG  87          HG1       ARG  87  11.458 -13.188   2.841
  663   1HD   ARG  87          HD2       ARG  87  12.837 -11.211   2.705
  664   2HD   ARG  87          HD1       ARG  87  11.143 -10.753   2.772
  665    HE   ARG  87           HE       ARG  87  12.573 -10.743   5.294
  666   1HH1  ARG  87          HH11      ARG  87  11.289  -8.703   2.623
  667   2HH1  ARG  87          HH12      ARG  87  11.612  -7.261   3.359
  668   1HH2  ARG  87          HH21      ARG  87  13.054  -8.694   6.311
  669   2HH2  ARG  87          HH22      ARG  87  12.677  -7.236   5.509
  670    H    ASN  88           H        ASN  88   7.734 -14.607   4.483
  671    HA   ASN  88           HA       ASN  88   5.809 -15.107   5.589
  672   1HB   ASN  88          HB2       ASN  88   6.070 -12.271   6.656
  673   2HB   ASN  88          HB1       ASN  88   4.746 -13.333   7.114
  674   1HD2  ASN  88          HD21      ASN  88   5.385 -13.241   9.279
  675   2HD2  ASN  88          HD22      ASN  88   6.750 -14.121   9.849
  676    H    ASN  89           H        ASN  89   5.979 -13.649   2.969
  677    HA   ASN  89           HA       ASN  89   3.127 -13.303   2.470
  678   1HB   ASN  89          HB2       ASN  89   5.135 -11.097   1.877
  679   2HB   ASN  89          HB1       ASN  89   3.465 -11.098   1.371
  680   1HD2  ASN  89          HD21      ASN  89   5.672 -10.539   3.961
  681   2HD2  ASN  89          HD22      ASN  89   4.549  -9.823   5.045
  682    H    GLN  90           H        GLN  90   3.782 -11.943  -0.077
  683    HA   GLN  90           HA       GLN  90   4.929 -14.174  -1.539
  684   1HB   GLN  90          HB2       GLN  90   4.008 -13.109  -3.487
  685   2HB   GLN  90          HB1       GLN  90   2.729 -13.266  -2.262
  686   1HG   GLN  90          HG2       GLN  90   4.261 -10.781  -2.779
  687   2HG   GLN  90          HG1       GLN  90   2.778 -11.161  -3.661
  688   1HE2  GLN  90          HE21      GLN  90   4.192 -10.095  -0.725
  689   2HE2  GLN  90          HE22      GLN  90   2.680  -9.716   0.061
  690    H    THR  91           H        THR  91   6.392 -13.345  -3.413
  691    HA   THR  91           HA       THR  91   8.112 -11.417  -2.155
  692    HB   THR  91           HB       THR  91   9.724 -12.187  -4.068
  693    HG1  THR  91           HG1      THR  91   8.339 -14.613  -3.897
  694   1HG2  THR  91          HG21      THR  91  10.523 -14.030  -2.618
  695   2HG2  THR  91          HG22      THR  91   8.987 -14.026  -1.764
  696   3HG2  THR  91          HG23      THR  91  10.053 -12.649  -1.636
  697    H    ILE  92           H        ILE  92   7.981  -9.580  -2.586
  698    HA   ILE  92           HA       ILE  92   7.252  -8.479  -5.122
  699    HB   ILE  92           HB       ILE  92   5.836  -6.789  -3.801
  700   1HG1  ILE  92          HG12      ILE  92   4.705  -8.062  -1.817
  701   2HG1  ILE  92          HG11      ILE  92   6.224  -8.902  -1.800
  702   1HG2  ILE  92          HG21      ILE  92   3.830  -8.215  -3.821
  703   2HG2  ILE  92          HG22      ILE  92   4.882  -9.604  -4.161
  704   3HG2  ILE  92          HG23      ILE  92   4.768  -8.285  -5.302
  705   1HD1  ILE  92          HD11      ILE  92   7.494  -6.932  -1.521
  706   2HD1  ILE  92          HD12      ILE  92   6.243  -6.968  -0.287
  707   3HD1  ILE  92          HD13      ILE  92   6.079  -5.914  -1.689
  708    H    PHE  93           H        PHE  93   7.775  -6.101  -5.179
  709    HA   PHE  93           HA       PHE  93  10.527  -5.923  -4.217
  710   1HB   PHE  93          HB2       PHE  93   8.910  -4.119  -6.003
  711   2HB   PHE  93          HB1       PHE  93  10.621  -3.971  -5.707
  712    HD1  PHE  93           HD1      PHE  93  12.116  -5.132  -6.982
  713    HD2  PHE  93           HD2      PHE  93   8.012  -6.060  -7.258
  714    HE1  PHE  93           HE1      PHE  93  12.566  -6.467  -9.034
  715    HE2  PHE  93           HE2      PHE  93   8.417  -7.407  -9.281
  716    HZ   PHE  93           HZ       PHE  93  10.703  -7.609 -10.174
  717    H    GLU  94           H        GLU  94  11.014  -4.737  -2.525
  718    HA   GLU  94           HA       GLU  94   9.006  -3.022  -1.360
  719   1HB   GLU  94          HB2       GLU  94  11.653  -3.957  -0.202
  720   2HB   GLU  94          HB1       GLU  94  10.356  -3.151   0.654
  721   1HG   GLU  94          HG2       GLU  94   8.995  -5.201  -0.137
  722   2HG   GLU  94          HG1       GLU  94  10.587  -5.975  -0.178
  723    H    GLN  95           H        GLN  95   9.381  -0.908  -1.050
  724    HA   GLN  95           HA       GLN  95  11.752   0.160  -2.402
  725   1HB   GLN  95          HB2       GLN  95   9.420   0.401  -3.540
  726   2HB   GLN  95          HB1       GLN  95   9.083   1.573  -2.272
  727   1HG   GLN  95          HG2       GLN  95  10.912   2.940  -2.974
  728   2HG   GLN  95          HG1       GLN  95  11.432   1.716  -4.122
  729   1HE2  GLN  95          HE21      GLN  95   9.157   4.260  -3.431
  730   2HE2  GLN  95          HE22      GLN  95   8.548   4.385  -5.034
  731    H    THR  96           H        THR  96  13.065   1.056  -0.922
  732    HA   THR  96           HA       THR  96  11.913   2.144   1.568
  733    HB   THR  96           HB       THR  96  14.764   1.663   1.658
  734    HG1  THR  96           HG1      THR  96  14.168  -0.766   1.725
  735   1HG2  THR  96          HG21      THR  96  12.353   0.633   3.169
  736   2HG2  THR  96          HG22      THR  96  13.460   1.878   3.677
  737   3HG2  THR  96          HG23      THR  96  13.996   0.196   3.592
  738    H    ILE  97           H        ILE  97  13.103   3.989   2.509
  739    HA   ILE  97           HA       ILE  97  14.189   5.742   0.398
  740    HB   ILE  97           HB       ILE  97  13.209   6.606   3.131
  741   1HG1  ILE  97          HG12      ILE  97  11.534   6.630   0.659
  742   2HG1  ILE  97          HG11      ILE  97  11.545   5.199   1.673
  743   1HG2  ILE  97          HG21      ILE  97  14.564   8.109   1.595
  744   2HG2  ILE  97          HG22      ILE  97  12.983   8.706   2.028
  745   3HG2  ILE  97          HG23      ILE  97  13.243   7.989   0.425
  746   1HD1  ILE  97          HD11      ILE  97   9.701   6.362   2.276
  747   2HD1  ILE  97          HD12      ILE  97  10.462   7.925   2.208
  748   3HD1  ILE  97          HD13      ILE  97  10.839   6.791   3.545
  749    H    ASN  98           H        ASN  98  15.976   7.009   0.958
  750    HA   ASN  98           HA       ASN  98  17.810   5.645   2.743
  751   1HB   ASN  98          HB2       ASN  98  19.470   7.222   1.601
  752   2HB   ASN  98          HB1       ASN  98  18.764   5.957   0.592
  753   1HD2  ASN  98          HD21      ASN  98  17.094   8.982   1.520
  754   2HD2  ASN  98          HD22      ASN  98  17.080   9.627  -0.053
  755    H    ASP  99           H        ASP  99  15.576   7.783   3.346
  756    HA   ASP  99           HA       ASP  99  17.205   9.332   5.201
  757   1HB   ASP  99          HB2       ASP  99  17.201  10.411   2.903
  758   2HB   ASP  99          HB1       ASP  99  15.530  10.794   3.220
  759    H    LEU 100           H        LEU 100  14.049   9.273   3.610
  760    HA   LEU 100           HA       LEU 100  12.552  10.215   5.901
  761   1HB   LEU 100          HB2       LEU 100  11.490   9.001   3.342
  762   2HB   LEU 100          HB1       LEU 100  10.725  10.113   4.437
  763    HG   LEU 100           HG       LEU 100  13.180  11.110   3.146
  764   1HD1  LEU 100          HD11      LEU 100  10.628  10.455   1.707
  765   2HD1  LEU 100          HD12      LEU 100  12.305  10.182   1.162
  766   3HD1  LEU 100          HD13      LEU 100  11.644  11.792   1.216
  767   1HD2  LEU 100          HD21      LEU 100  10.446  12.244   3.583
  768   2HD2  LEU 100          HD22      LEU 100  11.876  13.102   3.047
  769   3HD2  LEU 100          HD23      LEU 100  11.811  12.436   4.695
  770    H    THR 101           H        THR 101  14.045   7.581   5.774
  771    HA   THR 101           HA       THR 101  12.596   5.290   5.666
  772    HB   THR 101           HB       THR 101  14.803   5.922   7.602
  773    HG1  THR 101           HG1      THR 101  15.139   5.194   4.887
  774   1HG2  THR 101          HG21      THR 101  13.899   3.620   7.685
  775   2HG2  THR 101          HG22      THR 101  15.536   3.630   7.030
  776   3HG2  THR 101          HG23      THR 101  14.156   3.457   5.948
  777    H    PHE 102           H        PHE 102  12.695   7.654   8.283
  778    HA   PHE 102           HA       PHE 102  11.046   5.827   9.907
  779   1HB   PHE 102          HB2       PHE 102  12.998   7.892  10.938
  780   2HB   PHE 102          HB1       PHE 102  11.980   6.855  11.931
  781    HD1  PHE 102           HD1      PHE 102  15.136   7.210  10.365
  782    HD2  PHE 102           HD2      PHE 102  12.298   4.303  11.627
  783    HE1  PHE 102           HE1      PHE 102  16.891   5.493  10.343
  784    HE2  PHE 102           HE2      PHE 102  14.051   2.579  11.609
  785    HZ   PHE 102           HZ       PHE 102  16.354   3.174  10.966
  Start of MODEL   12
    1    HA   MET   1           HA       MET   1 -12.982 -15.786 -18.957
    2   1HB   MET   1          HB2       MET   1 -13.644 -13.252 -18.411
    3   2HB   MET   1          HB1       MET   1 -14.891 -14.010 -17.439
    4   1HG   MET   1          HG2       MET   1 -11.907 -14.336 -17.099
    5   2HG   MET   1          HG1       MET   1 -12.965 -13.356 -16.111
    6   1HE   MET   1          HE1       MET   1 -11.958 -14.459 -13.938
    7   2HE   MET   1          HE2       MET   1 -10.885 -15.434 -14.938
    8   3HE   MET   1          HE3       MET   1 -11.857 -16.200 -13.680
    9    H    ALA   2           H        ALA   2 -13.516 -17.549 -17.686
   10    HA   ALA   2           HA       ALA   2 -15.942 -18.867 -18.188
   11   1HB   ALA   2          HB1       ALA   2 -13.853 -20.034 -17.694
   12   2HB   ALA   2          HB2       ALA   2 -15.154 -20.548 -16.616
   13   3HB   ALA   2          HB3       ALA   2 -13.914 -19.438 -16.036
   14    H    HIS   3           H        HIS   3 -14.888 -16.894 -15.528
   15    HA   HIS   3           HA       HIS   3 -17.300 -17.470 -13.995
   16   1HB   HIS   3          HB2       HIS   3 -14.906 -15.719 -13.369
   17   2HB   HIS   3          HB1       HIS   3 -16.279 -15.933 -12.302
   18    HD1  HIS   3           HD1      HIS   3 -16.116 -17.877 -10.670
   19    HD2  HIS   3           HD2      HIS   3 -13.332 -18.103 -13.747
   20    HE1  HIS   3           HE1      HIS   3 -14.581 -19.768 -10.083
   21    H    HIS   4           H        HIS   4 -18.648 -15.716 -13.325
   22    HA   HIS   4           HA       HIS   4 -19.036 -13.731 -15.392
   23   1HB   HIS   4          HB2       HIS   4 -20.984 -14.861 -14.353
   24   2HB   HIS   4          HB1       HIS   4 -20.513 -14.227 -12.783
   25    HD1  HIS   4           HD1      HIS   4 -21.743 -12.105 -12.124
   26    HD2  HIS   4           HD2      HIS   4 -21.613 -12.690 -16.237
   27    HE1  HIS   4           HE1      HIS   4 -23.101 -10.254 -13.130
   28    H    HIS   5           H        HIS   5 -17.829 -14.014 -12.168
   29    HA   HIS   5           HA       HIS   5 -17.448 -11.131 -11.949
   30   1HB   HIS   5          HB2       HIS   5 -17.209 -13.271  -9.818
   31   2HB   HIS   5          HB1       HIS   5 -17.102 -11.530  -9.560
   32    HD1  HIS   5           HD1      HIS   5 -19.449 -14.166  -9.156
   33    HD2  HIS   5           HD2      HIS   5 -19.675 -10.278 -10.609
   34    HE1  HIS   5           HE1      HIS   5 -21.875 -13.541  -9.093
   35    H    HIS   6           H        HIS   6 -15.430 -10.343 -11.336
   36    HA   HIS   6           HA       HIS   6 -13.260 -11.938 -12.453
   37   1HB   HIS   6          HB2       HIS   6 -13.326  -8.986 -11.762
   38   2HB   HIS   6          HB1       HIS   6 -12.048  -9.815 -12.632
   39    HD1  HIS   6           HD1      HIS   6 -14.402  -7.482 -13.425
   40    HD2  HIS   6           HD2      HIS   6 -13.630 -11.255 -14.991
   41    HE1  HIS   6           HE1      HIS   6 -15.414  -7.503 -15.739
   42    H    HIS   7           H        HIS   7 -11.229 -11.910 -11.342
   43    HA   HIS   7           HA       HIS   7 -11.601 -12.070  -8.461
   44   1HB   HIS   7          HB2       HIS   7  -9.359 -13.043 -10.259
   45   2HB   HIS   7          HB1       HIS   7  -9.357 -13.210  -8.507
   46    HD1  HIS   7           HD1      HIS   7 -10.461 -15.308  -7.605
   47    HD2  HIS   7           HD2      HIS   7 -11.515 -14.530 -11.545
   48    HE1  HIS   7           HE1      HIS   7 -11.768 -17.318  -8.395
   49    H    HIS   8           H        HIS   8 -10.948 -10.512  -7.218
   50    HA   HIS   8           HA       HIS   8 -10.156  -8.590  -6.458
   51   1HB   HIS   8          HB2       HIS   8  -7.917  -8.935  -8.499
   52   2HB   HIS   8          HB1       HIS   8  -7.962  -7.637  -7.315
   53    HD1  HIS   8           HD1      HIS   8  -6.589 -10.972  -7.770
   54    HD2  HIS   8           HD2      HIS   8  -7.984  -8.731  -4.546
   55    HE1  HIS   8           HE1      HIS   8  -5.658 -12.049  -5.716
   56    H    ASN   9           H        ASN   9 -11.830  -7.489  -6.892
   57    HA   ASN   9           HA       ASN   9 -12.855  -6.728  -9.358
   58   1HB   ASN   9          HB2       ASN   9 -13.337  -5.452  -6.659
   59   2HB   ASN   9          HB1       ASN   9 -14.283  -5.134  -8.102
   60   1HD2  ASN   9          HD21      ASN   9 -13.608  -7.363  -5.548
   61   2HD2  ASN   9          HD22      ASN   9 -14.900  -8.451  -5.861
   62    H    GLN  10           H        GLN  10 -12.772  -4.967 -10.579
   63    HA   GLN  10           HA       GLN  10 -10.525  -3.262 -10.277
   64   1HB   GLN  10          HB2       GLN  10 -11.360  -2.117 -12.319
   65   2HB   GLN  10          HB1       GLN  10 -11.141  -3.841 -12.519
   66   1HG   GLN  10          HG2       GLN  10 -13.543  -4.178 -12.308
   67   2HG   GLN  10          HG1       GLN  10 -13.763  -2.442 -12.068
   68   1HE2  GLN  10          HE21      GLN  10 -15.069  -2.280 -13.914
   69   2HE2  GLN  10          HE22      GLN  10 -14.390  -2.370 -15.493
   70    H    GLN  11           H        GLN  11 -10.826  -0.870 -10.571
   71    HA   GLN  11           HA       GLN  11 -11.311   1.088  -9.734
   72   1HB   GLN  11          HB2       GLN  11 -13.876  -0.108  -8.674
   73   2HB   GLN  11          HB1       GLN  11 -13.383   1.537  -8.339
   74   1HG   GLN  11          HG2       GLN  11 -13.392   1.936 -10.813
   75   2HG   GLN  11          HG1       GLN  11 -14.124   0.336 -10.989
   76   1HE2  GLN  11          HE21      GLN  11 -16.048   1.203 -11.795
   77   2HE2  GLN  11          HE22      GLN  11 -17.168   2.033 -10.775
   78    H    ASN  12           H        ASN  12  -9.561   1.031  -8.600
   79    HA   ASN  12           HA       ASN  12  -9.942   0.386  -5.811
   80   1HB   ASN  12          HB2       ASN  12  -7.463   0.745  -5.554
   81   2HB   ASN  12          HB1       ASN  12  -7.882  -0.572  -6.643
   82   1HD2  ASN  12          HD21      ASN  12  -7.407  -0.394  -8.770
   83   2HD2  ASN  12          HD22      ASN  12  -6.392   0.843  -9.426
   84    H    LYS  13           H        LYS  13  -8.552   2.249  -4.443
   85    HA   LYS  13           HA       LYS  13 -10.371   4.432  -4.915
   86   1HB   LYS  13          HB2       LYS  13 -10.264   3.728  -2.652
   87   2HB   LYS  13          HB1       LYS  13  -8.506   3.770  -2.642
   88   1HG   LYS  13          HG2       LYS  13  -8.582   6.210  -2.931
   89   2HG   LYS  13          HG1       LYS  13 -10.336   6.146  -2.872
   90   1HD   LYS  13          HD2       LYS  13  -8.582   5.160  -0.642
   91   2HD   LYS  13          HD1       LYS  13  -9.138   6.825  -0.755
   92   1HE   LYS  13          HE2       LYS  13 -11.479   5.876  -0.872
   93   2HE   LYS  13          HE1       LYS  13 -10.765   4.338  -0.371
   94   1HZ   LYS  13          HZ1       LYS  13  -9.963   5.394   1.654
   95   2HZ   LYS  13          HZ2       LYS  13 -11.621   5.759   1.493
   96   3HZ   LYS  13          HZ3       LYS  13 -10.446   6.884   1.068
   97    H    LYS  14           H        LYS  14  -6.975   3.805  -4.965
   98    HA   LYS  14           HA       LYS  14  -5.213   4.906  -5.624
   99   1HB   LYS  14          HB2       LYS  14  -6.162   6.019  -7.588
  100   2HB   LYS  14          HB1       LYS  14  -7.066   7.141  -6.582
  101   1HG   LYS  14          HG2       LYS  14  -5.011   8.107  -7.748
  102   2HG   LYS  14          HG1       LYS  14  -5.090   8.365  -6.003
  103   1HD   LYS  14          HD2       LYS  14  -3.646   6.397  -5.686
  104   2HD   LYS  14          HD1       LYS  14  -3.524   6.226  -7.430
  105   1HE   LYS  14          HE2       LYS  14  -2.640   8.707  -5.966
  106   2HE   LYS  14          HE1       LYS  14  -1.644   7.261  -6.207
  107   1HZ   LYS  14          HZ1       LYS  14  -1.676   7.515  -8.483
  108   2HZ   LYS  14          HZ2       LYS  14  -1.265   9.017  -7.864
  109   3HZ   LYS  14          HZ3       LYS  14  -2.822   8.762  -8.499
  110    H    VAL  15           H        VAL  15  -4.456   4.777  -3.878
  111    HA   VAL  15           HA       VAL  15  -4.654   5.440  -1.474
  112    HB   VAL  15           HB       VAL  15  -2.646   4.608  -2.902
  113   1HG1  VAL  15          HG11      VAL  15  -0.684   6.054  -2.852
  114   2HG1  VAL  15          HG12      VAL  15  -1.791   7.379  -2.464
  115   3HG1  VAL  15          HG13      VAL  15  -1.970   6.516  -3.989
  116   1HG2  VAL  15          HG21      VAL  15  -2.241   5.888  -0.233
  117   2HG2  VAL  15          HG22      VAL  15  -1.136   4.715  -0.968
  118   3HG2  VAL  15          HG23      VAL  15  -2.789   4.245  -0.544
  119    H    GLU  16           H        GLU  16  -5.337   7.180  -0.251
  120    HA   GLU  16           HA       GLU  16  -4.976   9.925  -1.242
  121   1HB   GLU  16          HB2       GLU  16  -6.440   9.017   1.228
  122   2HB   GLU  16          HB1       GLU  16  -6.605  10.539   0.365
  123   1HG   GLU  16          HG2       GLU  16  -7.564   9.401  -1.508
  124   2HG   GLU  16          HG1       GLU  16  -7.304   7.859  -0.700
  125    H    GLY  17           H        GLY  17  -4.794   8.545   2.025
  126   1HA   GLY  17          HA2       GLY  17  -2.106   9.534   2.243
  127   2HA   GLY  17          HA1       GLY  17  -3.313  10.319   3.288
  128    H    GLY  18           H        GLY  18  -3.418   7.126   2.296
  129   1HA   GLY  18          HA2       GLY  18  -2.588   6.192   4.929
  130   2HA   GLY  18          HA1       GLY  18  -4.185   5.725   4.366
  131    H    TYR  19           H        TYR  19  -3.566   3.503   4.479
  132    HA   TYR  19           HA       TYR  19  -1.632   2.724   2.415
  133   1HB   TYR  19          HB2       TYR  19  -2.512   1.077   4.785
  134   2HB   TYR  19          HB1       TYR  19  -1.108   0.827   3.745
  135    HD1  TYR  19           HD1      TYR  19   0.443   3.121   3.681
  136    HD2  TYR  19           HD2      TYR  19  -1.996   1.805   6.904
  137    HE1  TYR  19           HE1      TYR  19   1.784   4.472   5.243
  138    HE2  TYR  19           HE2      TYR  19  -0.704   3.117   8.454
  139    HH   TYR  19           HH       TYR  19   1.664   4.087   8.557
  140    H    GLU  20           H        GLU  20  -2.580   2.223   0.686
  141    HA   GLU  20           HA       GLU  20  -5.211   1.003   0.679
  142   1HB   GLU  20          HB2       GLU  20  -4.817   2.919  -0.823
  143   2HB   GLU  20          HB1       GLU  20  -3.425   2.115  -1.519
  144   1HG   GLU  20          HG2       GLU  20  -4.899   0.402  -2.462
  145   2HG   GLU  20          HG1       GLU  20  -6.282   1.206  -1.745
  146    H    CYS  21           H        CYS  21  -5.281  -1.097   0.674
  147    HA   CYS  21           HA       CYS  21  -3.111  -2.859   0.730
  148   1HB   CYS  21          HB2       CYS  21  -5.939  -3.389  -0.059
  149   2HB   CYS  21          HB1       CYS  21  -4.762  -4.657   0.241
  150    H    LYS  22           H        LYS  22  -2.154  -4.189  -0.749
  151    HA   LYS  22           HA       LYS  22  -2.376  -3.847  -3.521
  152   1HB   LYS  22          HB2       LYS  22  -0.363  -4.766  -2.792
  153   2HB   LYS  22          HB1       LYS  22  -1.150  -5.831  -1.642
  154   1HG   LYS  22          HG2       LYS  22  -0.106  -7.064  -3.464
  155   2HG   LYS  22          HG1       LYS  22  -1.849  -7.294  -3.447
  156   1HD   LYS  22          HD2       LYS  22  -1.987  -5.507  -5.194
  157   2HD   LYS  22          HD1       LYS  22  -0.215  -5.581  -5.273
  158   1HE   LYS  22          HE2       LYS  22  -0.306  -7.929  -5.861
  159   2HE   LYS  22          HE1       LYS  22  -2.054  -7.944  -5.681
  160   1HZ   LYS  22          HZ1       LYS  22  -1.303  -7.857  -7.963
  161   2HZ   LYS  22          HZ2       LYS  22  -0.587  -6.349  -7.716
  162   3HZ   LYS  22          HZ3       LYS  22  -2.268  -6.544  -7.577
  163    H    TYR  23           H        TYR  23  -4.153  -5.649  -1.182
  164    HA   TYR  23           HA       TYR  23  -5.005  -7.584  -3.155
  165   1HB   TYR  23          HB2       TYR  23  -5.732  -7.925  -0.327
  166   2HB   TYR  23          HB1       TYR  23  -5.116  -9.092  -1.482
  167    HD1  TYR  23           HD1      TYR  23  -2.583  -9.245  -1.842
  168    HD2  TYR  23           HD2      TYR  23  -4.291  -6.799   1.186
  169    HE1  TYR  23           HE1      TYR  23  -0.412  -9.168  -0.656
  170    HE2  TYR  23           HE2      TYR  23  -2.148  -6.723   2.357
  171    HH   TYR  23           HH       TYR  23  -0.173  -8.098   2.544
  172    H    CYS  24           H        CYS  24  -6.119  -4.679  -2.207
  173    HA   CYS  24           HA       CYS  24  -8.745  -5.286  -3.003
  174   1HB   CYS  24          HB2       CYS  24  -9.977  -4.812  -0.941
  175   2HB   CYS  24          HB1       CYS  24  -8.851  -6.167  -0.773
  176    H    THR  25           H        THR  25 -10.229  -3.297  -2.438
  177    HA   THR  25           HA       THR  25  -8.907  -0.907  -3.391
  178    HB   THR  25           HB       THR  25 -11.778  -1.722  -2.892
  179    HG1  THR  25           HG1      THR  25 -11.319  -1.270  -5.454
  180   1HG2  THR  25          HG21      THR  25 -10.755   0.845  -4.174
  181   2HG2  THR  25          HG22      THR  25 -11.745   0.695  -2.732
  182   3HG2  THR  25          HG23      THR  25 -12.415   0.269  -4.304
  183    H    PHE  26           H        PHE  26  -9.501  -2.261  -0.409
  184    HA   PHE  26           HA       PHE  26 -10.531   0.098   0.889
  185   1HB   PHE  26          HB2       PHE  26  -9.786  -2.577   2.071
  186   2HB   PHE  26          HB1       PHE  26 -10.634  -1.279   2.911
  187    HD1  PHE  26           HD1      PHE  26 -12.877  -0.525   1.980
  188    HD2  PHE  26           HD2      PHE  26 -10.968  -4.129   0.808
  189    HE1  PHE  26           HE1      PHE  26 -15.020  -1.376   1.120
  190    HE2  PHE  26           HE2      PHE  26 -13.105  -4.988  -0.054
  191    HZ   PHE  26           HZ       PHE  26 -15.133  -3.610   0.099
  192    H    GLN  27           H        GLN  27  -9.483   1.461   2.055
  193    HA   GLN  27           HA       GLN  27  -6.618   1.108   2.480
  194   1HB   GLN  27          HB2       GLN  27  -6.593   2.622   0.712
  195   2HB   GLN  27          HB1       GLN  27  -8.110   3.354   1.217
  196   1HG   GLN  27          HG2       GLN  27  -7.055   4.600   2.928
  197   2HG   GLN  27          HG1       GLN  27  -5.575   3.670   2.784
  198   1HE2  GLN  27          HE21      GLN  27  -4.161   4.213   1.352
  199   2HE2  GLN  27          HE22      GLN  27  -4.205   5.602   0.342
  200    H    THR  28           H        THR  28  -5.875   1.800   4.384
  201    HA   THR  28           HA       THR  28  -7.476   3.545   6.033
  202    HB   THR  28           HB       THR  28  -8.069   1.345   6.917
  203    HG1  THR  28           HG1      THR  28  -7.918   2.663   8.577
  204   1HG2  THR  28          HG21      THR  28  -6.121   0.066   6.092
  205   2HG2  THR  28          HG22      THR  28  -6.370  -0.195   7.819
  206   3HG2  THR  28          HG23      THR  28  -5.100   0.882   7.274
  207    HA   PRO  29           HA       PRO  29  -3.359   5.237   6.390
  208   1HB   PRO  29          HB2       PRO  29  -3.957   7.289   8.058
  209   2HB   PRO  29          HB1       PRO  29  -4.289   7.317   6.323
  210   1HG   PRO  29          HG2       PRO  29  -6.152   6.801   8.594
  211   2HG   PRO  29          HG1       PRO  29  -6.416   7.666   7.065
  212   1HD   PRO  29          HD2       PRO  29  -7.276   5.098   7.539
  213   2HD   PRO  29          HD1       PRO  29  -6.922   5.759   5.924
  214    H    ASP  30           H        ASP  30  -5.067   3.676   8.744
  215    HA   ASP  30           HA       ASP  30  -3.052   4.063  10.813
  216   1HB   ASP  30          HB2       ASP  30  -5.634   2.505  10.759
  217   2HB   ASP  30          HB1       ASP  30  -4.530   2.502  12.128
  218    H    LEU  31           H        LEU  31  -1.324   2.808  10.685
  219    HA   LEU  31           HA       LEU  31  -0.979   0.635   8.996
  220   1HB   LEU  31          HB2       LEU  31   0.688   2.172  10.369
  221   2HB   LEU  31          HB1       LEU  31   0.570   0.885  11.546
  222    HG   LEU  31           HG       LEU  31   2.559   0.547  10.232
  223   1HD1  LEU  31          HD11      LEU  31   0.433  -1.322   9.313
  224   2HD1  LEU  31          HD12      LEU  31   1.364  -1.498  10.803
  225   3HD1  LEU  31          HD13      LEU  31   2.165  -1.659   9.218
  226   1HD2  LEU  31          HD21      LEU  31   0.781   0.602   7.828
  227   2HD2  LEU  31          HD22      LEU  31   2.533   0.335   7.824
  228   3HD2  LEU  31          HD23      LEU  31   1.853   1.887   8.343
  229    H    ASN  32           H        ASN  32  -1.834   0.881  12.440
  230    HA   ASN  32           HA       ASN  32  -1.847  -1.751  13.221
  231   1HB   ASN  32          HB2       ASN  32  -2.336   0.245  14.711
  232   2HB   ASN  32          HB1       ASN  32  -3.882   0.311  13.842
  233   1HD2  ASN  32          HD21      ASN  32  -2.776  -2.865  14.501
  234   2HD2  ASN  32          HD22      ASN  32  -3.902  -3.075  15.777
  235    H    MET  33           H        MET  33  -4.401   0.154  11.747
  236    HA   MET  33           HA       MET  33  -6.260  -2.004  11.715
  237   1HB   MET  33          HB2       MET  33  -6.354   0.561  10.142
  238   2HB   MET  33          HB1       MET  33  -7.691  -0.548  10.393
  239   1HG   MET  33          HG2       MET  33  -6.246   0.998  12.480
  240   2HG   MET  33          HG1       MET  33  -7.837   1.417  11.840
  241   1HE   MET  33          HE1       MET  33  -8.900   1.528  14.253
  242   2HE   MET  33          HE2       MET  33  -7.314   1.201  14.954
  243   3HE   MET  33          HE3       MET  33  -8.719   0.274  15.481
  244    H    PHE  34           H        PHE  34  -3.992  -0.618   9.497
  245    HA   PHE  34           HA       PHE  34  -4.781  -2.003   7.205
  246   1HB   PHE  34          HB2       PHE  34  -3.245  -0.156   6.982
  247   2HB   PHE  34          HB1       PHE  34  -2.074  -0.916   8.020
  248    HD1  PHE  34           HD1      PHE  34  -0.475  -2.370   7.185
  249    HD2  PHE  34           HD2      PHE  34  -3.751  -1.269   4.670
  250    HE1  PHE  34           HE1      PHE  34   0.628  -3.444   5.254
  251    HE2  PHE  34           HE2      PHE  34  -2.658  -2.324   2.770
  252    HZ   PHE  34           HZ       PHE  34  -0.472  -3.423   3.044
  253    H    THR  35           H        THR  35  -2.244  -2.852   9.531
  254    HA   THR  35           HA       THR  35  -1.832  -5.359   8.249
  255    HB   THR  35           HB       THR  35   0.064  -4.468   9.448
  256    HG1  THR  35           HG1      THR  35   0.301  -6.333  11.079
  257   1HG2  THR  35          HG21      THR  35  -1.593  -4.710  11.966
  258   2HG2  THR  35          HG22      THR  35  -1.071  -3.220  11.161
  259   3HG2  THR  35          HG23      THR  35   0.125  -4.286  11.901
  260    H    PHE  36           H        PHE  36  -3.916  -4.284  10.723
  261    HA   PHE  36           HA       PHE  36  -4.818  -6.792  11.651
  262   1HB   PHE  36          HB2       PHE  36  -5.490  -5.026  13.027
  263   2HB   PHE  36          HB1       PHE  36  -5.869  -3.985  11.685
  264    HD1  PHE  36           HD1      PHE  36  -8.089  -3.525  11.312
  265    HD2  PHE  36           HD2      PHE  36  -7.050  -7.252  13.062
  266    HE1  PHE  36           HE1      PHE  36 -10.477  -4.103  11.456
  267    HE2  PHE  36           HE2      PHE  36  -9.444  -7.840  13.223
  268    HZ   PHE  36           HZ       PHE  36 -11.155  -6.263  12.417
  269    H    HIS  37           H        HIS  37  -6.205  -4.572   9.263
  270    HA   HIS  37           HA       HIS  37  -8.180  -6.257   8.284
  271   1HB   HIS  37          HB2       HIS  37  -8.427  -3.970   7.848
  272   2HB   HIS  37          HB1       HIS  37  -6.786  -3.795   7.271
  273    HD1  HIS  37           HD1      HIS  37 -10.270  -4.746   6.084
  274    HD2  HIS  37           HD2      HIS  37  -6.405  -4.277   4.627
  275    HE1  HIS  37           HE1      HIS  37 -10.486  -4.678   3.590
  276    H    VAL  38           H        VAL  38  -4.814  -5.968   7.444
  277    HA   VAL  38           HA       VAL  38  -4.963  -7.654   5.174
  278    HB   VAL  38           HB       VAL  38  -2.694  -6.883   6.977
  279   1HG1  VAL  38          HG11      VAL  38  -1.150  -7.916   5.289
  280   2HG1  VAL  38          HG12      VAL  38  -2.557  -8.524   4.413
  281   3HG1  VAL  38          HG13      VAL  38  -2.203  -9.123   6.034
  282   1HG2  VAL  38          HG21      VAL  38  -1.915  -5.625   4.988
  283   2HG2  VAL  38          HG22      VAL  38  -3.511  -5.125   5.555
  284   3HG2  VAL  38          HG23      VAL  38  -3.368  -6.156   4.133
  285    H    ASP  39           H        ASP  39  -4.103  -8.247   8.550
  286    HA   ASP  39           HA       ASP  39  -3.611 -11.004   8.233
  287   1HB   ASP  39          HB2       ASP  39  -2.828  -9.694  10.149
  288   2HB   ASP  39          HB1       ASP  39  -4.490  -9.441  10.662
  289    H    SER  40           H        SER  40  -6.449  -9.172   8.667
  290    HA   SER  40           HA       SER  40  -8.091 -11.445   9.377
  291   1HB   SER  40          HB2       SER  40  -8.472  -9.217  10.375
  292   2HB   SER  40          HB1       SER  40  -8.902  -8.599   8.791
  293    HG   SER  40           HG       SER  40 -10.747  -9.632   8.808
  294    H    GLU  41           H        GLU  41  -7.685  -9.311   6.556
  295    HA   GLU  41           HA       GLU  41  -9.817 -10.851   5.250
  296   1HB   GLU  41          HB2       GLU  41  -8.631  -8.245   4.323
  297   2HB   GLU  41          HB1       GLU  41 -10.078  -9.032   3.708
  298   1HG   GLU  41          HG2       GLU  41  -9.681  -7.839   6.430
  299   2HG   GLU  41          HG1       GLU  41 -10.678  -7.176   5.133
  300    H    HIS  42           H        HIS  42  -6.344 -10.187   4.965
  301    HA   HIS  42           HA       HIS  42  -6.305 -11.920   2.635
  302   1HB   HIS  42          HB2       HIS  42  -4.342  -9.663   2.769
  303   2HB   HIS  42          HB1       HIS  42  -5.064 -10.450   1.384
  304    HD1  HIS  42           HD1      HIS  42  -7.671  -9.609   0.891
  305    HD2  HIS  42           HD2      HIS  42  -5.309  -7.160   3.284
  306    HE1  HIS  42           HE1      HIS  42  -8.765  -7.354   0.859
  307    HA   PRO  43           HA       PRO  43  -3.404 -12.679   6.369
  308   1HB   PRO  43          HB2       PRO  43  -4.060 -15.307   6.774
  309   2HB   PRO  43          HB1       PRO  43  -4.908 -13.955   7.541
  310   1HG   PRO  43          HG2       PRO  43  -5.671 -15.488   5.071
  311   2HG   PRO  43          HG1       PRO  43  -6.698 -15.009   6.439
  312   1HD   PRO  43          HD2       PRO  43  -6.689 -13.655   4.146
  313   2HD   PRO  43          HD1       PRO  43  -6.840 -12.832   5.712
  314    H    ASN  44           H        ASN  44  -4.249 -14.798   3.724
  315    HA   ASN  44           HA       ASN  44  -1.450 -15.134   3.065
  316   1HB   ASN  44          HB2       ASN  44  -3.567 -17.276   3.207
  317   2HB   ASN  44          HB1       ASN  44  -2.130 -17.452   2.209
  318   1HD2  ASN  44          HD21      ASN  44  -0.160 -17.765   3.209
  319   2HD2  ASN  44          HD22      ASN  44  -0.018 -18.203   4.875
  320    H    VAL  45           H        VAL  45  -1.110 -15.074   0.874
  321    HA   VAL  45           HA       VAL  45  -3.314 -14.871  -0.880
  322    HB   VAL  45           HB       VAL  45  -3.402 -12.720   0.233
  323   1HG1  VAL  45          HG11      VAL  45  -0.557 -12.237  -0.541
  324   2HG1  VAL  45          HG12      VAL  45  -1.266 -12.451   1.076
  325   3HG1  VAL  45          HG13      VAL  45  -1.687 -11.043   0.132
  326   1HG2  VAL  45          HG21      VAL  45  -2.362 -12.352  -2.568
  327   2HG2  VAL  45          HG22      VAL  45  -3.314 -11.183  -1.628
  328   3HG2  VAL  45          HG23      VAL  45  -4.026 -12.723  -2.096
  329    H    VAL  46           H        VAL  46  -2.422 -14.392  -3.165
  330    HA   VAL  46           HA       VAL  46  -0.192 -16.215  -3.348
  331    HB   VAL  46           HB       VAL  46  -0.779 -16.505  -5.725
  332   1HG1  VAL  46          HG11      VAL  46  -3.051 -16.889  -3.781
  333   2HG1  VAL  46          HG12      VAL  46  -1.687 -17.982  -4.016
  334   3HG1  VAL  46          HG13      VAL  46  -2.853 -17.739  -5.317
  335   1HG2  VAL  46          HG21      VAL  46  -3.102 -14.679  -5.072
  336   2HG2  VAL  46          HG22      VAL  46  -2.898 -15.590  -6.571
  337   3HG2  VAL  46          HG23      VAL  46  -1.766 -14.303  -6.157
  338    H    LEU  47           H        LEU  47   1.411 -16.115  -4.824
  339    HA   LEU  47           HA       LEU  47   2.968 -13.788  -4.765
  340   1HB   LEU  47          HB2       LEU  47   3.962 -15.947  -4.680
  341   2HB   LEU  47          HB1       LEU  47   3.230 -16.409  -6.199
  342    HG   LEU  47           HG       LEU  47   4.718 -14.800  -7.369
  343   1HD1  LEU  47          HD11      LEU  47   5.102 -13.220  -5.570
  344   2HD1  LEU  47          HD12      LEU  47   6.631 -13.864  -6.176
  345   3HD1  LEU  47          HD13      LEU  47   5.958 -14.465  -4.660
  346   1HD2  LEU  47          HD21      LEU  47   6.111 -16.816  -5.623
  347   2HD2  LEU  47          HD22      LEU  47   6.757 -16.113  -7.107
  348   3HD2  LEU  47          HD23      LEU  47   5.322 -17.141  -7.166
  349    H    ASN  48           H        ASN  48   3.378 -12.255  -6.171
  350    HA   ASN  48           HA       ASN  48   3.264 -12.382  -8.915
  351   1HB   ASN  48          HB2       ASN  48   1.479 -10.811  -9.463
  352   2HB   ASN  48          HB1       ASN  48   0.758 -12.127  -8.561
  353   1HD2  ASN  48          HD21      ASN  48   1.399 -11.269  -5.926
  354   2HD2  ASN  48          HD22      ASN  48   0.527  -9.822  -5.613
  355    H    SER  49           H        SER  49   3.494  -9.873  -9.633
  356    HA   SER  49           HA       SER  49   5.596  -8.916  -7.858
  357   1HB   SER  49          HB2       SER  49   4.813  -8.033 -10.641
  358   2HB   SER  49          HB1       SER  49   6.277  -7.568  -9.772
  359    HG   SER  49           HG       SER  49   5.534 -10.149 -10.675
  360    H    SER  50           H        SER  50   5.224  -7.211  -6.454
  361    HA   SER  50           HA       SER  50   3.464  -5.079  -7.190
  362   1HB   SER  50          HB2       SER  50   3.148  -6.729  -4.684
  363   2HB   SER  50          HB1       SER  50   2.254  -5.272  -5.120
  364    HG   SER  50           HG       SER  50   2.127  -6.962  -7.132
  365    H    TYR  51           H        TYR  51   3.634  -3.399  -5.301
  366    HA   TYR  51           HA       TYR  51   6.409  -3.356  -4.352
  367   1HB   TYR  51          HB2       TYR  51   4.674  -1.265  -5.551
  368   2HB   TYR  51          HB1       TYR  51   5.900  -0.819  -4.384
  369    HD1  TYR  51           HD1      TYR  51   6.042  -3.302  -7.174
  370    HD2  TYR  51           HD2      TYR  51   7.451   0.358  -5.548
  371    HE1  TYR  51           HE1      TYR  51   7.654  -3.130  -9.017
  372    HE2  TYR  51           HE2      TYR  51   9.107   0.536  -7.383
  373    HH   TYR  51           HH       TYR  51   8.851  -1.213 -10.152
  374    H    VAL  52           H        VAL  52   6.795  -2.700  -2.338
  375    HA   VAL  52           HA       VAL  52   4.541  -1.932  -0.630
  376    HB   VAL  52           HB       VAL  52   5.048  -4.354  -0.293
  377   1HG1  VAL  52          HG11      VAL  52   7.089  -5.049   0.718
  378   2HG1  VAL  52          HG12      VAL  52   7.689  -3.414   0.683
  379   3HG1  VAL  52          HG13      VAL  52   7.399  -4.290  -0.847
  380   1HG2  VAL  52          HG21      VAL  52   5.416  -4.391   2.111
  381   2HG2  VAL  52          HG22      VAL  52   4.226  -3.192   1.618
  382   3HG2  VAL  52          HG23      VAL  52   5.861  -2.682   2.057
  383    H    CYS  53           H        CYS  53   5.021  -0.359   0.769
  384    HA   CYS  53           HA       CYS  53   7.633   0.983   0.615
  385   1HB   CYS  53          HB2       CYS  53   5.636   2.364   0.747
  386   2HB   CYS  53          HB1       CYS  53   5.089   1.519   2.173
  387    H    VAL  54           H        VAL  54   9.139  -0.339   1.649
  388    HA   VAL  54           HA       VAL  54   8.660  -2.054   3.761
  389    HB   VAL  54           HB       VAL  54  11.236  -0.839   4.114
  390   1HG1  VAL  54          HG11      VAL  54  10.411  -3.412   2.957
  391   2HG1  VAL  54          HG12      VAL  54  10.670  -3.101   4.695
  392   3HG1  VAL  54          HG13      VAL  54  12.026  -3.015   3.534
  393   1HG2  VAL  54          HG21      VAL  54  12.148  -1.463   1.875
  394   2HG2  VAL  54          HG22      VAL  54  11.165  -0.015   1.945
  395   3HG2  VAL  54          HG23      VAL  54  10.478  -1.474   1.284
  396    H    GLU  55           H        GLU  55   9.290   1.328   3.737
  397    HA   GLU  55           HA       GLU  55   9.954   1.841   6.384
  398   1HB   GLU  55          HB2       GLU  55   8.312   3.641   4.616
  399   2HB   GLU  55          HB1       GLU  55   9.356   4.132   5.938
  400   1HG   GLU  55          HG2       GLU  55  10.309   2.839   3.389
  401   2HG   GLU  55          HG1       GLU  55  10.293   4.569   3.691
  402    H    CYS  56           H        CYS  56   6.897   1.479   4.821
  403    HA   CYS  56           HA       CYS  56   5.436   1.920   7.391
  404   1HB   CYS  56          HB2       CYS  56   4.370   1.542   4.622
  405   2HB   CYS  56          HB1       CYS  56   3.457   2.132   6.010
  406    H    ASN  57           H        ASN  57   6.459  -0.328   5.199
  407    HA   ASN  57           HA       ASN  57   6.004  -2.274   4.461
  408   1HB   ASN  57          HB2       ASN  57   6.619  -2.634   6.958
  409   2HB   ASN  57          HB1       ASN  57   5.013  -3.289   7.078
  410   1HD2  ASN  57          HD21      ASN  57   7.900  -3.479   5.517
  411   2HD2  ASN  57          HD22      ASN  57   7.797  -5.151   5.115
  412    H    PHE  58           H        PHE  58   4.502  -1.344   3.224
  413    HA   PHE  58           HA       PHE  58   1.957  -2.501   3.760
  414   1HB   PHE  58          HB2       PHE  58   0.623  -0.625   3.798
  415   2HB   PHE  58          HB1       PHE  58   2.109   0.120   4.349
  416    HD1  PHE  58           HD1      PHE  58   3.311   1.644   2.861
  417    HD2  PHE  58           HD2      PHE  58  -0.288  -0.186   1.672
  418    HE1  PHE  58           HE1      PHE  58   3.068   3.343   0.979
  419    HE2  PHE  58           HE2      PHE  58  -0.549   1.501  -0.170
  420    HZ   PHE  58           HZ       PHE  58   1.151   3.220  -0.494
  421    H    LEU  59           H        LEU  59   1.121  -3.430   1.962
  422    HA   LEU  59           HA       LEU  59   2.561  -3.091  -0.551
  423   1HB   LEU  59          HB2       LEU  59   1.008  -5.266   0.684
  424   2HB   LEU  59          HB1       LEU  59   0.778  -5.081  -1.037
  425    HG   LEU  59           HG       LEU  59   3.477  -5.458   0.236
  426   1HD1  LEU  59          HD11      LEU  59   3.225  -7.780  -0.547
  427   2HD1  LEU  59          HD12      LEU  59   1.594  -7.364  -1.138
  428   3HD1  LEU  59          HD13      LEU  59   1.931  -7.344   0.583
  429   1HD2  LEU  59          HD21      LEU  59   2.478  -5.602  -2.621
  430   2HD2  LEU  59          HD22      LEU  59   4.073  -6.084  -2.096
  431   3HD2  LEU  59          HD23      LEU  59   3.583  -4.401  -1.955
  432    H    THR  60           H        THR  60   1.549  -2.275  -2.298
  433    HA   THR  60           HA       THR  60  -1.264  -1.690  -1.946
  434    HB   THR  60           HB       THR  60  -0.254   0.316  -1.523
  435    HG1  THR  60           HG1      THR  60  -1.804   0.927  -2.817
  436   1HG2  THR  60          HG21      THR  60   1.539  -0.010  -3.938
  437   2HG2  THR  60          HG22      THR  60   1.990  -0.228  -2.252
  438   3HG2  THR  60          HG23      THR  60   1.544   1.361  -2.818
  439    H    LYS  61           H        LYS  61  -2.427  -1.339  -3.845
  440    HA   LYS  61           HA       LYS  61  -1.888  -3.360  -5.810
  441   1HB   LYS  61          HB2       LYS  61  -4.124  -2.947  -4.800
  442   2HB   LYS  61          HB1       LYS  61  -4.159  -1.369  -5.558
  443   1HG   LYS  61          HG2       LYS  61  -4.078  -2.467  -7.761
  444   2HG   LYS  61          HG1       LYS  61  -4.143  -4.032  -6.952
  445   1HD   LYS  61          HD2       LYS  61  -6.232  -1.874  -6.686
  446   2HD   LYS  61          HD1       LYS  61  -6.347  -3.224  -7.809
  447   1HE   LYS  61          HE2       LYS  61  -6.220  -3.423  -4.786
  448   2HE   LYS  61          HE1       LYS  61  -7.659  -3.613  -5.778
  449   1HZ   LYS  61          HZ1       LYS  61  -5.286  -5.417  -5.726
  450   2HZ   LYS  61          HZ2       LYS  61  -6.495  -5.515  -6.867
  451   3HZ   LYS  61          HZ3       LYS  61  -6.862  -5.787  -5.246
  452    H    ARG  62           H        ARG  62  -1.002  -0.154  -5.452
  453    HA   ARG  62           HA       ARG  62  -0.591   0.074  -8.319
  454   1HB   ARG  62          HB2       ARG  62  -1.055   2.493  -8.189
  455   2HB   ARG  62          HB1       ARG  62  -2.459   1.481  -7.894
  456   1HG   ARG  62          HG2       ARG  62  -2.274   1.904  -5.497
  457   2HG   ARG  62          HG1       ARG  62  -0.805   2.818  -5.781
  458   1HD   ARG  62          HD2       ARG  62  -2.844   4.205  -5.484
  459   2HD   ARG  62          HD1       ARG  62  -1.962   4.543  -6.952
  460    HE   ARG  62           HE       ARG  62  -4.450   2.970  -6.757
  461   1HH1  ARG  62          HH11      ARG  62  -2.215   4.982  -8.712
  462   2HH1  ARG  62          HH12      ARG  62  -3.328   5.195  -9.975
  463   1HH2  ARG  62          HH21      ARG  62  -5.909   3.287  -8.535
  464   2HH2  ARG  62          HH22      ARG  62  -5.464   4.212  -9.912
  465    H    TYR  63           H        TYR  63   1.377   0.373  -8.833
  466    HA   TYR  63           HA       TYR  63   3.514   0.616  -7.069
  467   1HB   TYR  63          HB2       TYR  63   4.866   1.137  -9.167
  468   2HB   TYR  63          HB1       TYR  63   3.953  -0.365  -9.175
  469    HD1  TYR  63           HD1      TYR  63   3.872   3.153 -10.390
  470    HD2  TYR  63           HD2      TYR  63   2.395  -0.794 -10.877
  471    HE1  TYR  63           HE1      TYR  63   2.799   3.825 -12.480
  472    HE2  TYR  63           HE2      TYR  63   1.309  -0.127 -12.972
  473    HH   TYR  63           HH       TYR  63   2.064   2.569 -14.611
  474    H    ASP  64           H        ASP  64   1.566   3.103  -8.475
  475    HA   ASP  64           HA       ASP  64   3.451   5.210  -8.152
  476   1HB   ASP  64          HB2       ASP  64   1.473   6.660  -8.451
  477   2HB   ASP  64          HB1       ASP  64   1.832   5.581  -9.820
  478    H    ALA  65           H        ALA  65   1.129   3.760  -6.051
  479    HA   ALA  65           HA       ALA  65   0.859   5.822  -4.175
  480   1HB   ALA  65          HB1       ALA  65   0.396   3.987  -2.547
  481   2HB   ALA  65          HB2       ALA  65   0.816   2.830  -3.828
  482   3HB   ALA  65          HB3       ALA  65  -0.549   3.922  -4.018
  483    H    LEU  66           H        LEU  66   3.505   3.711  -4.808
  484    HA   LEU  66           HA       LEU  66   4.934   4.296  -2.362
  485   1HB   LEU  66          HB2       LEU  66   5.949   3.085  -4.890
  486   2HB   LEU  66          HB1       LEU  66   6.795   3.102  -3.356
  487    HG   LEU  66           HG       LEU  66   6.006   0.954  -3.507
  488   1HD1  LEU  66          HD11      LEU  66   4.270   0.686  -1.828
  489   2HD1  LEU  66          HD12      LEU  66   3.861   2.387  -2.002
  490   3HD1  LEU  66          HD13      LEU  66   5.443   1.926  -1.352
  491   1HD2  LEU  66          HD21      LEU  66   3.768   0.312  -4.218
  492   2HD2  LEU  66          HD22      LEU  66   4.612   1.273  -5.448
  493   3HD2  LEU  66          HD23      LEU  66   3.367   2.017  -4.454
  494    H    SER  67           H        SER  67   4.800   5.463  -5.549
  495    HA   SER  67           HA       SER  67   7.274   6.969  -5.545
  496   1HB   SER  67          HB2       SER  67   4.866   6.684  -7.189
  497   2HB   SER  67          HB1       SER  67   6.020   7.959  -7.578
  498    HG   SER  67           HG       SER  67   7.409   5.746  -7.264
  499    H    GLU  68           H        GLU  68   3.859   7.760  -5.301
  500    HA   GLU  68           HA       GLU  68   4.448  10.487  -4.743
  501   1HB   GLU  68          HB2       GLU  68   1.871   9.461  -3.806
  502   2HB   GLU  68          HB1       GLU  68   2.280  10.897  -4.748
  503   1HG   GLU  68          HG2       GLU  68   2.671   9.255  -6.683
  504   2HG   GLU  68          HG1       GLU  68   1.865   8.106  -5.674
  505    H    HIS  69           H        HIS  69   4.390   7.664  -2.976
  506    HA   HIS  69           HA       HIS  69   3.490   8.282  -0.464
  507   1HB   HIS  69          HB2       HIS  69   4.429   6.106  -1.409
  508   2HB   HIS  69          HB1       HIS  69   5.995   6.745  -0.849
  509    HD1  HIS  69           HD1      HIS  69   2.565   5.885   0.515
  510    HD2  HIS  69           HD2      HIS  69   6.526   6.135   1.540
  511    HE1  HIS  69           HE1      HIS  69   2.683   5.042   2.889
  512    H    ASN  70           H        ASN  70   6.958   8.662  -1.409
  513    HA   ASN  70           HA       ASN  70   7.570  10.223   0.934
  514   1HB   ASN  70          HB2       ASN  70   9.730  10.614  -0.204
  515   2HB   ASN  70          HB1       ASN  70   9.313   8.908  -0.065
  516   1HD2  ASN  70          HD21      ASN  70  11.105  10.069  -1.724
  517   2HD2  ASN  70          HD22      ASN  70  10.617   9.716  -3.387
  518    H    LEU  71           H        LEU  71   6.043  10.968  -1.867
  519    HA   LEU  71           HA       LEU  71   6.892  13.690  -2.020
  520   1HB   LEU  71          HB2       LEU  71   6.187  12.823  -4.074
  521   2HB   LEU  71          HB1       LEU  71   4.880  11.932  -3.343
  522    HG   LEU  71           HG       LEU  71   3.558  13.873  -3.171
  523   1HD1  LEU  71          HD11      LEU  71   5.897  15.318  -4.511
  524   2HD1  LEU  71          HD12      LEU  71   5.340  15.595  -2.861
  525   3HD1  LEU  71          HD13      LEU  71   4.314  16.037  -4.226
  526   1HD2  LEU  71          HD21      LEU  71   3.224  14.337  -5.579
  527   2HD2  LEU  71          HD22      LEU  71   3.398  12.626  -5.197
  528   3HD2  LEU  71          HD23      LEU  71   4.749  13.514  -5.908
  529    H    LYS  72           H        LYS  72   4.002  11.977  -0.928
  530    HA   LYS  72           HA       LYS  72   3.251  14.389   0.543
  531   1HB   LYS  72          HB2       LYS  72   0.955  12.967   0.465
  532   2HB   LYS  72          HB1       LYS  72   1.358  14.296  -0.643
  533   1HG   LYS  72          HG2       LYS  72   2.357  12.444  -2.096
  534   2HG   LYS  72          HG1       LYS  72   1.561  11.307  -1.063
  535   1HD   LYS  72          HD2       LYS  72   0.201  13.488  -2.640
  536   2HD   LYS  72          HD1       LYS  72   0.172  11.763  -2.999
  537   1HE   LYS  72          HE2       LYS  72  -1.079  11.374  -0.865
  538   2HE   LYS  72          HE1       LYS  72  -1.022  13.102  -0.551
  539   1HZ   LYS  72          HZ1       LYS  72  -3.106  12.371  -1.458
  540   2HZ   LYS  72          HZ2       LYS  72  -2.348  11.789  -2.839
  541   3HZ   LYS  72          HZ3       LYS  72  -2.354  13.449  -2.514
  542    H    TYR  73           H        TYR  73   3.502  11.011   0.861
  543    HA   TYR  73           HA       TYR  73   2.360  10.858   3.532
  544   1HB   TYR  73          HB2       TYR  73   3.807   8.836   1.857
  545   2HB   TYR  73          HB1       TYR  73   3.115   8.445   3.435
  546    HD1  TYR  73           HD1      TYR  73   1.921  10.283   0.427
  547    HD2  TYR  73           HD2      TYR  73   1.259   7.091   3.118
  548    HE1  TYR  73           HE1      TYR  73  -0.108   9.765  -0.733
  549    HE2  TYR  73           HE2      TYR  73  -0.812   6.551   1.948
  550    HH   TYR  73           HH       TYR  73  -1.592   8.158  -1.016
  551    H    HIS  74           H        HIS  74   5.591  10.192   2.146
  552    HA   HIS  74           HA       HIS  74   6.729  10.968   4.800
  553   1HB   HIS  74          HB2       HIS  74   7.981   9.250   2.633
  554   2HB   HIS  74          HB1       HIS  74   8.816   9.722   4.102
  555    HD1  HIS  74           HD1      HIS  74   6.762   8.754   6.244
  556    HD2  HIS  74           HD2      HIS  74   7.751   6.707   2.788
  557    HE1  HIS  74           HE1      HIS  74   6.144   6.356   6.682
  558    HA   PRO  75           HA       PRO  75   7.757  14.134   1.539
  559   1HB   PRO  75          HB2       PRO  75   7.001  16.321   2.847
  560   2HB   PRO  75          HB1       PRO  75   5.810  15.270   2.059
  561   1HG   PRO  75          HG2       PRO  75   6.639  15.312   4.956
  562   2HG   PRO  75          HG1       PRO  75   4.990  15.307   4.277
  563   1HD   PRO  75          HD2       PRO  75   6.214  13.026   5.134
  564   2HD   PRO  75          HD1       PRO  75   5.101  13.079   3.751
  565    H    GLY  76           H        GLY  76   9.516  15.303   1.300
  566   1HA   GLY  76          HA2       GLY  76  10.948  16.894   2.909
  567   2HA   GLY  76          HA1       GLY  76  11.503  15.302   3.414
  568    H    GLU  77           H        GLU  77  11.440  14.001   0.973
  569    HA   GLU  77           HA       GLU  77  13.021  15.426  -0.929
  570   1HB   GLU  77          HB2       GLU  77  14.983  13.909  -0.704
  571   2HB   GLU  77          HB1       GLU  77  14.753  14.924   0.710
  572   1HG   GLU  77          HG2       GLU  77  15.059  12.992   1.846
  573   2HG   GLU  77          HG1       GLU  77  13.367  12.726   1.413
  574    H    GLU  78           H        GLU  78  13.746  13.626  -2.618
  575    HA   GLU  78           HA       GLU  78  11.611  11.621  -2.669
  576   1HB   GLU  78          HB2       GLU  78  11.004  13.623  -4.014
  577   2HB   GLU  78          HB1       GLU  78  12.478  13.355  -4.935
  578   1HG   GLU  78          HG2       GLU  78  11.631  11.297  -5.797
  579   2HG   GLU  78          HG1       GLU  78  10.189  11.412  -4.780
  580    H    ASN  79           H        ASN  79  13.127  10.074  -2.094
  581    HA   ASN  79           HA       ASN  79  14.828   9.051  -4.235
  582   1HB   ASN  79          HB2       ASN  79  15.766   9.735  -1.461
  583   2HB   ASN  79          HB1       ASN  79  16.737   8.807  -2.616
  584   1HD2  ASN  79          HD21      ASN  79  15.479  11.796  -1.722
  585   2HD2  ASN  79          HD22      ASN  79  16.292  12.870  -2.799
  586    H    PHE  80           H        PHE  80  13.447   7.303  -4.261
  587    HA   PHE  80           HA       PHE  80  13.335   5.641  -1.847
  588   1HB   PHE  80          HB2       PHE  80  11.437   6.267  -3.942
  589   2HB   PHE  80          HB1       PHE  80  11.674   4.540  -3.750
  590    HD1  PHE  80           HD1      PHE  80   9.823   7.289  -2.682
  591    HD2  PHE  80           HD2      PHE  80  11.571   3.720  -1.237
  592    HE1  PHE  80           HE1      PHE  80   8.182   7.226  -0.843
  593    HE2  PHE  80           HE2      PHE  80   9.925   3.633   0.568
  594    HZ   PHE  80           HZ       PHE  80   8.224   5.380   0.768
  595    H    LYS  81           H        LYS  81  14.111   3.618  -1.924
  596    HA   LYS  81           HA       LYS  81  15.694   2.899  -4.292
  597   1HB   LYS  81          HB2       LYS  81  17.322   2.070  -2.854
  598   2HB   LYS  81          HB1       LYS  81  16.549   3.229  -1.772
  599   1HG   LYS  81          HG2       LYS  81  15.245   1.534  -0.741
  600   2HG   LYS  81          HG1       LYS  81  15.805   0.333  -1.892
  601   1HD   LYS  81          HD2       LYS  81  18.152   0.890  -1.024
  602   2HD   LYS  81          HD1       LYS  81  17.287   1.652   0.326
  603   1HE   LYS  81          HE2       LYS  81  16.068  -0.448   0.693
  604   2HE   LYS  81          HE1       LYS  81  16.992  -1.170  -0.618
  605   1HZ   LYS  81          HZ1       LYS  81  19.020  -0.812   0.679
  606   2HZ   LYS  81          HZ2       LYS  81  17.918  -1.764   1.534
  607   3HZ   LYS  81          HZ3       LYS  81  18.117  -0.141   1.945
  608    H    LEU  82           H        LEU  82  15.817   0.405  -4.517
  609    HA   LEU  82           HA       LEU  82  13.233  -0.724  -3.830
  610   1HB   LEU  82          HB2       LEU  82  13.100  -1.851  -6.024
  611   2HB   LEU  82          HB1       LEU  82  12.998  -0.113  -6.153
  612    HG   LEU  82           HG       LEU  82  15.588  -1.549  -6.652
  613   1HD1  LEU  82          HD11      LEU  82  13.885  -2.551  -8.131
  614   2HD1  LEU  82          HD12      LEU  82  14.987  -1.538  -9.063
  615   3HD1  LEU  82          HD13      LEU  82  13.381  -0.942  -8.649
  616   1HD2  LEU  82          HD21      LEU  82  16.043   0.419  -8.062
  617   2HD2  LEU  82          HD22      LEU  82  15.691   0.882  -6.396
  618   3HD2  LEU  82          HD23      LEU  82  14.462   1.078  -7.644
  619    H    THR  83           H        THR  83  13.393  -2.576  -2.821
  620    HA   THR  83           HA       THR  83  15.684  -4.225  -3.360
  621    HB   THR  83           HB       THR  83  16.280  -2.996  -1.371
  622    HG1  THR  83           HG1      THR  83  16.186  -5.573  -1.401
  623   1HG2  THR  83          HG21      THR  83  13.683  -3.893  -0.127
  624   2HG2  THR  83          HG22      THR  83  14.061  -2.254  -0.648
  625   3HG2  THR  83          HG23      THR  83  14.951  -2.981   0.697
  626    H    MET  84           H        MET  84  14.842  -6.257  -3.906
  627    HA   MET  84           HA       MET  84  11.987  -6.522  -3.202
  628   1HB   MET  84          HB2       MET  84  12.706  -6.738  -5.591
  629   2HB   MET  84          HB1       MET  84  13.679  -8.117  -5.108
  630   1HG   MET  84          HG2       MET  84  11.679  -9.355  -4.517
  631   2HG   MET  84          HG1       MET  84  10.675  -7.962  -4.919
  632   1HE   MET  84          HE1       MET  84   9.181  -9.281  -6.638
  633   2HE   MET  84          HE2       MET  84  10.047 -10.749  -6.201
  634   3HE   MET  84          HE3       MET  84   9.829 -10.327  -7.899
  635    H    VAL  85           H        VAL  85  11.931  -7.298  -1.252
  636    HA   VAL  85           HA       VAL  85  12.845  -9.982  -0.861
  637    HB   VAL  85           HB       VAL  85  13.591  -9.227   1.570
  638   1HG1  VAL  85          HG11      VAL  85  15.097 -10.262  -0.061
  639   2HG1  VAL  85          HG12      VAL  85  15.919  -8.957   0.803
  640   3HG1  VAL  85          HG13      VAL  85  15.326  -8.698  -0.843
  641   1HG2  VAL  85          HG21      VAL  85  14.106  -6.705  -0.017
  642   2HG2  VAL  85          HG22      VAL  85  14.670  -7.013   1.626
  643   3HG2  VAL  85          HG23      VAL  85  12.939  -6.864   1.298
  644    H    LYS  86           H        LYS  86  10.818 -10.863  -0.422
  645    HA   LYS  86           HA       LYS  86   9.549  -9.654   1.874
  646   1HB   LYS  86          HB2       LYS  86   8.411  -8.892  -0.357
  647   2HB   LYS  86          HB1       LYS  86   7.792 -10.551  -0.382
  648   1HG   LYS  86          HG2       LYS  86   6.137  -9.107   0.455
  649   2HG   LYS  86          HG1       LYS  86   6.697 -10.161   1.751
  650   1HD   LYS  86          HD2       LYS  86   7.911  -8.458   2.801
  651   2HD   LYS  86          HD1       LYS  86   7.961  -7.486   1.339
  652   1HE   LYS  86          HE2       LYS  86   5.769  -6.651   1.682
  653   2HE   LYS  86          HE1       LYS  86   5.361  -7.937   2.836
  654   1HZ   LYS  86          HZ1       LYS  86   7.358  -5.798   3.124
  655   2HZ   LYS  86          HZ2       LYS  86   7.058  -7.006   4.246
  656   3HZ   LYS  86          HZ3       LYS  86   5.868  -5.867   3.962
  657    H    ARG  87           H        ARG  87   9.208 -11.181   3.297
  658    HA   ARG  87           HA       ARG  87   9.724 -13.810   2.214
  659   1HB   ARG  87          HB2       ARG  87  10.413 -12.688   4.931
  660   2HB   ARG  87          HB1       ARG  87  10.609 -14.380   4.499
  661   1HG   ARG  87          HG2       ARG  87  12.772 -13.461   4.162
  662   2HG   ARG  87          HG1       ARG  87  12.044 -13.539   2.557
  663   1HD   ARG  87          HD2       ARG  87  13.188 -11.429   2.770
  664   2HD   ARG  87          HD1       ARG  87  11.451 -11.143   2.726
  665    HE   ARG  87           HE       ARG  87  12.548 -11.353   5.362
  666   1HH1  ARG  87          HH11      ARG  87  11.717  -9.004   2.752
  667   2HH1  ARG  87          HH12      ARG  87  11.887  -7.668   3.739
  668   1HH2  ARG  87          HH21      ARG  87  12.753  -9.430   6.683
  669   2HH2  ARG  87          HH22      ARG  87  12.494  -7.884   5.982
  670    H    ASN  88           H        ASN  88   8.717 -15.603   2.960
  671    HA   ASN  88           HA       ASN  88   7.058 -16.945   3.653
  672   1HB   ASN  88          HB2       ASN  88   7.280 -15.955   5.889
  673   2HB   ASN  88          HB1       ASN  88   6.176 -14.663   5.434
  674   1HD2  ASN  88          HD21      ASN  88   4.632 -15.094   6.900
  675   2HD2  ASN  88          HD22      ASN  88   3.678 -16.531   6.940
  676    H    ASN  89           H        ASN  89   5.769 -13.714   3.236
  677    HA   ASN  89           HA       ASN  89   3.167 -14.511   2.414
  678   1HB   ASN  89          HB2       ASN  89   4.537 -11.888   1.767
  679   2HB   ASN  89          HB1       ASN  89   2.811 -12.199   1.746
  680   1HD2  ASN  89          HD21      ASN  89   5.601 -11.526   3.691
  681   2HD2  ASN  89          HD22      ASN  89   4.745 -11.281   5.164
  682    H    GLN  90           H        GLN  90   5.393 -12.668   0.320
  683    HA   GLN  90           HA       GLN  90   5.520 -14.589  -1.737
  684   1HB   GLN  90          HB2       GLN  90   4.349 -13.381  -3.436
  685   2HB   GLN  90          HB1       GLN  90   3.226 -13.577  -2.081
  686   1HG   GLN  90          HG2       GLN  90   4.771 -11.096  -2.582
  687   2HG   GLN  90          HG1       GLN  90   3.182 -11.365  -3.316
  688   1HE2  GLN  90          HE21      GLN  90   4.981 -10.520  -0.545
  689   2HE2  GLN  90          HE22      GLN  90   3.603 -10.173   0.465
  690    H    THR  91           H        THR  91   6.852 -13.518  -3.506
  691    HA   THR  91           HA       THR  91   8.511 -11.559  -2.209
  692    HB   THR  91           HB       THR  91   9.991 -12.139  -4.360
  693    HG1  THR  91           HG1      THR  91   9.283 -14.726  -3.968
  694   1HG2  THR  91          HG21      THR  91  11.176 -13.788  -2.926
  695   2HG2  THR  91          HG22      THR  91   9.787 -13.825  -1.840
  696   3HG2  THR  91          HG23      THR  91  10.718 -12.355  -2.015
  697    H    ILE  92           H        ILE  92   8.248  -9.630  -2.528
  698    HA   ILE  92           HA       ILE  92   7.423  -8.516  -5.003
  699    HB   ILE  92           HB       ILE  92   5.914  -6.919  -3.689
  700   1HG1  ILE  92          HG12      ILE  92   4.812  -8.232  -1.715
  701   2HG1  ILE  92          HG11      ILE  92   6.367  -9.028  -1.701
  702   1HG2  ILE  92          HG21      ILE  92   4.978  -8.457  -5.231
  703   2HG2  ILE  92          HG22      ILE  92   3.978  -8.428  -3.771
  704   3HG2  ILE  92          HG23      ILE  92   5.085  -9.773  -4.065
  705   1HD1  ILE  92          HD11      ILE  92   6.075  -6.050  -1.527
  706   2HD1  ILE  92          HD12      ILE  92   7.554  -6.992  -1.390
  707   3HD1  ILE  92          HD13      ILE  92   6.308  -7.132  -0.160
  708    H    PHE  93           H        PHE  93   7.719  -6.039  -4.958
  709    HA   PHE  93           HA       PHE  93  10.525  -5.751  -4.202
  710   1HB   PHE  93          HB2       PHE  93   8.558  -4.109  -5.765
  711   2HB   PHE  93          HB1       PHE  93  10.191  -3.576  -5.517
  712    HD1  PHE  93           HD1      PHE  93   7.951  -5.837  -7.281
  713    HD2  PHE  93           HD2      PHE  93  11.987  -4.667  -6.693
  714    HE1  PHE  93           HE1      PHE  93   8.568  -6.965  -9.377
  715    HE2  PHE  93           HE2      PHE  93  12.629  -5.794  -8.793
  716    HZ   PHE  93           HZ       PHE  93  10.914  -6.943 -10.138
  717    H    GLU  94           H        GLU  94  11.020  -4.714  -2.296
  718    HA   GLU  94           HA       GLU  94   9.002  -3.082  -1.071
  719   1HB   GLU  94          HB2       GLU  94  11.669  -3.991   0.076
  720   2HB   GLU  94          HB1       GLU  94  10.322  -3.261   0.932
  721   1HG   GLU  94          HG2       GLU  94   9.070  -5.349   0.001
  722   2HG   GLU  94          HG1       GLU  94  10.700  -6.039   0.055
  723    H    GLN  95           H        GLN  95   9.358  -0.988  -0.782
  724    HA   GLN  95           HA       GLN  95  11.731   0.114  -2.125
  725   1HB   GLN  95          HB2       GLN  95   9.402   0.286  -3.241
  726   2HB   GLN  95          HB1       GLN  95   9.039   1.456  -1.977
  727   1HG   GLN  95          HG2       GLN  95  10.783   2.876  -2.696
  728   2HG   GLN  95          HG1       GLN  95  11.380   1.661  -3.819
  729   1HE2  GLN  95          HE21      GLN  95   9.062   4.121  -3.201
  730   2HE2  GLN  95          HE22      GLN  95   8.433   4.179  -4.810
  731    H    THR  96           H        THR  96  13.067   0.990  -0.660
  732    HA   THR  96           HA       THR  96  11.946   2.146   1.809
  733    HB   THR  96           HB       THR  96  14.785   1.786   1.908
  734    HG1  THR  96           HG1      THR  96  14.115  -0.740   1.907
  735   1HG2  THR  96          HG21      THR  96  12.521   0.386   3.346
  736   2HG2  THR  96          HG22      THR  96  13.257   1.886   3.841
  737   3HG2  THR  96          HG23      THR  96  14.205   0.391   3.850
  738    H    ILE  97           H        ILE  97  13.065   4.064   2.655
  739    HA   ILE  97           HA       ILE  97  14.126   5.763   0.494
  740    HB   ILE  97           HB       ILE  97  13.176   6.704   3.215
  741   1HG1  ILE  97          HG12      ILE  97  11.465   6.653   0.782
  742   2HG1  ILE  97          HG11      ILE  97  11.505   5.243   1.830
  743   1HG2  ILE  97          HG21      ILE  97  12.891   8.762   2.034
  744   2HG2  ILE  97          HG22      ILE  97  13.147   7.973   0.473
  745   3HG2  ILE  97          HG23      ILE  97  14.489   8.154   1.597
  746   1HD1  ILE  97          HD11      ILE  97   9.669   6.415   2.477
  747   2HD1  ILE  97          HD12      ILE  97  10.421   7.975   2.298
  748   3HD1  ILE  97          HD13      ILE  97  10.859   6.914   3.676
  749    H    ASN  98           H        ASN  98  15.892   7.041   1.028
  750    HA   ASN  98           HA       ASN  98  17.739   5.749   2.882
  751   1HB   ASN  98          HB2       ASN  98  19.413   7.219   1.604
  752   2HB   ASN  98          HB1       ASN  98  18.654   5.910   0.694
  753   1HD2  ASN  98          HD21      ASN  98  17.215   9.076   1.517
  754   2HD2  ASN  98          HD22      ASN  98  17.046   9.607  -0.078
  755    H    ASP  99           H        ASP  99  15.534   7.973   3.260
  756    HA   ASP  99           HA       ASP  99  17.164   9.743   4.961
  757   1HB   ASP  99          HB2       ASP  99  17.027  10.623   2.621
  758   2HB   ASP  99          HB1       ASP  99  15.315  10.797   2.872
  759    H    LEU 100           H        LEU 100  13.955   9.410   3.551
  760    HA   LEU 100           HA       LEU 100  12.550  10.538   5.799
  761   1HB   LEU 100          HB2       LEU 100  11.423   9.108   3.389
  762   2HB   LEU 100          HB1       LEU 100  10.665  10.282   4.430
  763    HG   LEU 100           HG       LEU 100  13.063  11.186   2.949
  764   1HD1  LEU 100          HD11      LEU 100  11.510  11.773   1.058
  765   2HD1  LEU 100          HD12      LEU 100  10.383  10.567   1.717
  766   3HD1  LEU 100          HD13      LEU 100  11.982  10.099   1.154
  767   1HD2  LEU 100          HD21      LEU 100  10.391  12.391   3.530
  768   2HD2  LEU 100          HD22      LEU 100  11.776  13.202   2.831
  769   3HD2  LEU 100          HD23      LEU 100  11.841  12.633   4.519
  770    H    THR 101           H        THR 101  14.065   7.870   5.752
  771    HA   THR 101           HA       THR 101  12.490   5.639   6.170
  772    HB   THR 101           HB       THR 101  15.046   6.319   7.589
  773    HG1  THR 101           HG1      THR 101  14.883   5.433   4.915
  774   1HG2  THR 101          HG21      THR 101  15.603   3.980   7.051
  775   2HG2  THR 101          HG22      THR 101  14.077   3.801   6.197
  776   3HG2  THR 101          HG23      THR 101  14.084   4.061   7.946
  777    H    PHE 102           H        PHE 102  13.319   8.367   8.192
  778    HA   PHE 102           HA       PHE 102  11.871   7.247  10.471
  779   1HB   PHE 102          HB2       PHE 102  14.444   8.842  10.592
  780   2HB   PHE 102          HB1       PHE 102  13.507   8.313  11.987
  781    HD1  PHE 102           HD1      PHE 102  16.026   7.425   9.577
  782    HD2  PHE 102           HD2      PHE 102  13.288   5.857  12.420
  783    HE1  PHE 102           HE1      PHE 102  17.277   5.311   9.604
  784    HE2  PHE 102           HE2      PHE 102  14.537   3.734  12.456
  785    HZ   PHE 102           HZ       PHE 102  16.530   3.463  11.044
  Start of MODEL   13
    1    HA   MET   1           HA       MET   1 -10.728   5.699 -36.404
    2   1HB   MET   1          HB2       MET   1 -11.913   7.760 -35.943
    3   2HB   MET   1          HB1       MET   1 -13.145   6.901 -35.041
    4   1HG   MET   1          HG2       MET   1 -11.616   8.101 -33.563
    5   2HG   MET   1          HG1       MET   1 -11.541   6.365 -33.297
    6   1HE   MET   1          HE1       MET   1  -9.768   9.507 -34.777
    7   2HE   MET   1          HE2       MET   1  -9.868   8.484 -36.216
    8   3HE   MET   1          HE3       MET   1  -8.304   8.829 -35.481
    9    H    ALA   2           H        ALA   2  -9.831   4.183 -35.215
   10    HA   ALA   2           HA       ALA   2 -11.524   2.576 -33.458
   11   1HB   ALA   2          HB1       ALA   2 -10.518   1.207 -35.186
   12   2HB   ALA   2          HB2       ALA   2  -9.732   0.858 -33.643
   13   3HB   ALA   2          HB3       ALA   2  -8.930   1.874 -34.838
   14    H    HIS   3           H        HIS   3 -11.284   3.326 -31.457
   15    HA   HIS   3           HA       HIS   3  -8.712   3.720 -30.279
   16   1HB   HIS   3          HB2       HIS   3  -9.147   5.834 -31.659
   17   2HB   HIS   3          HB1       HIS   3 -10.537   6.127 -30.631
   18    HD1  HIS   3           HD1      HIS   3 -10.075   7.314 -28.393
   19    HD2  HIS   3           HD2      HIS   3  -6.644   6.081 -30.388
   20    HE1  HIS   3           HE1      HIS   3  -8.142   8.336 -27.154
   21    H    HIS   4           H        HIS   4  -9.128   4.287 -27.916
   22    HA   HIS   4           HA       HIS   4 -11.655   3.222 -27.057
   23   1HB   HIS   4          HB2       HIS   4  -9.392   4.488 -25.459
   24   2HB   HIS   4          HB1       HIS   4 -10.815   3.748 -24.748
   25    HD1  HIS   4           HD1      HIS   4  -7.486   2.933 -24.948
   26    HD2  HIS   4           HD2      HIS   4 -10.902   0.895 -26.152
   27    HE1  HIS   4           HE1      HIS   4  -6.852   0.505 -25.065
   28    H    HIS   5           H        HIS   5 -13.241   4.502 -27.683
   29    HA   HIS   5           HA       HIS   5 -13.026   7.318 -27.829
   30   1HB   HIS   5          HB2       HIS   5 -15.517   5.607 -28.009
   31   2HB   HIS   5          HB1       HIS   5 -15.406   7.303 -28.451
   32    HD1  HIS   5           HD1      HIS   5 -15.766   4.377 -30.229
   33    HD2  HIS   5           HD2      HIS   5 -12.847   7.340 -30.362
   34    HE1  HIS   5           HE1      HIS   5 -14.690   4.195 -32.473
   35    H    HIS   6           H        HIS   6 -14.106   5.176 -25.369
   36    HA   HIS   6           HA       HIS   6 -15.234   7.402 -23.849
   37   1HB   HIS   6          HB2       HIS   6 -14.950   4.490 -23.022
   38   2HB   HIS   6          HB1       HIS   6 -15.837   5.731 -22.159
   39    HD1  HIS   6           HD1      HIS   6 -18.167   6.436 -23.174
   40    HD2  HIS   6           HD2      HIS   6 -16.228   3.376 -25.185
   41    HE1  HIS   6           HE1      HIS   6 -19.887   5.384 -24.684
   42    H    HIS   7           H        HIS   7 -12.663   5.048 -23.781
   43    HA   HIS   7           HA       HIS   7 -10.653   4.941 -22.866
   44   1HB   HIS   7          HB2       HIS   7 -10.245   7.117 -23.946
   45   2HB   HIS   7          HB1       HIS   7 -10.916   7.951 -22.557
   46    HD1  HIS   7           HD1      HIS   7  -9.263   8.631 -20.793
   47    HD2  HIS   7           HD2      HIS   7  -7.732   5.762 -23.375
   48    HE1  HIS   7           HE1      HIS   7  -6.817   8.456 -20.252
   49    H    HIS   8           H        HIS   8 -11.538   3.684 -21.271
   50    HA   HIS   8           HA       HIS   8 -12.323   4.848 -18.746
   51   1HB   HIS   8          HB2       HIS   8 -12.210   2.000 -19.729
   52   2HB   HIS   8          HB1       HIS   8 -12.657   2.436 -18.086
   53    HD1  HIS   8           HD1      HIS   8 -14.229   1.598 -21.165
   54    HD2  HIS   8           HD2      HIS   8 -14.914   4.423 -18.201
   55    HE1  HIS   8           HE1      HIS   8 -16.627   2.292 -21.402
   56    H    ASN   9           H        ASN   9  -9.560   4.942 -19.781
   57    HA   ASN   9           HA       ASN   9  -7.963   3.438 -17.937
   58   1HB   ASN   9          HB2       ASN   9  -6.963   4.162 -20.025
   59   2HB   ASN   9          HB1       ASN   9  -7.341   5.838 -19.668
   60   1HD2  ASN   9          HD21      ASN   9  -5.291   6.592 -19.719
   61   2HD2  ASN   9          HD22      ASN   9  -4.071   6.156 -18.591
   62    H    GLN  10           H        GLN  10  -8.215   3.826 -15.873
   63    HA   GLN  10           HA       GLN  10  -8.271   6.607 -14.949
   64   1HB   GLN  10          HB2       GLN  10  -9.908   4.327 -13.817
   65   2HB   GLN  10          HB1       GLN  10  -9.902   5.989 -13.250
   66   1HG   GLN  10          HG2       GLN  10 -10.879   6.704 -15.377
   67   2HG   GLN  10          HG1       GLN  10 -10.900   5.030 -15.922
   68   1HE2  GLN  10          HE21      GLN  10 -13.050   6.868 -15.594
   69   2HE2  GLN  10          HE22      GLN  10 -14.187   6.186 -14.502
   70    H    GLN  11           H        GLN  11  -7.587   6.737 -12.699
   71    HA   GLN  11           HA       GLN  11  -5.673   4.636 -11.982
   72   1HB   GLN  11          HB2       GLN  11  -6.004   7.471 -10.951
   73   2HB   GLN  11          HB1       GLN  11  -4.808   6.324 -10.372
   74   1HG   GLN  11          HG2       GLN  11  -3.768   6.286 -12.579
   75   2HG   GLN  11          HG1       GLN  11  -4.976   7.427 -13.167
   76   1HE2  GLN  11          HE21      GLN  11  -2.056   7.632 -12.951
   77   2HE2  GLN  11          HE22      GLN  11  -1.758   9.071 -12.042
   78    H    ASN  12           H        ASN  12  -8.750   5.178 -11.664
   79    HA   ASN  12           HA       ASN  12 -10.418   4.658 -10.276
   80   1HB   ASN  12          HB2       ASN  12  -8.185   3.115  -8.953
   81   2HB   ASN  12          HB1       ASN  12  -9.790   3.114  -8.244
   82   1HD2  ASN  12          HD21      ASN  12 -11.463   2.073  -9.329
   83   2HD2  ASN  12          HD22      ASN  12 -11.188   0.963 -10.617
   84    H    LYS  13           H        LYS  13 -10.124   4.497  -7.237
   85    HA   LYS  13           HA       LYS  13 -10.406   7.289  -6.830
   86   1HB   LYS  13          HB2       LYS  13 -10.774   6.776  -4.492
   87   2HB   LYS  13          HB1       LYS  13 -11.651   5.648  -5.496
   88   1HG   LYS  13          HG2       LYS  13  -9.969   3.928  -5.105
   89   2HG   LYS  13          HG1       LYS  13  -9.023   5.061  -4.156
   90   1HD   LYS  13          HD2       LYS  13 -11.854   4.388  -3.392
   91   2HD   LYS  13          HD1       LYS  13 -10.511   3.357  -2.916
   92   1HE   LYS  13          HE2       LYS  13 -11.003   4.828  -1.089
   93   2HE   LYS  13          HE1       LYS  13  -9.476   5.330  -1.789
   94   1HZ   LYS  13          HZ1       LYS  13 -10.721   7.164  -2.916
   95   2HZ   LYS  13          HZ2       LYS  13 -10.747   7.208  -1.267
   96   3HZ   LYS  13          HZ3       LYS  13 -12.116   6.675  -2.078
   97    H    LYS  14           H        LYS  14  -7.679   5.547  -7.245
   98    HA   LYS  14           HA       LYS  14  -5.481   5.867  -7.005
   99   1HB   LYS  14          HB2       LYS  14  -6.567   8.499  -7.054
  100   2HB   LYS  14          HB1       LYS  14  -5.359   8.491  -5.785
  101   1HG   LYS  14          HG2       LYS  14  -4.905   7.715  -8.673
  102   2HG   LYS  14          HG1       LYS  14  -4.409   9.225  -7.913
  103   1HD   LYS  14          HD2       LYS  14  -2.935   7.985  -6.402
  104   2HD   LYS  14          HD1       LYS  14  -3.443   6.466  -7.126
  105   1HE   LYS  14          HE2       LYS  14  -1.336   7.084  -7.980
  106   2HE   LYS  14          HE1       LYS  14  -2.511   7.246  -9.294
  107   1HZ   LYS  14          HZ1       LYS  14  -2.535   9.723  -8.643
  108   2HZ   LYS  14          HZ2       LYS  14  -1.145   9.177  -9.383
  109   3HZ   LYS  14          HZ3       LYS  14  -1.162   9.375  -7.720
  110    H    VAL  15           H        VAL  15  -3.979   7.209  -5.032
  111    HA   VAL  15           HA       VAL  15  -4.805   5.726  -2.692
  112    HB   VAL  15           HB       VAL  15  -2.573   5.187  -3.976
  113   1HG1  VAL  15          HG11      VAL  15  -1.766   7.681  -2.633
  114   2HG1  VAL  15          HG12      VAL  15  -1.689   7.294  -4.357
  115   3HG1  VAL  15          HG13      VAL  15  -0.623   6.455  -3.196
  116   1HG2  VAL  15          HG21      VAL  15  -3.108   4.207  -1.848
  117   2HG2  VAL  15          HG22      VAL  15  -2.564   5.671  -1.020
  118   3HG2  VAL  15          HG23      VAL  15  -1.399   4.665  -1.884
  119    H    GLU  16           H        GLU  16  -5.388   7.018  -0.982
  120    HA   GLU  16           HA       GLU  16  -5.147   9.855  -1.477
  121   1HB   GLU  16          HB2       GLU  16  -6.687   8.436   0.670
  122   2HB   GLU  16          HB1       GLU  16  -6.770  10.153   0.279
  123   1HG   GLU  16          HG2       GLU  16  -7.536   9.552  -1.964
  124   2HG   GLU  16          HG1       GLU  16  -7.510   7.864  -1.457
  125    H    GLY  17           H        GLY  17  -5.233   8.512   1.770
  126   1HA   GLY  17          HA2       GLY  17  -2.485   9.398   2.099
  127   2HA   GLY  17          HA1       GLY  17  -3.751  10.107   3.125
  128    H    GLY  18           H        GLY  18  -4.207   6.945   2.244
  129   1HA   GLY  18          HA2       GLY  18  -2.964   6.091   4.753
  130   2HA   GLY  18          HA1       GLY  18  -4.555   5.484   4.308
  131    H    TYR  19           H        TYR  19  -3.703   3.385   4.496
  132    HA   TYR  19           HA       TYR  19  -1.806   2.607   2.372
  133   1HB   TYR  19          HB2       TYR  19  -2.615   1.010   4.782
  134   2HB   TYR  19          HB1       TYR  19  -1.223   0.784   3.729
  135    HD1  TYR  19           HD1      TYR  19   0.311   3.043   3.629
  136    HD2  TYR  19           HD2      TYR  19  -2.154   1.817   6.865
  137    HE1  TYR  19           HE1      TYR  19   1.640   4.430   5.162
  138    HE2  TYR  19           HE2      TYR  19  -0.881   3.159   8.389
  139    HH   TYR  19           HH       TYR  19   1.449   4.165   8.507
  140    H    GLU  20           H        GLU  20  -2.609   1.944   0.725
  141    HA   GLU  20           HA       GLU  20  -5.198   0.638   0.715
  142   1HB   GLU  20          HB2       GLU  20  -4.769   2.323  -1.021
  143   2HB   GLU  20          HB1       GLU  20  -3.304   1.472  -1.496
  144   1HG   GLU  20          HG2       GLU  20  -4.851  -0.538  -1.917
  145   2HG   GLU  20          HG1       GLU  20  -6.152   0.651  -1.891
  146    H    CYS  21           H        CYS  21  -5.259  -1.422   0.486
  147    HA   CYS  21           HA       CYS  21  -2.879  -3.067   0.475
  148   1HB   CYS  21          HB2       CYS  21  -5.739  -3.913   0.128
  149   2HB   CYS  21          HB1       CYS  21  -4.375  -4.983   0.398
  150    H    LYS  22           H        LYS  22  -2.128  -4.313  -1.105
  151    HA   LYS  22           HA       LYS  22  -2.589  -3.886  -3.842
  152   1HB   LYS  22          HB2       LYS  22  -0.475  -4.727  -3.162
  153   2HB   LYS  22          HB1       LYS  22  -1.194  -6.037  -2.243
  154   1HG   LYS  22          HG2       LYS  22  -0.090  -6.859  -4.236
  155   2HG   LYS  22          HG1       LYS  22  -1.828  -7.138  -4.329
  156   1HD   LYS  22          HD2       LYS  22  -1.967  -5.011  -5.645
  157   2HD   LYS  22          HD1       LYS  22  -0.197  -5.046  -5.705
  158   1HE   LYS  22          HE2       LYS  22  -0.250  -7.196  -6.816
  159   2HE   LYS  22          HE1       LYS  22  -2.003  -7.264  -6.653
  160   1HZ   LYS  22          HZ1       LYS  22  -2.174  -5.357  -8.144
  161   2HZ   LYS  22          HZ2       LYS  22  -1.338  -6.621  -8.861
  162   3HZ   LYS  22          HZ3       LYS  22  -0.486  -5.297  -8.290
  163    H    TYR  23           H        TYR  23  -4.269  -5.711  -1.521
  164    HA   TYR  23           HA       TYR  23  -5.581  -7.286  -3.581
  165   1HB   TYR  23          HB2       TYR  23  -5.881  -8.751  -1.215
  166   2HB   TYR  23          HB1       TYR  23  -4.841  -9.133  -2.577
  167    HD1  TYR  23           HD1      TYR  23  -4.956  -7.943   0.861
  168    HD2  TYR  23           HD2      TYR  23  -2.421  -8.550  -2.482
  169    HE1  TYR  23           HE1      TYR  23  -2.989  -7.742   2.329
  170    HE2  TYR  23           HE2      TYR  23  -0.441  -8.359  -1.027
  171    HH   TYR  23           HH       TYR  23  -0.645  -8.453   2.363
  172    H    CYS  24           H        CYS  24  -6.278  -4.648  -1.936
  173    HA   CYS  24           HA       CYS  24  -9.018  -5.053  -2.283
  174   1HB   CYS  24          HB2       CYS  24  -9.869  -4.805  -0.021
  175   2HB   CYS  24          HB1       CYS  24  -8.733  -6.152  -0.072
  176    H    THR  25           H        THR  25 -10.154  -3.060  -2.234
  177    HA   THR  25           HA       THR  25  -8.384  -0.787  -2.476
  178    HB   THR  25           HB       THR  25 -11.389  -0.963  -3.011
  179    HG1  THR  25           HG1      THR  25 -10.221  -2.335  -4.386
  180   1HG2  THR  25          HG21      THR  25  -9.346   1.058  -3.981
  181   2HG2  THR  25          HG22      THR  25 -10.526   1.337  -2.704
  182   3HG2  THR  25          HG23      THR  25 -11.075   1.058  -4.357
  183    H    PHE  26           H        PHE  26  -9.778  -2.238   0.038
  184    HA   PHE  26           HA       PHE  26 -10.784   0.004   1.497
  185   1HB   PHE  26          HB2       PHE  26  -9.871  -2.723   2.459
  186   2HB   PHE  26          HB1       PHE  26 -10.587  -1.501   3.500
  187    HD1  PHE  26           HD1      PHE  26 -11.232  -4.337   1.540
  188    HD2  PHE  26           HD2      PHE  26 -12.922  -0.608   2.702
  189    HE1  PHE  26           HE1      PHE  26 -13.479  -5.185   0.995
  190    HE2  PHE  26           HE2      PHE  26 -15.166  -1.452   2.158
  191    HZ   PHE  26           HZ       PHE  26 -15.446  -3.740   1.306
  192    H    GLN  27           H        GLN  27  -9.515   1.617   1.890
  193    HA   GLN  27           HA       GLN  27  -6.737   1.128   2.615
  194   1HB   GLN  27          HB2       GLN  27  -6.659   2.411   0.675
  195   2HB   GLN  27          HB1       GLN  27  -8.091   3.343   1.116
  196   1HG   GLN  27          HG2       GLN  27  -6.811   4.542   2.791
  197   2HG   GLN  27          HG1       GLN  27  -5.446   3.478   2.471
  198   1HE2  GLN  27          HE21      GLN  27  -4.151   3.963   1.029
  199   2HE2  GLN  27          HE22      GLN  27  -4.116   5.325  -0.033
  200    H    THR  28           H        THR  28  -5.932   1.966   4.391
  201    HA   THR  28           HA       THR  28  -7.457   3.860   5.916
  202    HB   THR  28           HB       THR  28  -8.311   1.800   6.861
  203    HG1  THR  28           HG1      THR  28  -8.133   2.996   8.575
  204   1HG2  THR  28          HG21      THR  28  -5.433   1.006   7.369
  205   2HG2  THR  28          HG22      THR  28  -6.489   0.286   6.161
  206   3HG2  THR  28          HG23      THR  28  -6.853   0.101   7.875
  207    HA   PRO  29           HA       PRO  29  -3.233   5.268   6.480
  208   1HB   PRO  29          HB2       PRO  29  -3.828   7.374   8.091
  209   2HB   PRO  29          HB1       PRO  29  -4.059   7.384   6.333
  210   1HG   PRO  29          HG2       PRO  29  -6.072   6.877   8.491
  211   2HG   PRO  29          HG1       PRO  29  -6.211   7.898   7.048
  212   1HD   PRO  29          HD2       PRO  29  -7.272   5.427   7.138
  213   2HD   PRO  29          HD1       PRO  29  -6.555   6.072   5.638
  214    H    ASP  30           H        ASP  30  -5.239   3.872   8.734
  215    HA   ASP  30           HA       ASP  30  -3.356   4.143  10.931
  216   1HB   ASP  30          HB2       ASP  30  -5.953   2.602  10.700
  217   2HB   ASP  30          HB1       ASP  30  -4.963   2.678  12.152
  218    H    LEU  31           H        LEU  31  -1.605   2.906  10.674
  219    HA   LEU  31           HA       LEU  31  -1.296   0.730   9.027
  220   1HB   LEU  31          HB2       LEU  31   0.355   2.208  10.433
  221   2HB   LEU  31          HB1       LEU  31   0.186   0.938  11.620
  222    HG   LEU  31           HG       LEU  31   2.209   0.564  10.362
  223   1HD1  LEU  31          HD11      LEU  31   1.830  -1.655   9.423
  224   2HD1  LEU  31          HD12      LEU  31   0.088  -1.303   9.448
  225   3HD1  LEU  31          HD13      LEU  31   0.976  -1.440  10.968
  226   1HD2  LEU  31          HD21      LEU  31   1.582   1.848   8.413
  227   2HD2  LEU  31          HD22      LEU  31   0.486   0.569   7.914
  228   3HD2  LEU  31          HD23      LEU  31   2.232   0.265   7.964
  229    H    ASN  32           H        ASN  32  -2.251   0.937  12.442
  230    HA   ASN  32           HA       ASN  32  -2.290  -1.707  13.181
  231   1HB   ASN  32          HB2       ASN  32  -2.794   0.234  14.727
  232   2HB   ASN  32          HB1       ASN  32  -4.320   0.376  13.845
  233   1HD2  ASN  32          HD21      ASN  32  -3.172  -2.808  14.475
  234   2HD2  ASN  32          HD22      ASN  32  -4.356  -3.098  15.667
  235    H    MET  33           H        MET  33  -4.809   0.223  11.680
  236    HA   MET  33           HA       MET  33  -6.662  -1.935  11.610
  237   1HB   MET  33          HB2       MET  33  -6.746   0.665  10.086
  238   2HB   MET  33          HB1       MET  33  -8.090  -0.451  10.276
  239   1HG   MET  33          HG2       MET  33  -6.670   1.021  12.422
  240   2HG   MET  33          HG1       MET  33  -8.262   1.452  11.780
  241   1HE   MET  33          HE1       MET  33  -9.535  -1.529  11.438
  242   2HE   MET  33          HE2       MET  33 -10.425  -0.153  12.092
  243   3HE   MET  33          HE3       MET  33 -10.392  -1.679  12.973
  244    H    PHE  34           H        PHE  34  -4.338  -0.550   9.478
  245    HA   PHE  34           HA       PHE  34  -5.136  -1.810   7.109
  246   1HB   PHE  34          HB2       PHE  34  -3.555  -0.018   6.941
  247   2HB   PHE  34          HB1       PHE  34  -2.433  -0.791   8.026
  248    HD1  PHE  34           HD1      PHE  34  -0.741  -2.159   7.199
  249    HD2  PHE  34           HD2      PHE  34  -4.030  -1.183   4.676
  250    HE1  PHE  34           HE1      PHE  34   0.407  -3.216   5.290
  251    HE2  PHE  34           HE2      PHE  34  -2.888  -2.231   2.772
  252    HZ   PHE  34           HZ       PHE  34  -0.671  -3.254   3.076
  253    H    THR  35           H        THR  35  -2.662  -2.757   9.446
  254    HA   THR  35           HA       THR  35  -2.284  -5.222   8.066
  255    HB   THR  35           HB       THR  35  -0.355  -4.241   9.207
  256    HG1  THR  35           HG1      THR  35  -0.962  -6.725   9.238
  257   1HG2  THR  35          HG21      THR  35  -1.867  -4.779  11.766
  258   2HG2  THR  35          HG22      THR  35  -1.437  -3.200  11.097
  259   3HG2  THR  35          HG23      THR  35  -0.174  -4.282  11.678
  260    H    PHE  36           H        PHE  36  -4.291  -4.178  10.655
  261    HA   PHE  36           HA       PHE  36  -4.942  -6.735  11.640
  262   1HB   PHE  36          HB2       PHE  36  -5.455  -5.012  13.111
  263   2HB   PHE  36          HB1       PHE  36  -6.200  -4.020  11.871
  264    HD1  PHE  36           HD1      PHE  36  -6.672  -7.388  13.420
  265    HD2  PHE  36           HD2      PHE  36  -8.469  -3.812  12.005
  266    HE1  PHE  36           HE1      PHE  36  -8.886  -8.217  14.126
  267    HE2  PHE  36           HE2      PHE  36 -10.681  -4.635  12.699
  268    HZ   PHE  36           HZ       PHE  36 -10.884  -6.845  13.758
  269    H    HIS  37           H        HIS  37  -6.608  -4.589   9.308
  270    HA   HIS  37           HA       HIS  37  -8.564  -6.571   8.863
  271   1HB   HIS  37          HB2       HIS  37  -9.613  -5.128   7.328
  272   2HB   HIS  37          HB1       HIS  37  -8.724  -4.011   8.354
  273    HD1  HIS  37           HD1      HIS  37  -7.162  -2.420   7.165
  274    HD2  HIS  37           HD2      HIS  37  -8.435  -5.548   4.759
  275    HE1  HIS  37           HE1      HIS  37  -6.390  -1.847   4.823
  276    H    VAL  38           H        VAL  38  -5.449  -5.977   7.556
  277    HA   VAL  38           HA       VAL  38  -5.689  -7.708   5.323
  278    HB   VAL  38           HB       VAL  38  -3.284  -6.797   6.897
  279   1HG1  VAL  38          HG11      VAL  38  -2.801  -9.002   5.937
  280   2HG1  VAL  38          HG12      VAL  38  -1.874  -7.762   5.083
  281   3HG1  VAL  38          HG13      VAL  38  -3.329  -8.448   4.350
  282   1HG2  VAL  38          HG21      VAL  38  -2.757  -5.519   4.861
  283   2HG2  VAL  38          HG22      VAL  38  -4.323  -5.087   5.547
  284   3HG2  VAL  38          HG23      VAL  38  -4.242  -6.116   4.119
  285    H    ASP  39           H        ASP  39  -4.360  -8.175   8.580
  286    HA   ASP  39           HA       ASP  39  -3.723 -10.886   8.304
  287   1HB   ASP  39          HB2       ASP  39  -2.904  -9.369  10.084
  288   2HB   ASP  39          HB1       ASP  39  -4.508  -9.371  10.795
  289    H    SER  40           H        SER  40  -6.650  -9.276   8.974
  290    HA   SER  40           HA       SER  40  -8.045 -11.614   9.898
  291   1HB   SER  40          HB2       SER  40  -8.607  -9.416  10.792
  292   2HB   SER  40          HB1       SER  40  -9.026  -8.854   9.183
  293    HG   SER  40           HG       SER  40 -10.791 -10.167   9.146
  294    H    GLU  41           H        GLU  41  -8.070  -9.626   6.946
  295    HA   GLU  41           HA       GLU  41 -10.166 -11.406   5.904
  296   1HB   GLU  41          HB2       GLU  41  -9.249  -8.774   4.753
  297   2HB   GLU  41          HB1       GLU  41 -10.660  -9.698   4.274
  298   1HG   GLU  41          HG2       GLU  41 -10.243  -8.364   6.941
  299   2HG   GLU  41          HG1       GLU  41 -11.276  -7.782   5.640
  300    H    HIS  42           H        HIS  42  -6.884 -10.292   5.121
  301    HA   HIS  42           HA       HIS  42  -6.728 -12.352   3.133
  302   1HB   HIS  42          HB2       HIS  42  -5.148 -10.329   2.102
  303   2HB   HIS  42          HB1       HIS  42  -6.702 -10.810   1.434
  304    HD1  HIS  42           HD1      HIS  42  -8.761  -9.167   2.134
  305    HD2  HIS  42           HD2      HIS  42  -4.973  -7.773   3.138
  306    HE1  HIS  42           HE1      HIS  42  -9.050  -6.738   2.599
  307    HA   PRO  43           HA       PRO  43  -3.364 -12.148   6.387
  308   1HB   PRO  43          HB2       PRO  43  -3.377 -14.825   6.988
  309   2HB   PRO  43          HB1       PRO  43  -4.370 -13.618   7.809
  310   1HG   PRO  43          HG2       PRO  43  -5.116 -15.515   5.627
  311   2HG   PRO  43          HG1       PRO  43  -6.047 -15.030   7.055
  312   1HD   PRO  43          HD2       PRO  43  -6.526 -14.014   4.598
  313   2HD   PRO  43          HD1       PRO  43  -6.748 -13.070   6.086
  314    H    ASN  44           H        ASN  44  -3.565 -15.179   4.516
  315    HA   ASN  44           HA       ASN  44  -0.814 -14.678   3.657
  316   1HB   ASN  44          HB2       ASN  44  -1.155 -16.843   4.828
  317   2HB   ASN  44          HB1       ASN  44  -2.393 -17.274   3.655
  318   1HD2  ASN  44          HD21      ASN  44   1.017 -16.960   4.228
  319   2HD2  ASN  44          HD22      ASN  44   1.545 -17.748   2.801
  320    H    VAL  45           H        VAL  45  -0.559 -14.017   1.669
  321    HA   VAL  45           HA       VAL  45  -2.330 -14.855  -0.414
  322    HB   VAL  45           HB       VAL  45  -3.439 -12.826   0.473
  323   1HG1  VAL  45          HG11      VAL  45  -1.631 -11.807   1.611
  324   2HG1  VAL  45          HG12      VAL  45  -2.419 -10.670   0.534
  325   3HG1  VAL  45          HG13      VAL  45  -0.858 -11.372   0.084
  326   1HG2  VAL  45          HG21      VAL  45  -3.541 -13.135  -1.936
  327   2HG2  VAL  45          HG22      VAL  45  -2.038 -12.224  -2.132
  328   3HG2  VAL  45          HG23      VAL  45  -3.485 -11.421  -1.522
  329    H    VAL  46           H        VAL  46  -1.250 -14.745  -2.433
  330    HA   VAL  46           HA       VAL  46   1.586 -14.106  -2.169
  331    HB   VAL  46           HB       VAL  46   0.477 -16.551  -3.580
  332   1HG1  VAL  46          HG11      VAL  46   2.821 -17.199  -3.925
  333   2HG1  VAL  46          HG12      VAL  46   3.340 -15.664  -3.232
  334   3HG1  VAL  46          HG13      VAL  46   2.430 -15.685  -4.743
  335   1HG2  VAL  46          HG21      VAL  46   2.142 -16.349  -1.065
  336   2HG2  VAL  46          HG22      VAL  46   1.663 -17.848  -1.862
  337   3HG2  VAL  46          HG23      VAL  46   0.441 -16.801  -1.144
  338    H    LEU  47           H        LEU  47   2.053 -12.565  -3.454
  339    HA   LEU  47           HA       LEU  47   0.966 -12.437  -6.191
  340   1HB   LEU  47          HB2       LEU  47   2.238 -10.237  -4.509
  341   2HB   LEU  47          HB1       LEU  47   1.787 -10.063  -6.181
  342    HG   LEU  47           HG       LEU  47   0.192  -8.928  -4.868
  343   1HD1  LEU  47          HD11      LEU  47  -0.718 -10.059  -6.764
  344   2HD1  LEU  47          HD12      LEU  47  -1.886  -9.996  -5.446
  345   3HD1  LEU  47          HD13      LEU  47  -1.027 -11.499  -5.791
  346   1HD2  LEU  47          HD21      LEU  47   0.521  -9.951  -2.710
  347   2HD2  LEU  47          HD22      LEU  47  -0.162 -11.467  -3.296
  348   3HD2  LEU  47          HD23      LEU  47  -1.190 -10.044  -3.140
  349    H    ASN  48           H        ASN  48   2.739 -11.345  -7.639
  350    HA   ASN  48           HA       ASN  48   5.345 -12.519  -6.909
  351   1HB   ASN  48          HB2       ASN  48   4.276 -13.858  -8.664
  352   2HB   ASN  48          HB1       ASN  48   4.130 -12.427  -9.667
  353   1HD2  ASN  48          HD21      ASN  48   6.333 -14.709  -8.286
  354   2HD2  ASN  48          HD22      ASN  48   7.665 -14.399  -9.341
  355    H    SER  49           H        SER  49   3.683  -9.861  -8.484
  356    HA   SER  49           HA       SER  49   6.137  -8.349  -8.179
  357   1HB   SER  49          HB2       SER  49   4.541  -8.440 -10.739
  358   2HB   SER  49          HB1       SER  49   5.941  -7.406 -10.439
  359    HG   SER  49           HG       SER  49   6.588  -9.861  -9.783
  360    H    SER  50           H        SER  50   5.312  -7.130  -6.529
  361    HA   SER  50           HA       SER  50   3.463  -5.102  -7.327
  362   1HB   SER  50          HB2       SER  50   3.214  -6.757  -4.807
  363   2HB   SER  50          HB1       SER  50   2.225  -5.373  -5.272
  364    HG   SER  50           HG       SER  50   2.226  -7.090  -7.271
  365    H    TYR  51           H        TYR  51   3.606  -3.389  -5.533
  366    HA   TYR  51           HA       TYR  51   6.356  -3.307  -4.565
  367   1HB   TYR  51          HB2       TYR  51   4.709  -1.363  -6.032
  368   2HB   TYR  51          HB1       TYR  51   5.693  -0.734  -4.726
  369    HD1  TYR  51           HD1      TYR  51   6.362  -3.334  -7.361
  370    HD2  TYR  51           HD2      TYR  51   7.493   0.362  -5.591
  371    HE1  TYR  51           HE1      TYR  51   8.296  -3.211  -8.874
  372    HE2  TYR  51           HE2      TYR  51   9.447   0.482  -7.091
  373    HH   TYR  51           HH       TYR  51   9.773  -1.564  -9.789
  374    H    VAL  52           H        VAL  52   6.718  -2.689  -2.569
  375    HA   VAL  52           HA       VAL  52   4.446  -1.852  -0.912
  376    HB   VAL  52           HB       VAL  52   4.934  -4.270  -0.571
  377   1HG1  VAL  52          HG11      VAL  52   6.952  -4.980   0.474
  378   2HG1  VAL  52          HG12      VAL  52   7.602  -3.342   0.355
  379   3HG1  VAL  52          HG13      VAL  52   7.247  -4.273  -1.112
  380   1HG2  VAL  52          HG21      VAL  52   5.715  -2.598   1.789
  381   2HG2  VAL  52          HG22      VAL  52   5.231  -4.295   1.834
  382   3HG2  VAL  52          HG23      VAL  52   4.078  -3.064   1.324
  383    H    CYS  53           H        CYS  53   4.882  -0.250   0.482
  384    HA   CYS  53           HA       CYS  53   7.513   1.048   0.443
  385   1HB   CYS  53          HB2       CYS  53   5.585   2.467   0.570
  386   2HB   CYS  53          HB1       CYS  53   4.929   1.595   1.941
  387    H    VAL  54           H        VAL  54   8.973  -0.234   1.433
  388    HA   VAL  54           HA       VAL  54   8.508  -2.140   3.372
  389    HB   VAL  54           HB       VAL  54  11.008  -0.757   3.786
  390   1HG1  VAL  54          HG11      VAL  54  10.325  -3.361   2.701
  391   2HG1  VAL  54          HG12      VAL  54  10.502  -3.016   4.446
  392   3HG1  VAL  54          HG13      VAL  54  11.899  -2.907   3.325
  393   1HG2  VAL  54          HG21      VAL  54  11.887  -1.535   1.519
  394   2HG2  VAL  54          HG22      VAL  54  11.016  -0.022   1.659
  395   3HG2  VAL  54          HG23      VAL  54  10.190  -1.403   1.001
  396    H    GLU  55           H        GLU  55   9.088   1.226   3.597
  397    HA   GLU  55           HA       GLU  55   9.774   1.553   6.237
  398   1HB   GLU  55          HB2       GLU  55   8.066   3.460   4.652
  399   2HB   GLU  55          HB1       GLU  55   9.166   3.855   5.965
  400   1HG   GLU  55          HG2       GLU  55   9.992   2.811   3.259
  401   2HG   GLU  55          HG1       GLU  55  10.056   4.488   3.773
  402    H    CYS  56           H        CYS  56   6.695   1.379   4.656
  403    HA   CYS  56           HA       CYS  56   5.304   1.571   7.284
  404   1HB   CYS  56          HB2       CYS  56   4.041   1.514   4.562
  405   2HB   CYS  56          HB1       CYS  56   3.347   2.140   6.061
  406    H    ASN  57           H        ASN  57   6.333  -0.601   4.996
  407    HA   ASN  57           HA       ASN  57   5.664  -2.348   3.973
  408   1HB   ASN  57          HB2       ASN  57   5.770  -3.111   6.785
  409   2HB   ASN  57          HB1       ASN  57   4.943  -4.279   5.734
  410   1HD2  ASN  57          HD21      ASN  57   6.473  -3.815   3.394
  411   2HD2  ASN  57          HD22      ASN  57   8.029  -4.461   3.647
  412    H    PHE  58           H        PHE  58   4.123  -1.103   3.039
  413    HA   PHE  58           HA       PHE  58   1.544  -2.422   3.344
  414   1HB   PHE  58          HB2       PHE  58   0.358  -0.479   3.476
  415   2HB   PHE  58          HB1       PHE  58   1.878   0.211   4.010
  416    HD1  PHE  58           HD1      PHE  58  -0.489  -0.085   1.271
  417    HD2  PHE  58           HD2      PHE  58   3.072   1.790   2.580
  418    HE1  PHE  58           HE1      PHE  58  -0.697   1.585  -0.556
  419    HE2  PHE  58           HE2      PHE  58   2.884   3.440   0.717
  420    HZ   PHE  58           HZ       PHE  58   1.008   3.323  -0.827
  421    H    LEU  59           H        LEU  59   0.887  -3.343   1.587
  422    HA   LEU  59           HA       LEU  59   2.446  -3.027  -0.842
  423   1HB   LEU  59          HB2       LEU  59   0.798  -5.197   0.306
  424   2HB   LEU  59          HB1       LEU  59   0.743  -5.015  -1.436
  425    HG   LEU  59           HG       LEU  59   3.348  -5.349   0.044
  426   1HD1  LEU  59          HD11      LEU  59   3.182  -7.699  -0.572
  427   2HD1  LEU  59          HD12      LEU  59   1.616  -7.387  -1.330
  428   3HD1  LEU  59          HD13      LEU  59   1.785  -7.262   0.427
  429   1HD2  LEU  59          HD21      LEU  59   3.472  -4.409  -2.214
  430   2HD2  LEU  59          HD22      LEU  59   2.465  -5.717  -2.817
  431   3HD2  LEU  59          HD23      LEU  59   4.070  -6.069  -2.207
  432    H    THR  60           H        THR  60   1.496  -2.163  -2.617
  433    HA   THR  60           HA       THR  60  -1.364  -1.588  -2.457
  434    HB   THR  60           HB       THR  60  -0.391   0.464  -1.967
  435    HG1  THR  60           HG1      THR  60  -1.943   0.723  -3.690
  436   1HG2  THR  60          HG21      THR  60   1.510   1.489  -3.104
  437   2HG2  THR  60          HG22      THR  60   1.595   0.138  -4.222
  438   3HG2  THR  60          HG23      THR  60   1.942  -0.106  -2.513
  439    H    LYS  61           H        LYS  61  -2.330  -1.121  -4.600
  440    HA   LYS  61           HA       LYS  61  -1.254  -3.073  -6.455
  441   1HB   LYS  61          HB2       LYS  61  -3.615  -2.911  -7.480
  442   2HB   LYS  61          HB1       LYS  61  -3.410  -3.768  -5.972
  443   1HG   LYS  61          HG2       LYS  61  -4.191  -1.715  -4.788
  444   2HG   LYS  61          HG1       LYS  61  -4.553  -1.016  -6.372
  445   1HD   LYS  61          HD2       LYS  61  -6.119  -2.750  -6.863
  446   2HD   LYS  61          HD1       LYS  61  -5.629  -3.668  -5.443
  447   1HE   LYS  61          HE2       LYS  61  -7.768  -2.565  -5.070
  448   2HE   LYS  61          HE1       LYS  61  -6.533  -1.926  -3.993
  449   1HZ   LYS  61          HZ1       LYS  61  -6.415   0.057  -5.217
  450   2HZ   LYS  61          HZ2       LYS  61  -8.067  -0.296  -5.098
  451   3HZ   LYS  61          HZ3       LYS  61  -7.253  -0.607  -6.532
  452    H    ARG  62           H        ARG  62  -0.413  -0.249  -6.211
  453    HA   ARG  62           HA       ARG  62  -0.183   0.114  -9.071
  454   1HB   ARG  62          HB2       ARG  62  -0.690   2.541  -8.958
  455   2HB   ARG  62          HB1       ARG  62  -2.093   1.579  -8.534
  456   1HG   ARG  62          HG2       ARG  62  -1.728   2.038  -6.190
  457   2HG   ARG  62          HG1       ARG  62  -0.247   2.910  -6.574
  458   1HD   ARG  62          HD2       ARG  62  -2.138   4.431  -6.156
  459   2HD   ARG  62          HD1       ARG  62  -1.520   4.584  -7.795
  460    HE   ARG  62           HE       ARG  62  -3.475   3.890  -8.605
  461   1HH1  ARG  62          HH11      ARG  62  -3.364   2.934  -5.188
  462   2HH1  ARG  62          HH12      ARG  62  -4.962   2.445  -5.115
  463   1HH2  ARG  62          HH21      ARG  62  -5.754   3.313  -8.452
  464   2HH2  ARG  62          HH22      ARG  62  -6.362   2.678  -6.996
  465    H    TYR  63           H        TYR  63   1.779   1.155  -9.604
  466    HA   TYR  63           HA       TYR  63   3.691   1.050  -7.453
  467   1HB   TYR  63          HB2       TYR  63   5.419   1.572  -9.191
  468   2HB   TYR  63          HB1       TYR  63   4.462   0.152  -9.567
  469    HD1  TYR  63           HD1      TYR  63   4.887   3.761 -10.399
  470    HD2  TYR  63           HD2      TYR  63   3.318   0.000 -11.638
  471    HE1  TYR  63           HE1      TYR  63   4.430   4.691 -12.618
  472    HE2  TYR  63           HE2      TYR  63   2.850   0.931 -13.866
  473    HH   TYR  63           HH       TYR  63   4.120   3.927 -14.872
  474    H    ASP  64           H        ASP  64   1.713   3.305  -8.793
  475    HA   ASP  64           HA       ASP  64   3.178   5.724  -8.532
  476   1HB   ASP  64          HB2       ASP  64   0.206   5.399  -8.154
  477   2HB   ASP  64          HB1       ASP  64   1.055   6.897  -8.479
  478    H    ALA  65           H        ALA  65   1.319   3.872  -6.240
  479    HA   ALA  65           HA       ALA  65   0.993   5.944  -4.394
  480   1HB   ALA  65          HB1       ALA  65   0.455   4.105  -2.794
  481   2HB   ALA  65          HB2       ALA  65   0.882   2.968  -4.099
  482   3HB   ALA  65          HB3       ALA  65  -0.450   4.092  -4.301
  483    H    LEU  66           H        LEU  66   3.606   3.806  -5.008
  484    HA   LEU  66           HA       LEU  66   4.990   4.307  -2.528
  485   1HB   LEU  66          HB2       LEU  66   6.046   3.175  -5.088
  486   2HB   LEU  66          HB1       LEU  66   6.868   3.128  -3.547
  487    HG   LEU  66           HG       LEU  66   6.077   0.987  -3.831
  488   1HD1  LEU  66          HD11      LEU  66   3.957   2.349  -2.210
  489   2HD1  LEU  66          HD12      LEU  66   5.538   1.803  -1.630
  490   3HD1  LEU  66          HD13      LEU  66   4.338   0.626  -2.171
  491   1HD2  LEU  66          HD21      LEU  66   4.695   1.380  -5.751
  492   2HD2  LEU  66          HD22      LEU  66   3.450   2.122  -4.747
  493   3HD2  LEU  66          HD23      LEU  66   3.815   0.405  -4.575
  494    H    SER  67           H        SER  67   4.894   5.544  -5.736
  495    HA   SER  67           HA       SER  67   7.382   7.002  -5.743
  496   1HB   SER  67          HB2       SER  67   4.922   6.796  -7.334
  497   2HB   SER  67          HB1       SER  67   6.087   8.045  -7.755
  498    HG   SER  67           HG       SER  67   6.134   5.215  -7.960
  499    H    GLU  68           H        GLU  68   4.011   7.772  -5.409
  500    HA   GLU  68           HA       GLU  68   4.501  10.518  -4.812
  501   1HB   GLU  68          HB2       GLU  68   1.900   9.322  -4.051
  502   2HB   GLU  68          HB1       GLU  68   2.302  10.833  -4.855
  503   1HG   GLU  68          HG2       GLU  68   2.967   9.440  -6.862
  504   2HG   GLU  68          HG1       GLU  68   2.232   8.125  -6.033
  505    H    HIS  69           H        HIS  69   4.447   7.651  -3.115
  506    HA   HIS  69           HA       HIS  69   3.477   8.189  -0.601
  507   1HB   HIS  69          HB2       HIS  69   4.544   6.058  -1.514
  508   2HB   HIS  69          HB1       HIS  69   6.057   6.754  -0.912
  509    HD1  HIS  69           HD1      HIS  69   2.683   5.613   0.369
  510    HD2  HIS  69           HD2      HIS  69   6.525   6.400   1.632
  511    HE1  HIS  69           HE1      HIS  69   2.764   4.850   2.772
  512    H    ASN  70           H        ASN  70   6.930   8.692  -1.471
  513    HA   ASN  70           HA       ASN  70   7.495  10.212   0.886
  514   1HB   ASN  70          HB2       ASN  70   9.651  10.713  -0.255
  515   2HB   ASN  70          HB1       ASN  70   9.302   9.002  -0.106
  516   1HD2  ASN  70          HD21      ASN  70  11.078  10.056  -1.772
  517   2HD2  ASN  70          HD22      ASN  70  10.582   9.736  -3.430
  518    H    LEU  71           H        LEU  71   5.975  11.007  -1.862
  519    HA   LEU  71           HA       LEU  71   6.602  13.816  -1.797
  520   1HB   LEU  71          HB2       LEU  71   6.036  13.166  -3.939
  521   2HB   LEU  71          HB1       LEU  71   4.856  12.006  -3.395
  522    HG   LEU  71           HG       LEU  71   3.254  13.759  -3.018
  523   1HD1  LEU  71          HD11      LEU  71   3.709  16.086  -3.828
  524   2HD1  LEU  71          HD12      LEU  71   5.379  15.625  -4.158
  525   3HD1  LEU  71          HD13      LEU  71   4.784  15.647  -2.499
  526   1HD2  LEU  71          HD21      LEU  71   2.862  14.375  -5.361
  527   2HD2  LEU  71          HD22      LEU  71   3.316  12.681  -5.167
  528   3HD2  LEU  71          HD23      LEU  71   4.498  13.851  -5.754
  529    H    LYS  72           H        LYS  72   3.826  11.796  -0.922
  530    HA   LYS  72           HA       LYS  72   2.736  14.096   0.521
  531   1HB   LYS  72          HB2       LYS  72   0.624  12.377   0.325
  532   2HB   LYS  72          HB1       LYS  72   0.891  13.758  -0.754
  533   1HG   LYS  72          HG2       LYS  72   2.214  12.067  -2.149
  534   2HG   LYS  72          HG1       LYS  72   1.488  10.825  -1.168
  535   1HD   LYS  72          HD2       LYS  72   0.077  12.825  -2.905
  536   2HD   LYS  72          HD1       LYS  72   0.243  11.094  -3.196
  537   1HE   LYS  72          HE2       LYS  72  -1.066  10.731  -1.071
  538   2HE   LYS  72          HE1       LYS  72  -1.336  12.463  -1.030
  539   1HZ   LYS  72          HZ1       LYS  72  -2.242  10.639  -3.205
  540   2HZ   LYS  72          HZ2       LYS  72  -2.418  12.303  -3.211
  541   3HZ   LYS  72          HZ3       LYS  72  -3.209  11.390  -2.054
  542    H    TYR  73           H        TYR  73   3.373  10.763   0.886
  543    HA   TYR  73           HA       TYR  73   2.237  10.604   3.549
  544   1HB   TYR  73          HB2       TYR  73   3.737   8.642   1.860
  545   2HB   TYR  73          HB1       TYR  73   3.099   8.229   3.456
  546    HD1  TYR  73           HD1      TYR  73   1.094   7.038   3.409
  547    HD2  TYR  73           HD2      TYR  73   1.917   9.741   0.240
  548    HE1  TYR  73           HE1      TYR  73  -1.005   6.376   2.257
  549    HE2  TYR  73           HE2      TYR  73  -0.127   9.085  -0.871
  550    HH   TYR  73           HH       TYR  73  -2.523   7.448   0.703
  551    H    HIS  74           H        HIS  74   5.512  10.099   2.113
  552    HA   HIS  74           HA       HIS  74   6.652  10.853   4.756
  553   1HB   HIS  74          HB2       HIS  74   7.860   9.102   2.597
  554   2HB   HIS  74          HB1       HIS  74   8.711   9.585   4.052
  555    HD1  HIS  74           HD1      HIS  74   6.245   8.749   6.046
  556    HD2  HIS  74           HD2      HIS  74   7.944   6.485   3.005
  557    HE1  HIS  74           HE1      HIS  74   5.686   6.372   6.573
  558    HA   PRO  75           HA       PRO  75   7.794  14.023   1.531
  559   1HB   PRO  75          HB2       PRO  75   7.054  16.225   2.849
  560   2HB   PRO  75          HB1       PRO  75   5.868  15.210   2.010
  561   1HG   PRO  75          HG2       PRO  75   6.600  15.200   4.931
  562   2HG   PRO  75          HG1       PRO  75   4.979  15.227   4.199
  563   1HD   PRO  75          HD2       PRO  75   6.128  12.939   5.086
  564   2HD   PRO  75          HD1       PRO  75   5.055  13.010   3.672
  565    H    GLY  76           H        GLY  76   9.527  15.344   1.401
  566   1HA   GLY  76          HA2       GLY  76  10.915  16.832   3.115
  567   2HA   GLY  76          HA1       GLY  76  11.449  15.223   3.586
  568    H    GLU  77           H        GLU  77  11.488  14.013   1.075
  569    HA   GLU  77           HA       GLU  77  13.107  15.433  -0.788
  570   1HB   GLU  77          HB2       GLU  77  15.097  13.988  -0.521
  571   2HB   GLU  77          HB1       GLU  77  14.843  14.997   0.894
  572   1HG   GLU  77          HG2       GLU  77  14.937  13.176   2.159
  573   2HG   GLU  77          HG1       GLU  77  13.483  12.581   1.346
  574    H    GLU  78           H        GLU  78  13.890  13.627  -2.436
  575    HA   GLU  78           HA       GLU  78  11.808  11.574  -2.403
  576   1HB   GLU  78          HB2       GLU  78  11.120  13.466  -3.847
  577   2HB   GLU  78          HB1       GLU  78  12.618  13.196  -4.750
  578   1HG   GLU  78          HG2       GLU  78  11.843  10.958  -5.351
  579   2HG   GLU  78          HG1       GLU  78  10.333  11.254  -4.488
  580    H    ASN  79           H        ASN  79  13.361  10.038  -1.843
  581    HA   ASN  79           HA       ASN  79  14.965   9.117  -4.086
  582   1HB   ASN  79          HB2       ASN  79  16.022   9.677  -1.330
  583   2HB   ASN  79          HB1       ASN  79  16.939   8.773  -2.549
  584   1HD2  ASN  79          HD21      ASN  79  15.704  11.811  -1.545
  585   2HD2  ASN  79          HD22      ASN  79  16.511  12.845  -2.676
  586    H    PHE  80           H        PHE  80  13.620   7.410  -4.240
  587    HA   PHE  80           HA       PHE  80  13.429   5.633  -1.932
  588   1HB   PHE  80          HB2       PHE  80  11.605   6.337  -4.088
  589   2HB   PHE  80          HB1       PHE  80  11.822   4.604  -3.922
  590    HD1  PHE  80           HD1      PHE  80  10.025   7.414  -2.799
  591    HD2  PHE  80           HD2      PHE  80  11.552   3.691  -1.496
  592    HE1  PHE  80           HE1      PHE  80   8.299   7.322  -1.021
  593    HE2  PHE  80           HE2      PHE  80   9.837   3.581   0.237
  594    HZ   PHE  80           HZ       PHE  80   8.198   5.395   0.475
  595    H    LYS  81           H        LYS  81  14.148   3.584  -2.071
  596    HA   LYS  81           HA       LYS  81  15.830   2.908  -4.376
  597   1HB   LYS  81          HB2       LYS  81  17.368   1.999  -2.886
  598   2HB   LYS  81          HB1       LYS  81  16.572   3.170  -1.830
  599   1HG   LYS  81          HG2       LYS  81  15.193   1.516  -0.862
  600   2HG   LYS  81          HG1       LYS  81  15.735   0.307  -2.017
  601   1HD   LYS  81          HD2       LYS  81  18.067   0.707  -1.067
  602   2HD   LYS  81          HD1       LYS  81  17.223   1.544   0.250
  603   1HE   LYS  81          HE2       LYS  81  15.847  -0.445   0.619
  604   2HE   LYS  81          HE1       LYS  81  16.726  -1.251  -0.676
  605   1HZ   LYS  81          HZ1       LYS  81  17.513  -1.836   1.590
  606   2HZ   LYS  81          HZ2       LYS  81  18.010  -0.237   1.814
  607   3HZ   LYS  81          HZ3       LYS  81  18.718  -1.179   0.614
  608    H    LEU  82           H        LEU  82  15.944   0.392  -4.640
  609    HA   LEU  82           HA       LEU  82  13.301  -0.718  -4.136
  610   1HB   LEU  82          HB2       LEU  82  13.391  -1.903  -6.293
  611   2HB   LEU  82          HB1       LEU  82  13.346  -0.166  -6.500
  612    HG   LEU  82           HG       LEU  82  15.929  -1.704  -6.656
  613   1HD1  LEU  82          HD11      LEU  82  14.373  -2.667  -8.302
  614   2HD1  LEU  82          HD12      LEU  82  15.612  -1.713  -9.116
  615   3HD1  LEU  82          HD13      LEU  82  13.990  -1.052  -8.893
  616   1HD2  LEU  82          HD21      LEU  82  15.037   0.917  -7.843
  617   2HD2  LEU  82          HD22      LEU  82  16.646   0.201  -7.992
  618   3HD2  LEU  82          HD23      LEU  82  16.060   0.739  -6.420
  619    H    THR  83           H        THR  83  13.304  -2.664  -3.284
  620    HA   THR  83           HA       THR  83  15.641  -4.338  -3.482
  621    HB   THR  83           HB       THR  83  16.170  -3.091  -1.485
  622    HG1  THR  83           HG1      THR  83  15.346  -5.020   0.085
  623   1HG2  THR  83          HG21      THR  83  13.877  -2.214  -1.041
  624   2HG2  THR  83          HG22      THR  83  14.708  -2.779   0.400
  625   3HG2  THR  83          HG23      THR  83  13.469  -3.789  -0.347
  626    H    MET  84           H        MET  84  14.811  -6.444  -3.914
  627    HA   MET  84           HA       MET  84  11.923  -6.678  -3.304
  628   1HB   MET  84          HB2       MET  84  12.730  -7.100  -5.640
  629   2HB   MET  84          HB1       MET  84  13.731  -8.383  -4.995
  630   1HG   MET  84          HG2       MET  84  11.719  -9.626  -4.336
  631   2HG   MET  84          HG1       MET  84  10.716  -8.341  -5.021
  632   1HE   MET  84          HE1       MET  84   9.420  -9.988  -6.641
  633   2HE   MET  84          HE2       MET  84  10.312 -11.371  -6.004
  634   3HE   MET  84          HE3       MET  84  10.212 -11.110  -7.742
  635    H    VAL  85           H        VAL  85  11.882  -7.297  -1.223
  636    HA   VAL  85           HA       VAL  85  12.689  -9.997  -0.731
  637    HB   VAL  85           HB       VAL  85  13.393  -9.184   1.697
  638   1HG1  VAL  85          HG11      VAL  85  14.805 -10.469   0.212
  639   2HG1  VAL  85          HG12      VAL  85  15.744  -9.185   0.987
  640   3HG1  VAL  85          HG13      VAL  85  15.215  -9.009  -0.695
  641   1HG2  VAL  85          HG21      VAL  85  12.967  -6.800   1.262
  642   2HG2  VAL  85          HG22      VAL  85  14.179  -6.817  -0.014
  643   3HG2  VAL  85          HG23      VAL  85  14.664  -7.082   1.664
  644    H    LYS  86           H        LYS  86  10.685 -10.775  -0.334
  645    HA   LYS  86           HA       LYS  86   9.504  -9.532   1.976
  646   1HB   LYS  86          HB2       LYS  86   8.361  -8.795  -0.245
  647   2HB   LYS  86          HB1       LYS  86   7.749 -10.438  -0.257
  648   1HG   LYS  86          HG2       LYS  86   6.080  -9.105   0.558
  649   2HG   LYS  86          HG1       LYS  86   6.705 -10.000   1.954
  650   1HD   LYS  86          HD2       LYS  86   7.794  -8.071   2.819
  651   2HD   LYS  86          HD1       LYS  86   7.709  -7.226   1.280
  652   1HE   LYS  86          HE2       LYS  86   6.055  -6.173   2.661
  653   2HE   LYS  86          HE1       LYS  86   5.215  -7.234   1.549
  654   1HZ   LYS  86          HZ1       LYS  86   4.914  -8.859   3.276
  655   2HZ   LYS  86          HZ2       LYS  86   4.359  -7.381   3.808
  656   3HZ   LYS  86          HZ3       LYS  86   5.837  -7.953   4.352
  657    H    ARG  87           H        ARG  87   9.593 -11.029   3.348
  658    HA   ARG  87           HA       ARG  87   9.556 -13.797   2.418
  659   1HB   ARG  87          HB2       ARG  87  10.764 -12.546   4.908
  660   2HB   ARG  87          HB1       ARG  87  10.992 -14.232   4.369
  661   1HG   ARG  87          HG2       ARG  87  11.736 -11.807   2.835
  662   2HG   ARG  87          HG1       ARG  87  12.809 -12.490   4.077
  663   1HD   ARG  87          HD2       ARG  87  11.705 -13.864   1.677
  664   2HD   ARG  87          HD1       ARG  87  13.233 -12.973   1.830
  665    HE   ARG  87           HE       ARG  87  12.817 -15.156   3.696
  666   1HH1  ARG  87          HH11      ARG  87  14.409 -14.082   0.710
  667   2HH1  ARG  87          HH12      ARG  87  15.609 -15.271   0.749
  668   1HH2  ARG  87          HH21      ARG  87  14.518 -16.820   3.739
  669   2HH2  ARG  87          HH22      ARG  87  15.669 -16.830   2.490
  670    H    ASN  88           H        ASN  88   8.310 -15.242   3.688
  671    HA   ASN  88           HA       ASN  88   6.733 -16.011   5.079
  672   1HB   ASN  88          HB2       ASN  88   7.490 -14.606   6.931
  673   2HB   ASN  88          HB1       ASN  88   6.665 -13.210   6.261
  674   1HD2  ASN  88          HD21      ASN  88   6.281 -16.247   7.912
  675   2HD2  ASN  88          HD22      ASN  88   4.698 -15.942   8.527
  676    H    ASN  89           H        ASN  89   6.314 -13.869   2.689
  677    HA   ASN  89           HA       ASN  89   3.422 -14.411   2.653
  678   1HB   ASN  89          HB2       ASN  89   4.592 -11.720   1.864
  679   2HB   ASN  89          HB1       ASN  89   2.909 -12.188   1.718
  680   1HD2  ASN  89          HD21      ASN  89   5.394 -10.969   3.776
  681   2HD2  ASN  89          HD22      ASN  89   4.399 -10.797   5.171
  682    H    GLN  90           H        GLN  90   5.527 -12.565   0.478
  683    HA   GLN  90           HA       GLN  90   5.694 -14.588  -1.510
  684   1HB   GLN  90          HB2       GLN  90   4.426 -13.491  -3.203
  685   2HB   GLN  90          HB1       GLN  90   3.386 -13.586  -1.779
  686   1HG   GLN  90          HG2       GLN  90   4.926 -11.136  -2.473
  687   2HG   GLN  90          HG1       GLN  90   3.344 -11.443  -3.176
  688   1HE2  GLN  90          HE21      GLN  90   5.130 -10.508  -0.446
  689   2HE2  GLN  90          HE22      GLN  90   3.750 -10.058   0.539
  690    H    THR  91           H        THR  91   6.977 -13.580  -3.278
  691    HA   THR  91           HA       THR  91   8.563 -11.488  -2.077
  692    HB   THR  91           HB       THR  91  10.134 -12.027  -4.081
  693    HG1  THR  91           HG1      THR  91   8.258 -13.610  -4.723
  694   1HG2  THR  91          HG21      THR  91   9.782 -13.915  -1.731
  695   2HG2  THR  91          HG22      THR  91  10.696 -12.428  -1.693
  696   3HG2  THR  91          HG23      THR  91  11.250 -13.773  -2.690
  697    H    ILE  92           H        ILE  92   8.159  -9.609  -2.479
  698    HA   ILE  92           HA       ILE  92   7.387  -8.662  -5.046
  699    HB   ILE  92           HB       ILE  92   5.889  -6.976  -3.810
  700   1HG1  ILE  92          HG12      ILE  92   4.727  -8.174  -1.809
  701   2HG1  ILE  92          HG11      ILE  92   6.248  -9.044  -1.755
  702   1HG2  ILE  92          HG21      ILE  92   4.938  -8.550  -5.329
  703   2HG2  ILE  92          HG22      ILE  92   3.926  -8.463  -3.883
  704   3HG2  ILE  92          HG23      ILE  92   5.018  -9.833  -4.120
  705   1HD1  ILE  92          HD11      ILE  92   7.510  -7.057  -1.471
  706   2HD1  ILE  92          HD12      ILE  92   6.233  -7.097  -0.259
  707   3HD1  ILE  92          HD13      ILE  92   6.083  -6.056  -1.670
  708    H    PHE  93           H        PHE  93   7.693  -6.207  -5.167
  709    HA   PHE  93           HA       PHE  93  10.473  -5.901  -4.351
  710   1HB   PHE  93          HB2       PHE  93   8.653  -4.304  -6.136
  711   2HB   PHE  93          HB1       PHE  93  10.340  -3.940  -5.915
  712    HD1  PHE  93           HD1      PHE  93   7.878  -6.093  -7.499
  713    HD2  PHE  93           HD2      PHE  93  12.013  -5.365  -6.919
  714    HE1  PHE  93           HE1      PHE  93   8.379  -7.534  -9.432
  715    HE2  PHE  93           HE2      PHE  93  12.541  -6.810  -8.859
  716    HZ   PHE  93           HZ       PHE  93  10.716  -7.892 -10.115
  717    H    GLU  94           H        GLU  94  10.932  -4.692  -2.584
  718    HA   GLU  94           HA       GLU  94   8.876  -3.045  -1.436
  719   1HB   GLU  94          HB2       GLU  94  11.568  -3.866  -0.343
  720   2HB   GLU  94          HB1       GLU  94  10.250  -3.129   0.539
  721   1HG   GLU  94          HG2       GLU  94   8.967  -5.256  -0.097
  722   2HG   GLU  94          HG1       GLU  94  10.582  -5.921  -0.356
  723    H    GLN  95           H        GLN  95   9.286  -0.905  -1.041
  724    HA   GLN  95           HA       GLN  95  11.645   0.193  -2.421
  725   1HB   GLN  95          HB2       GLN  95   9.220   0.437  -3.442
  726   2HB   GLN  95          HB1       GLN  95   9.023   1.658  -2.196
  727   1HG   GLN  95          HG2       GLN  95  10.911   2.895  -3.088
  728   2HG   GLN  95          HG1       GLN  95  11.179   1.632  -4.278
  729   1HE2  GLN  95          HE21      GLN  95   9.170   4.293  -3.327
  730   2HE2  GLN  95          HE22      GLN  95   8.349   4.473  -4.829
  731    H    THR  96           H        THR  96  13.005   1.028  -0.882
  732    HA   THR  96           HA       THR  96  11.842   2.134   1.602
  733    HB   THR  96           HB       THR  96  14.661   1.705   1.804
  734    HG1  THR  96           HG1      THR  96  13.510  -0.810   1.590
  735   1HG2  THR  96          HG21      THR  96  13.251   1.795   3.708
  736   2HG2  THR  96          HG22      THR  96  13.910   0.155   3.650
  737   3HG2  THR  96          HG23      THR  96  12.257   0.486   3.127
  738    H    ILE  97           H        ILE  97  13.044   3.938   2.539
  739    HA   ILE  97           HA       ILE  97  14.174   5.707   0.452
  740    HB   ILE  97           HB       ILE  97  13.094   6.540   3.147
  741   1HG1  ILE  97          HG12      ILE  97  11.505   6.568   0.614
  742   2HG1  ILE  97          HG11      ILE  97  11.486   5.141   1.631
  743   1HG2  ILE  97          HG21      ILE  97  13.210   7.942   0.450
  744   2HG2  ILE  97          HG22      ILE  97  14.503   8.027   1.630
  745   3HG2  ILE  97          HG23      ILE  97  12.925   8.677   2.037
  746   1HD1  ILE  97          HD11      ILE  97  10.709   6.735   3.472
  747   2HD1  ILE  97          HD12      ILE  97   9.650   6.214   2.199
  748   3HD1  ILE  97          HD13      ILE  97  10.298   7.842   2.122
  749    H    ASN  98           H        ASN  98  15.916   6.930   1.020
  750    HA   ASN  98           HA       ASN  98  17.740   5.659   2.892
  751   1HB   ASN  98          HB2       ASN  98  19.438   7.110   1.850
  752   2HB   ASN  98          HB1       ASN  98  18.582   6.176   0.601
  753   1HD2  ASN  98          HD21      ASN  98  16.363   8.398   1.070
  754   2HD2  ASN  98          HD22      ASN  98  17.021   9.677   0.184
  755    H    ASP  99           H        ASP  99  15.405   7.670   3.463
  756    HA   ASP  99           HA       ASP  99  16.874   9.341   5.333
  757   1HB   ASP  99          HB2       ASP  99  16.986  10.362   3.067
  758   2HB   ASP  99          HB1       ASP  99  15.267  10.561   3.158
  759    H    LEU 100           H        LEU 100  13.854   9.219   3.580
  760    HA   LEU 100           HA       LEU 100  12.226  10.233   5.732
  761   1HB   LEU 100          HB2       LEU 100  11.367   8.976   3.161
  762   2HB   LEU 100          HB1       LEU 100  10.512  10.129   4.162
  763    HG   LEU 100           HG       LEU 100  13.092  10.999   2.992
  764   1HD1  LEU 100          HD11      LEU 100  12.104  10.028   1.073
  765   2HD1  LEU 100          HD12      LEU 100  11.685  11.740   0.992
  766   3HD1  LEU 100          HD13      LEU 100  10.510  10.552   1.571
  767   1HD2  LEU 100          HD21      LEU 100  10.428  12.295   3.387
  768   2HD2  LEU 100          HD22      LEU 100  11.926  13.086   2.914
  769   3HD2  LEU 100          HD23      LEU 100  11.766  12.392   4.541
  770    H    THR 101           H        THR 101  13.614   7.668   5.929
  771    HA   THR 101           HA       THR 101  12.016   5.386   5.821
  772    HB   THR 101           HB       THR 101  14.328   6.019   7.656
  773    HG1  THR 101           HG1      THR 101  14.189   5.149   4.969
  774   1HG2  THR 101          HG21      THR 101  13.190   3.771   7.940
  775   2HG2  THR 101          HG22      THR 101  14.873   3.669   7.414
  776   3HG2  THR 101          HG23      THR 101  13.586   3.444   6.242
  777    H    PHE 102           H        PHE 102  12.195   7.957   8.124
  778    HA   PHE 102           HA       PHE 102  11.196   6.796  10.460
  779   1HB   PHE 102          HB2       PHE 102  10.561   9.105  11.114
  780   2HB   PHE 102          HB1       PHE 102  12.209   8.981  10.524
  781    HD1  PHE 102           HD1      PHE 102  12.885  10.091   8.519
  782    HD2  PHE 102           HD2      PHE 102   8.827  10.238   9.766
  783    HE1  PHE 102           HE1      PHE 102  12.463  11.927   6.925
  784    HE2  PHE 102           HE2      PHE 102   8.390  12.056   8.167
  785    HZ   PHE 102           HZ       PHE 102  10.216  12.904   6.744
  Start of MODEL   14
    1    HA   MET   1           HA       MET   1  -3.897 -11.328 -21.240
    2   1HB   MET   1          HB2       MET   1  -6.490 -10.420 -19.964
    3   2HB   MET   1          HB1       MET   1  -5.080 -10.887 -19.036
    4   1HG   MET   1          HG2       MET   1  -5.193  -8.500 -19.149
    5   2HG   MET   1          HG1       MET   1  -3.818  -9.047 -20.098
    6   1HE   MET   1          HE1       MET   1  -3.667  -6.611 -21.196
    7   2HE   MET   1          HE2       MET   1  -5.051  -6.109 -20.226
    8   3HE   MET   1          HE3       MET   1  -5.038  -5.806 -21.961
    9    H    ALA   2           H        ALA   2  -3.517 -13.093 -19.965
   10    HA   ALA   2           HA       ALA   2  -4.697 -15.500 -20.732
   11   1HB   ALA   2          HB1       ALA   2  -2.399 -15.294 -19.880
   12   2HB   ALA   2          HB2       ALA   2  -3.320 -16.533 -19.028
   13   3HB   ALA   2          HB3       ALA   2  -3.044 -14.964 -18.271
   14    H    HIS   3           H        HIS   3  -6.717 -16.034 -20.335
   15    HA   HIS   3           HA       HIS   3  -8.676 -16.550 -19.281
   16   1HB   HIS   3          HB2       HIS   3  -6.858 -16.692 -16.862
   17   2HB   HIS   3          HB1       HIS   3  -8.541 -17.204 -16.844
   18    HD1  HIS   3           HD1      HIS   3  -8.887 -19.639 -17.350
   19    HD2  HIS   3           HD2      HIS   3  -5.279 -18.210 -18.831
   20    HE1  HIS   3           HE1      HIS   3  -7.670 -21.631 -18.266
   21    H    HIS   4           H        HIS   4  -7.783 -13.802 -19.525
   22    HA   HIS   4           HA       HIS   4  -8.305 -11.714 -19.024
   23   1HB   HIS   4          HB2       HIS   4 -10.739 -12.914 -17.652
   24   2HB   HIS   4          HB1       HIS   4 -10.533 -11.198 -17.992
   25    HD1  HIS   4           HD1      HIS   4 -10.974 -10.422 -20.459
   26    HD2  HIS   4           HD2      HIS   4 -11.262 -14.532 -19.872
   27    HE1  HIS   4           HE1      HIS   4 -11.958 -11.364 -22.564
   28    H    HIS   5           H        HIS   5  -6.459 -11.566 -17.883
   29    HA   HIS   5           HA       HIS   5  -6.750 -11.401 -14.981
   30   1HB   HIS   5          HB2       HIS   5  -5.119 -13.106 -15.696
   31   2HB   HIS   5          HB1       HIS   5  -4.294 -11.918 -16.689
   32    HD1  HIS   5           HD1      HIS   5  -2.050 -12.252 -15.409
   33    HD2  HIS   5           HD2      HIS   5  -5.207 -11.057 -12.994
   34    HE1  HIS   5           HE1      HIS   5  -1.041 -11.612 -13.215
   35    H    HIS   6           H        HIS   6  -7.144  -9.326 -14.537
   36    HA   HIS   6           HA       HIS   6  -5.935  -7.295 -16.236
   37   1HB   HIS   6          HB2       HIS   6  -7.525  -5.701 -15.239
   38   2HB   HIS   6          HB1       HIS   6  -8.339  -7.075 -15.954
   39    HD1  HIS   6           HD1      HIS   6 -10.097  -8.162 -14.487
   40    HD2  HIS   6           HD2      HIS   6  -7.412  -5.860 -12.305
   41    HE1  HIS   6           HE1      HIS   6 -11.000  -8.057 -12.148
   42    H    HIS   7           H        HIS   7  -5.188  -8.848 -13.514
   43    HA   HIS   7           HA       HIS   7  -3.586  -8.637 -11.943
   44   1HB   HIS   7          HB2       HIS   7  -2.873  -6.119 -13.443
   45   2HB   HIS   7          HB1       HIS   7  -2.003  -6.642 -12.009
   46    HD1  HIS   7           HD1      HIS   7  -0.047  -8.106 -12.453
   47    HD2  HIS   7           HD2      HIS   7  -2.732  -8.061 -15.616
   48    HE1  HIS   7           HE1      HIS   7   1.069  -9.368 -14.334
   49    H    HIS   8           H        HIS   8  -4.687  -5.317 -12.400
   50    HA   HIS   8           HA       HIS   8  -5.257  -5.236  -9.512
   51   1HB   HIS   8          HB2       HIS   8  -4.019  -2.996 -11.126
   52   2HB   HIS   8          HB1       HIS   8  -4.388  -2.969  -9.410
   53    HD1  HIS   8           HD1      HIS   8  -1.697  -3.730 -11.749
   54    HD2  HIS   8           HD2      HIS   8  -2.760  -4.894  -7.910
   55    HE1  HIS   8           HE1      HIS   8   0.381  -4.706 -10.722
   56    H    ASN   9           H        ASN   9  -7.171  -4.471  -9.034
   57    HA   ASN   9           HA       ASN   9  -8.796  -3.205 -11.110
   58   1HB   ASN   9          HB2       ASN   9  -9.808  -5.152  -9.988
   59   2HB   ASN   9          HB1       ASN   9  -9.581  -4.384  -8.422
   60   1HD2  ASN   9          HD21      ASN   9 -11.791  -4.480  -7.992
   61   2HD2  ASN   9          HD22      ASN   9 -12.934  -3.453  -8.774
   62    H    GLN  10           H        GLN  10  -8.775  -1.074 -11.097
   63    HA   GLN  10           HA       GLN  10  -8.503   0.349  -8.544
   64   1HB   GLN  10          HB2       GLN  10  -7.473   2.189  -9.875
   65   2HB   GLN  10          HB1       GLN  10  -6.519   0.713  -9.916
   66   1HG   GLN  10          HG2       GLN  10  -7.412   0.171 -12.111
   67   2HG   GLN  10          HG1       GLN  10  -8.415   1.613 -12.073
   68   1HE2  GLN  10          HE21      GLN  10  -6.325   3.275 -10.920
   69   2HE2  GLN  10          HE22      GLN  10  -5.173   3.530 -12.175
   70    H    GLN  11           H        GLN  11  -9.756   2.368  -8.468
   71    HA   GLN  11           HA       GLN  11 -11.795   2.497 -10.535
   72   1HB   GLN  11          HB2       GLN  11 -12.712   1.157  -8.679
   73   2HB   GLN  11          HB1       GLN  11 -12.473   2.521  -7.595
   74   1HG   GLN  11          HG2       GLN  11 -14.786   2.374  -8.309
   75   2HG   GLN  11          HG1       GLN  11 -14.032   3.850  -8.910
   76   1HE2  GLN  11          HE21      GLN  11 -15.529   4.035 -10.549
   77   2HE2  GLN  11          HE22      GLN  11 -15.538   3.026 -11.947
   78    H    ASN  12           H        ASN  12 -11.224   4.247  -7.443
   79    HA   ASN  12           HA       ASN  12 -11.190   6.686  -9.082
   80   1HB   ASN  12          HB2       ASN  12 -13.468   6.486  -8.397
   81   2HB   ASN  12          HB1       ASN  12 -12.997   6.184  -6.733
   82   1HD2  ASN  12          HD21      ASN  12 -13.309   8.613  -9.211
   83   2HD2  ASN  12          HD22      ASN  12 -13.173   9.969  -8.148
   84    H    LYS  13           H        LYS  13 -10.720   5.505  -5.755
   85    HA   LYS  13           HA       LYS  13  -9.755   7.945  -4.781
   86   1HB   LYS  13          HB2       LYS  13  -9.391   5.202  -3.611
   87   2HB   LYS  13          HB1       LYS  13  -9.084   6.716  -2.774
   88   1HG   LYS  13          HG2       LYS  13 -11.474   7.318  -3.077
   89   2HG   LYS  13          HG1       LYS  13 -11.746   5.726  -3.791
   90   1HD   LYS  13          HD2       LYS  13 -10.926   4.682  -1.710
   91   2HD   LYS  13          HD1       LYS  13 -10.730   6.285  -1.009
   92   1HE   LYS  13          HE2       LYS  13 -12.790   5.333  -0.228
   93   2HE   LYS  13          HE1       LYS  13 -13.154   6.668  -1.316
   94   1HZ   LYS  13          HZ1       LYS  13 -13.639   5.094  -3.065
   95   2HZ   LYS  13          HZ2       LYS  13 -14.548   4.707  -1.705
   96   3HZ   LYS  13          HZ3       LYS  13 -13.184   3.803  -2.076
   97    H    LYS  14           H        LYS  14  -8.027   5.523  -6.464
   98    HA   LYS  14           HA       LYS  14  -5.851   5.320  -7.167
   99   1HB   LYS  14          HB2       LYS  14  -6.282   7.930  -7.451
  100   2HB   LYS  14          HB1       LYS  14  -5.225   8.090  -6.077
  101   1HG   LYS  14          HG2       LYS  14  -4.513   6.899  -8.759
  102   2HG   LYS  14          HG1       LYS  14  -4.064   8.491  -8.176
  103   1HD   LYS  14          HD2       LYS  14  -2.765   7.414  -6.375
  104   2HD   LYS  14          HD1       LYS  14  -3.171   5.838  -7.062
  105   1HE   LYS  14          HE2       LYS  14  -0.992   6.477  -7.819
  106   2HE   LYS  14          HE1       LYS  14  -2.098   6.556  -9.191
  107   1HZ   LYS  14          HZ1       LYS  14  -1.097   8.813  -7.557
  108   2HZ   LYS  14          HZ2       LYS  14  -2.199   9.002  -8.841
  109   3HZ   LYS  14          HZ3       LYS  14  -0.640   8.494  -9.137
  110    H    VAL  15           H        VAL  15  -4.931   7.352  -4.585
  111    HA   VAL  15           HA       VAL  15  -4.822   5.423  -2.609
  112    HB   VAL  15           HB       VAL  15  -2.632   4.967  -4.003
  113   1HG1  VAL  15          HG11      VAL  15  -1.887   7.538  -2.729
  114   2HG1  VAL  15          HG12      VAL  15  -1.882   7.157  -4.460
  115   3HG1  VAL  15          HG13      VAL  15  -0.730   6.361  -3.350
  116   1HG2  VAL  15          HG21      VAL  15  -1.343   4.587  -1.968
  117   2HG2  VAL  15          HG22      VAL  15  -3.054   4.104  -1.822
  118   3HG2  VAL  15          HG23      VAL  15  -2.500   5.619  -1.116
  119    H    GLU  16           H        GLU  16  -5.128   6.604  -0.710
  120    HA   GLU  16           HA       GLU  16  -5.245   9.494  -1.138
  121   1HB   GLU  16          HB2       GLU  16  -6.351   7.848   1.108
  122   2HB   GLU  16          HB1       GLU  16  -6.703   9.543   0.787
  123   1HG   GLU  16          HG2       GLU  16  -7.817   8.919  -1.258
  124   2HG   GLU  16          HG1       GLU  16  -7.333   7.241  -0.983
  125    H    GLY  17           H        GLY  17  -4.816   7.963   2.002
  126   1HA   GLY  17          HA2       GLY  17  -2.125   9.033   2.108
  127   2HA   GLY  17          HA1       GLY  17  -3.309   9.747   3.211
  128    H    GLY  18           H        GLY  18  -3.848   6.559   2.528
  129   1HA   GLY  18          HA2       GLY  18  -2.469   5.790   5.001
  130   2HA   GLY  18          HA1       GLY  18  -4.062   5.178   4.553
  131    H    TYR  19           H        TYR  19  -3.351   3.109   4.709
  132    HA   TYR  19           HA       TYR  19  -1.364   2.197   2.721
  133   1HB   TYR  19          HB2       TYR  19  -2.485   0.684   5.053
  134   2HB   TYR  19          HB1       TYR  19  -1.016   0.328   4.148
  135    HD1  TYR  19           HD1      TYR  19  -2.053   1.260   7.225
  136    HD2  TYR  19           HD2      TYR  19   0.597   2.675   4.209
  137    HE1  TYR  19           HE1      TYR  19  -0.843   2.516   8.903
  138    HE2  TYR  19           HE2      TYR  19   1.844   3.947   5.913
  139    HH   TYR  19           HH       TYR  19   1.438   4.911   8.165
  140    H    GLU  20           H        GLU  20  -2.200   1.518   0.953
  141    HA   GLU  20           HA       GLU  20  -4.850   0.283   1.008
  142   1HB   GLU  20          HB2       GLU  20  -4.498   2.126  -0.662
  143   2HB   GLU  20          HB1       GLU  20  -3.193   1.185  -1.375
  144   1HG   GLU  20          HG2       GLU  20  -5.296  -0.605  -1.314
  145   2HG   GLU  20          HG1       GLU  20  -6.059   0.938  -1.700
  146    H    CYS  21           H        CYS  21  -4.868  -1.771   0.881
  147    HA   CYS  21           HA       CYS  21  -2.551  -3.430   0.454
  148   1HB   CYS  21          HB2       CYS  21  -5.450  -4.202   0.206
  149   2HB   CYS  21          HB1       CYS  21  -4.103  -5.317   0.401
  150    H    LYS  22           H        LYS  22  -1.842  -4.299  -1.484
  151    HA   LYS  22           HA       LYS  22  -2.808  -3.501  -3.978
  152   1HB   LYS  22          HB2       LYS  22  -0.522  -4.288  -3.772
  153   2HB   LYS  22          HB1       LYS  22  -1.056  -5.845  -3.184
  154   1HG   LYS  22          HG2       LYS  22  -1.941  -5.081  -5.910
  155   2HG   LYS  22          HG1       LYS  22  -0.229  -5.455  -5.700
  156   1HD   LYS  22          HD2       LYS  22  -0.702  -7.566  -4.848
  157   2HD   LYS  22          HD1       LYS  22  -2.429  -7.251  -4.701
  158   1HE   LYS  22          HE2       LYS  22  -1.942  -8.718  -6.635
  159   2HE   LYS  22          HE1       LYS  22  -2.623  -7.180  -7.155
  160   1HZ   LYS  22          HZ1       LYS  22  -0.583  -6.465  -7.940
  161   2HZ   LYS  22          HZ2       LYS  22  -0.581  -8.103  -8.401
  162   3HZ   LYS  22          HZ3       LYS  22   0.282  -7.584  -7.045
  163    H    TYR  23           H        TYR  23  -4.042  -5.725  -1.849
  164    HA   TYR  23           HA       TYR  23  -5.541  -7.091  -3.907
  165   1HB   TYR  23          HB2       TYR  23  -5.874  -8.721  -1.780
  166   2HB   TYR  23          HB1       TYR  23  -4.556  -8.886  -2.933
  167    HD1  TYR  23           HD1      TYR  23  -5.433  -8.168   0.528
  168    HD2  TYR  23           HD2      TYR  23  -2.282  -8.007  -2.325
  169    HE1  TYR  23           HE1      TYR  23  -3.787  -7.973   2.339
  170    HE2  TYR  23           HE2      TYR  23  -0.636  -7.805  -0.513
  171    HH   TYR  23           HH       TYR  23  -1.387  -8.431   2.709
  172    H    CYS  24           H        CYS  24  -5.982  -4.494  -2.072
  173    HA   CYS  24           HA       CYS  24  -8.739  -4.545  -2.397
  174   1HB   CYS  24          HB2       CYS  24  -9.599  -4.666  -0.142
  175   2HB   CYS  24          HB1       CYS  24  -8.567  -6.061  -0.456
  176    H    THR  25           H        THR  25  -9.342  -2.437  -2.648
  177    HA   THR  25           HA       THR  25  -7.431  -0.457  -1.792
  178    HB   THR  25           HB       THR  25  -9.936  -0.021  -3.509
  179    HG1  THR  25           HG1      THR  25  -7.211  -0.162  -4.254
  180   1HG2  THR  25          HG21      THR  25  -9.031   2.057  -2.451
  181   2HG2  THR  25          HG22      THR  25  -8.846   2.068  -4.203
  182   3HG2  THR  25          HG23      THR  25  -7.460   1.713  -3.178
  183    H    PHE  26           H        PHE  26  -9.102  -1.906   0.074
  184    HA   PHE  26           HA       PHE  26 -10.582   0.240   1.332
  185   1HB   PHE  26          HB2       PHE  26 -10.011  -2.586   2.319
  186   2HB   PHE  26          HB1       PHE  26 -11.069  -1.421   3.110
  187    HD1  PHE  26           HD1      PHE  26 -12.925  -0.423   1.438
  188    HD2  PHE  26           HD2      PHE  26 -11.039  -4.211   1.080
  189    HE1  PHE  26           HE1      PHE  26 -14.824  -1.235   0.106
  190    HE2  PHE  26           HE2      PHE  26 -12.932  -5.034  -0.260
  191    HZ   PHE  26           HZ       PHE  26 -14.827  -3.545  -0.748
  192    H    GLN  27           H        GLN  27  -9.247   1.682   1.935
  193    HA   GLN  27           HA       GLN  27  -6.623   0.908   2.924
  194   1HB   GLN  27          HB2       GLN  27  -6.266   2.064   0.980
  195   2HB   GLN  27          HB1       GLN  27  -7.652   3.108   1.227
  196   1HG   GLN  27          HG2       GLN  27  -6.436   4.331   2.944
  197   2HG   GLN  27          HG1       GLN  27  -5.097   3.194   2.732
  198   1HE2  GLN  27          HE21      GLN  27  -3.710   3.590   1.331
  199   2HE2  GLN  27          HE22      GLN  27  -3.681   4.861   0.146
  200    H    THR  28           H        THR  28  -5.763   1.825   4.657
  201    HA   THR  28           HA       THR  28  -7.244   3.787   6.125
  202    HB   THR  28           HB       THR  28  -8.164   1.777   7.069
  203    HG1  THR  28           HG1      THR  28  -7.734   3.199   8.672
  204   1HG2  THR  28          HG21      THR  28  -6.789  -0.054   7.968
  205   2HG2  THR  28          HG22      THR  28  -5.330   0.794   7.507
  206   3HG2  THR  28          HG23      THR  28  -6.410   0.189   6.262
  207    HA   PRO  29           HA       PRO  29  -2.927   4.935   6.788
  208   1HB   PRO  29          HB2       PRO  29  -3.433   7.106   8.351
  209   2HB   PRO  29          HB1       PRO  29  -3.577   7.105   6.583
  210   1HG   PRO  29          HG2       PRO  29  -5.731   6.813   8.644
  211   2HG   PRO  29          HG1       PRO  29  -5.724   7.792   7.167
  212   1HD   PRO  29          HD2       PRO  29  -6.965   5.387   7.284
  213   2HD   PRO  29          HD1       PRO  29  -6.159   5.947   5.800
  214    H    ASP  30           H        ASP  30  -5.097   3.604   8.928
  215    HA   ASP  30           HA       ASP  30  -3.285   3.773  11.196
  216   1HB   ASP  30          HB2       ASP  30  -5.998   2.449  10.920
  217   2HB   ASP  30          HB1       ASP  30  -5.040   2.466  12.390
  218    H    LEU  31           H        LEU  31  -1.638   2.391  11.104
  219    HA   LEU  31           HA       LEU  31  -1.355   0.192   9.492
  220   1HB   LEU  31          HB2       LEU  31   0.276   1.540  11.056
  221   2HB   LEU  31          HB1       LEU  31  -0.083   0.274  12.206
  222    HG   LEU  31           HG       LEU  31   2.003  -0.255  11.141
  223   1HD1  LEU  31          HD11      LEU  31   1.558  -2.403  10.062
  224   2HD1  LEU  31          HD12      LEU  31  -0.150  -1.933   9.946
  225   3HD1  LEU  31          HD13      LEU  31   0.584  -2.174  11.528
  226   1HD2  LEU  31          HD21      LEU  31   1.787   1.136   9.203
  227   2HD2  LEU  31          HD22      LEU  31   0.540   0.086   8.551
  228   3HD2  LEU  31          HD23      LEU  31   2.203  -0.509   8.700
  229    H    ASN  32           H        ASN  32  -2.604   0.460  12.813
  230    HA   ASN  32           HA       ASN  32  -2.886  -2.166  13.546
  231   1HB   ASN  32          HB2       ASN  32  -3.411  -0.185  15.035
  232   2HB   ASN  32          HB1       ASN  32  -4.823   0.059  13.998
  233   1HD2  ASN  32          HD21      ASN  32  -3.972  -3.175  14.776
  234   2HD2  ASN  32          HD22      ASN  32  -5.316  -3.373  15.832
  235    H    MET  33           H        MET  33  -5.107  -0.091  11.790
  236    HA   MET  33           HA       MET  33  -7.075  -2.148  11.558
  237   1HB   MET  33          HB2       MET  33  -6.899   0.479  10.085
  238   2HB   MET  33          HB1       MET  33  -8.302  -0.579  10.141
  239   1HG   MET  33          HG2       MET  33  -7.000   0.738  12.447
  240   2HG   MET  33          HG1       MET  33  -8.479   1.322  11.668
  241   1HE   MET  33          HE1       MET  33  -8.296   0.775  14.812
  242   2HE   MET  33          HE2       MET  33  -9.807  -0.079  15.116
  243   3HE   MET  33          HE3       MET  33  -9.782   1.308  14.026
  244    H    PHE  34           H        PHE  34  -4.506  -0.879   9.649
  245    HA   PHE  34           HA       PHE  34  -5.171  -2.063   7.196
  246   1HB   PHE  34          HB2       PHE  34  -3.509  -0.360   7.209
  247   2HB   PHE  34          HB1       PHE  34  -2.515  -1.226   8.361
  248    HD1  PHE  34           HD1      PHE  34  -0.788  -2.545   7.616
  249    HD2  PHE  34           HD2      PHE  34  -3.912  -1.534   4.894
  250    HE1  PHE  34           HE1      PHE  34   0.483  -3.582   5.768
  251    HE2  PHE  34           HE2      PHE  34  -2.651  -2.564   3.057
  252    HZ   PHE  34           HZ       PHE  34  -0.455  -3.592   3.488
  253    H    THR  35           H        THR  35  -2.957  -3.203   9.701
  254    HA   THR  35           HA       THR  35  -2.660  -5.687   8.332
  255    HB   THR  35           HB       THR  35  -0.764  -4.843   9.633
  256    HG1  THR  35           HG1      THR  35  -0.123  -6.739  10.299
  257   1HG2  THR  35          HG21      THR  35  -1.921  -3.727  11.401
  258   2HG2  THR  35          HG22      THR  35  -0.786  -4.888  12.102
  259   3HG2  THR  35          HG23      THR  35  -2.521  -5.257  12.048
  260    H    PHE  36           H        PHE  36  -4.802  -4.484  10.771
  261    HA   PHE  36           HA       PHE  36  -5.677  -6.985  11.715
  262   1HB   PHE  36          HB2       PHE  36  -6.138  -5.188  13.126
  263   2HB   PHE  36          HB1       PHE  36  -6.832  -4.209  11.851
  264    HD1  PHE  36           HD1      PHE  36  -9.118  -4.009  11.843
  265    HD2  PHE  36           HD2      PHE  36  -7.385  -7.487  13.538
  266    HE1  PHE  36           HE1      PHE  36 -11.359  -4.793  12.501
  267    HE2  PHE  36           HE2      PHE  36  -9.624  -8.275  14.213
  268    HZ   PHE  36           HZ       PHE  36 -11.606  -6.924  13.690
  269    H    HIS  37           H        HIS  37  -7.049  -4.766   9.254
  270    HA   HIS  37           HA       HIS  37  -9.136  -6.585   8.701
  271   1HB   HIS  37          HB2       HIS  37  -9.882  -5.113   6.992
  272   2HB   HIS  37          HB1       HIS  37  -9.015  -4.057   8.098
  273    HD1  HIS  37           HD1      HIS  37  -7.074  -2.731   7.121
  274    HD2  HIS  37           HD2      HIS  37  -8.549  -5.633   4.561
  275    HE1  HIS  37           HE1      HIS  37  -6.002  -2.271   4.866
  276    H    VAL  38           H        VAL  38  -5.887  -6.330   7.650
  277    HA   VAL  38           HA       VAL  38  -6.082  -8.130   5.474
  278    HB   VAL  38           HB       VAL  38  -3.748  -7.330   7.207
  279   1HG1  VAL  38          HG11      VAL  38  -3.704  -9.098   4.738
  280   2HG1  VAL  38          HG12      VAL  38  -3.332  -9.605   6.387
  281   3HG1  VAL  38          HG13      VAL  38  -2.270  -8.466   5.554
  282   1HG2  VAL  38          HG21      VAL  38  -4.548  -5.606   5.701
  283   2HG2  VAL  38          HG22      VAL  38  -4.418  -6.709   4.332
  284   3HG2  VAL  38          HG23      VAL  38  -2.964  -6.177   5.179
  285    H    ASP  39           H        ASP  39  -4.960  -8.590   8.824
  286    HA   ASP  39           HA       ASP  39  -4.608 -11.361   8.560
  287   1HB   ASP  39          HB2       ASP  39  -3.536  -9.996  10.304
  288   2HB   ASP  39          HB1       ASP  39  -5.103  -9.742  11.060
  289    H    SER  40           H        SER  40  -7.374  -9.486   9.111
  290    HA   SER  40           HA       SER  40  -8.937 -11.667  10.189
  291   1HB   SER  40          HB2       SER  40  -9.239  -9.289  10.948
  292   2HB   SER  40          HB1       SER  40  -9.877  -8.911   9.356
  293    HG   SER  40           HG       SER  40 -11.012 -10.239  11.470
  294    H    GLU  41           H        GLU  41  -8.723  -9.829   7.141
  295    HA   GLU  41           HA       GLU  41 -10.853 -11.549   6.076
  296   1HB   GLU  41          HB2       GLU  41  -9.771  -8.961   4.999
  297   2HB   GLU  41          HB1       GLU  41 -11.076  -9.895   4.285
  298   1HG   GLU  41          HG2       GLU  41 -12.397  -9.595   6.324
  299   2HG   GLU  41          HG1       GLU  41 -11.086  -8.637   7.012
  300    H    HIS  42           H        HIS  42  -7.570 -10.449   5.258
  301    HA   HIS  42           HA       HIS  42  -7.348 -12.679   3.438
  302   1HB   HIS  42          HB2       HIS  42  -5.859 -10.881   2.190
  303   2HB   HIS  42          HB1       HIS  42  -7.527 -11.184   1.698
  304    HD1  HIS  42           HD1      HIS  42  -9.170  -9.157   2.140
  305    HD2  HIS  42           HD2      HIS  42  -5.280  -8.444   3.398
  306    HE1  HIS  42           HE1      HIS  42  -9.048  -6.703   2.555
  307    HA   PRO  43           HA       PRO  43  -3.809 -12.140   6.409
  308   1HB   PRO  43          HB2       PRO  43  -3.839 -14.694   7.395
  309   2HB   PRO  43          HB1       PRO  43  -4.722 -13.355   8.128
  310   1HG   PRO  43          HG2       PRO  43  -5.695 -15.515   6.325
  311   2HG   PRO  43          HG1       PRO  43  -6.495 -14.770   7.724
  312   1HD   PRO  43          HD2       PRO  43  -7.106 -14.135   5.131
  313   2HD   PRO  43          HD1       PRO  43  -7.252 -13.001   6.488
  314    H    ASN  44           H        ASN  44  -4.645 -15.054   4.536
  315    HA   ASN  44           HA       ASN  44  -1.814 -15.413   3.889
  316   1HB   ASN  44          HB2       ASN  44  -4.084 -17.393   3.502
  317   2HB   ASN  44          HB1       ASN  44  -2.376 -17.696   3.232
  318   1HD2  ASN  44          HD21      ASN  44  -4.879 -17.378   5.575
  319   2HD2  ASN  44          HD22      ASN  44  -3.947 -17.878   6.942
  320    H    VAL  45           H        VAL  45  -1.578 -13.979   2.249
  321    HA   VAL  45           HA       VAL  45  -2.965 -14.714  -0.159
  322    HB   VAL  45           HB       VAL  45  -4.227 -12.792   0.724
  323   1HG1  VAL  45          HG11      VAL  45  -1.674 -11.244   0.635
  324   2HG1  VAL  45          HG12      VAL  45  -2.562 -11.742   2.075
  325   3HG1  VAL  45          HG13      VAL  45  -3.281 -10.584   0.952
  326   1HG2  VAL  45          HG21      VAL  45  -2.587 -12.076  -1.699
  327   2HG2  VAL  45          HG22      VAL  45  -4.095 -11.294  -1.222
  328   3HG2  VAL  45          HG23      VAL  45  -4.090 -12.996  -1.678
  329    H    VAL  46           H        VAL  46  -1.601 -15.133  -1.668
  330    HA   VAL  46           HA       VAL  46   1.118 -14.058  -1.472
  331    HB   VAL  46           HB       VAL  46   0.224 -16.763  -2.539
  332   1HG1  VAL  46          HG11      VAL  46   2.175 -15.877  -3.749
  333   2HG1  VAL  46          HG12      VAL  46   2.590 -17.285  -2.774
  334   3HG1  VAL  46          HG13      VAL  46   3.024 -15.675  -2.212
  335   1HG2  VAL  46          HG21      VAL  46   0.110 -16.689  -0.113
  336   2HG2  VAL  46          HG22      VAL  46   1.754 -16.059  -0.034
  337   3HG2  VAL  46          HG23      VAL  46   1.469 -17.697  -0.618
  338    H    LEU  47           H        LEU  47   1.359 -12.619  -2.992
  339    HA   LEU  47           HA       LEU  47  -0.092 -12.892  -5.511
  340   1HB   LEU  47          HB2       LEU  47   1.402 -10.532  -4.342
  341   2HB   LEU  47          HB1       LEU  47   0.570 -10.516  -5.877
  342    HG   LEU  47           HG       LEU  47  -0.838  -9.386  -4.426
  343   1HD1  LEU  47          HD11      LEU  47  -2.064 -10.899  -5.774
  344   2HD1  LEU  47          HD12      LEU  47  -2.842 -10.705  -4.206
  345   3HD1  LEU  47          HD13      LEU  47  -1.919 -12.165  -4.553
  346   1HD2  LEU  47          HD21      LEU  47  -0.486 -11.573  -2.382
  347   2HD2  LEU  47          HD22      LEU  47  -1.554 -10.177  -2.216
  348   3HD2  LEU  47          HD23      LEU  47   0.193  -9.947  -2.302
  349    H    ASN  48           H        ASN  48   1.640 -11.391  -7.144
  350    HA   ASN  48           HA       ASN  48   4.003 -13.124  -7.082
  351   1HB   ASN  48          HB2       ASN  48   2.464 -13.704  -8.941
  352   2HB   ASN  48          HB1       ASN  48   2.680 -12.085  -9.589
  353   1HD2  ASN  48          HD21      ASN  48   3.631 -12.749 -11.487
  354   2HD2  ASN  48          HD22      ASN  48   5.212 -13.438 -11.536
  355    H    SER  49           H        SER  49   3.266 -10.235  -9.102
  356    HA   SER  49           HA       SER  49   5.739  -9.101  -7.996
  357   1HB   SER  49          HB2       SER  49   4.612  -8.726 -10.780
  358   2HB   SER  49          HB1       SER  49   6.150  -8.108 -10.173
  359    HG   SER  49           HG       SER  49   6.152 -10.665  -9.661
  360    H    SER  50           H        SER  50   5.374  -7.290  -6.771
  361    HA   SER  50           HA       SER  50   3.566  -5.289  -7.618
  362   1HB   SER  50          HB2       SER  50   3.244  -6.813  -5.029
  363   2HB   SER  50          HB1       SER  50   2.386  -5.338  -5.462
  364    HG   SER  50           HG       SER  50   2.264  -7.167  -7.384
  365    H    TYR  51           H        TYR  51   3.741  -3.487  -5.826
  366    HA   TYR  51           HA       TYR  51   6.516  -3.352  -4.873
  367   1HB   TYR  51          HB2       TYR  51   4.721  -1.389  -6.178
  368   2HB   TYR  51          HB1       TYR  51   5.803  -0.809  -4.930
  369    HD1  TYR  51           HD1      TYR  51   7.421   0.408  -5.938
  370    HD2  TYR  51           HD2      TYR  51   6.343  -3.320  -7.681
  371    HE1  TYR  51           HE1      TYR  51   9.210   0.669  -7.586
  372    HE2  TYR  51           HE2      TYR  51   8.129  -3.060  -9.346
  373    HH   TYR  51           HH       TYR  51   9.408  -1.221 -10.364
  374    H    VAL  52           H        VAL  52   6.899  -2.760  -2.834
  375    HA   VAL  52           HA       VAL  52   4.637  -1.971  -1.131
  376    HB   VAL  52           HB       VAL  52   5.138  -4.388  -0.803
  377   1HG1  VAL  52          HG11      VAL  52   7.180  -5.106   0.171
  378   2HG1  VAL  52          HG12      VAL  52   7.801  -3.456   0.115
  379   3HG1  VAL  52          HG13      VAL  52   7.452  -4.329  -1.387
  380   1HG2  VAL  52          HG21      VAL  52   5.943  -2.719   1.561
  381   2HG2  VAL  52          HG22      VAL  52   5.474  -4.419   1.610
  382   3HG2  VAL  52          HG23      VAL  52   4.305  -3.198   1.114
  383    H    CYS  53           H        CYS  53   5.057  -0.409   0.307
  384    HA   CYS  53           HA       CYS  53   7.680   0.911   0.309
  385   1HB   CYS  53          HB2       CYS  53   5.731   2.324   0.437
  386   2HB   CYS  53          HB1       CYS  53   5.080   1.408   1.784
  387    H    VAL  54           H        VAL  54   9.155  -0.376   1.300
  388    HA   VAL  54           HA       VAL  54   8.726  -2.275   3.251
  389    HB   VAL  54           HB       VAL  54  11.218  -0.899   3.717
  390   1HG1  VAL  54          HG11      VAL  54  10.775  -3.233   4.214
  391   2HG1  VAL  54          HG12      VAL  54  12.158  -2.988   3.108
  392   3HG1  VAL  54          HG13      VAL  54  10.589  -3.470   2.460
  393   1HG2  VAL  54          HG21      VAL  54  10.482  -1.471   0.884
  394   2HG2  VAL  54          HG22      VAL  54  12.146  -1.484   1.444
  395   3HG2  VAL  54          HG23      VAL  54  11.174  -0.016   1.577
  396    H    GLU  55           H        GLU  55   9.182   1.113   3.496
  397    HA   GLU  55           HA       GLU  55   9.835   1.414   6.172
  398   1HB   GLU  55          HB2       GLU  55   8.167   3.347   4.565
  399   2HB   GLU  55          HB1       GLU  55   9.218   3.715   5.921
  400   1HG   GLU  55          HG2       GLU  55  10.186   2.679   3.263
  401   2HG   GLU  55          HG1       GLU  55  10.116   4.376   3.705
  402    H    CYS  56           H        CYS  56   6.806   1.218   4.502
  403    HA   CYS  56           HA       CYS  56   5.324   1.426   7.082
  404   1HB   CYS  56          HB2       CYS  56   4.142   1.456   4.320
  405   2HB   CYS  56          HB1       CYS  56   3.404   2.027   5.814
  406    H    ASN  57           H        ASN  57   6.423  -0.790   4.863
  407    HA   ASN  57           HA       ASN  57   5.831  -2.690   3.954
  408   1HB   ASN  57          HB2       ASN  57   5.405  -3.069   6.826
  409   2HB   ASN  57          HB1       ASN  57   4.839  -4.386   5.769
  410   1HD2  ASN  57          HD21      ASN  57   6.978  -4.008   3.788
  411   2HD2  ASN  57          HD22      ASN  57   8.376  -4.599   4.572
  412    H    PHE  58           H        PHE  58   4.290  -1.298   2.847
  413    HA   PHE  58           HA       PHE  58   1.685  -2.588   3.045
  414   1HB   PHE  58          HB2       PHE  58   0.474  -0.665   3.123
  415   2HB   PHE  58          HB1       PHE  58   1.948   0.034   3.765
  416    HD1  PHE  58           HD1      PHE  58   3.226   1.627   2.377
  417    HD2  PHE  58           HD2      PHE  58  -0.296  -0.201   0.947
  418    HE1  PHE  58           HE1      PHE  58   3.081   3.343   0.571
  419    HE2  PHE  58           HE2      PHE  58  -0.483   1.542  -0.833
  420    HZ   PHE  58           HZ       PHE  58   1.206   3.290  -1.022
  421    H    LEU  59           H        LEU  59   1.080  -3.479   1.294
  422    HA   LEU  59           HA       LEU  59   2.725  -3.187  -1.072
  423   1HB   LEU  59          HB2       LEU  59   1.123  -5.351   0.112
  424   2HB   LEU  59          HB1       LEU  59   0.965  -5.206  -1.622
  425    HG   LEU  59           HG       LEU  59   3.621  -5.550  -0.238
  426   1HD1  LEU  59          HD11      LEU  59   3.403  -7.879  -0.949
  427   2HD1  LEU  59          HD12      LEU  59   1.811  -7.493  -1.636
  428   3HD1  LEU  59          HD13      LEU  59   2.048  -7.441   0.109
  429   1HD2  LEU  59          HD21      LEU  59   3.721  -4.537  -2.467
  430   2HD2  LEU  59          HD22      LEU  59   2.694  -5.821  -3.092
  431   3HD2  LEU  59          HD23      LEU  59   4.307  -6.199  -2.512
  432    H    THR  60           H        THR  60   1.808  -2.233  -2.805
  433    HA   THR  60           HA       THR  60  -1.059  -1.706  -2.633
  434    HB   THR  60           HB       THR  60   0.130   0.177  -1.871
  435    HG1  THR  60           HG1      THR  60  -1.724   0.514  -3.164
  436   1HG2  THR  60          HG21      THR  60   1.693   1.476  -3.325
  437   2HG2  THR  60          HG22      THR  60   1.640   0.140  -4.487
  438   3HG2  THR  60          HG23      THR  60   2.257  -0.122  -2.862
  439    H    LYS  61           H        LYS  61  -1.982  -1.000  -4.699
  440    HA   LYS  61           HA       LYS  61  -1.448  -2.979  -6.648
  441   1HB   LYS  61          HB2       LYS  61  -3.282  -0.597  -6.791
  442   2HB   LYS  61          HB1       LYS  61  -3.281  -1.965  -7.899
  443   1HG   LYS  61          HG2       LYS  61  -3.801  -3.461  -6.028
  444   2HG   LYS  61          HG1       LYS  61  -3.829  -2.061  -4.956
  445   1HD   LYS  61          HD2       LYS  61  -5.698  -1.136  -6.162
  446   2HD   LYS  61          HD1       LYS  61  -5.649  -2.480  -7.311
  447   1HE   LYS  61          HE2       LYS  61  -6.057  -4.053  -5.456
  448   2HE   LYS  61          HE1       LYS  61  -6.140  -2.694  -4.350
  449   1HZ   LYS  61          HZ1       LYS  61  -7.925  -2.847  -6.682
  450   2HZ   LYS  61          HZ2       LYS  61  -8.119  -1.957  -5.258
  451   3HZ   LYS  61          HZ3       LYS  61  -8.300  -3.638  -5.253
  452    H    ARG  62           H        ARG  62  -1.183   0.558  -6.883
  453    HA   ARG  62           HA       ARG  62   0.305   0.039  -9.337
  454   1HB   ARG  62          HB2       ARG  62  -0.297   2.132 -10.232
  455   2HB   ARG  62          HB1       ARG  62  -1.746   1.561  -9.436
  456   1HG   ARG  62          HG2       ARG  62   0.173   3.584  -8.320
  457   2HG   ARG  62          HG1       ARG  62  -1.338   3.992  -9.123
  458   1HD   ARG  62          HD2       ARG  62  -0.976   2.465  -6.555
  459   2HD   ARG  62          HD1       ARG  62  -1.509   4.131  -6.701
  460    HE   ARG  62           HE       ARG  62  -3.416   3.003  -8.060
  461   1HH1  ARG  62          HH11      ARG  62  -1.864   1.797  -5.082
  462   2HH1  ARG  62          HH12      ARG  62  -3.270   1.036  -4.566
  463   1HH2  ARG  62          HH21      ARG  62  -5.359   1.921  -7.191
  464   2HH2  ARG  62          HH22      ARG  62  -5.214   1.135  -5.653
  465    H    TYR  63           H        TYR  63   2.310   0.867  -9.727
  466    HA   TYR  63           HA       TYR  63   4.076   1.077  -7.597
  467   1HB   TYR  63          HB2       TYR  63   5.792   1.651  -9.214
  468   2HB   TYR  63          HB1       TYR  63   4.724   0.448  -9.925
  469    HD1  TYR  63           HD1      TYR  63   6.101   3.779 -10.226
  470    HD2  TYR  63           HD2      TYR  63   3.020   1.209 -11.639
  471    HE1  TYR  63           HE1      TYR  63   5.751   5.257 -12.158
  472    HE2  TYR  63           HE2      TYR  63   2.671   2.670 -13.559
  473    HH   TYR  63           HH       TYR  63   3.054   5.061 -14.110
  474    H    ASP  64           H        ASP  64   2.221   3.464  -9.223
  475    HA   ASP  64           HA       ASP  64   3.557   5.830  -8.709
  476   1HB   ASP  64          HB2       ASP  64   0.555   5.491  -8.648
  477   2HB   ASP  64          HB1       ASP  64   1.452   6.955  -8.993
  478    H    ALA  65           H        ALA  65   1.525   3.916  -6.510
  479    HA   ALA  65           HA       ALA  65   1.134   5.994  -4.621
  480   1HB   ALA  65          HB1       ALA  65   0.455   4.163  -3.083
  481   2HB   ALA  65          HB2       ALA  65   0.948   2.989  -4.316
  482   3HB   ALA  65          HB3       ALA  65  -0.361   4.121  -4.631
  483    H    LEU  66           H        LEU  66   3.748   3.866  -5.222
  484    HA   LEU  66           HA       LEU  66   5.075   4.326  -2.700
  485   1HB   LEU  66          HB2       LEU  66   6.162   3.243  -5.263
  486   2HB   LEU  66          HB1       LEU  66   6.999   3.201  -3.727
  487    HG   LEU  66           HG       LEU  66   6.242   1.048  -3.992
  488   1HD1  LEU  66          HD11      LEU  66   4.078   2.375  -2.413
  489   2HD1  LEU  66          HD12      LEU  66   5.658   1.882  -1.794
  490   3HD1  LEU  66          HD13      LEU  66   4.496   0.664  -2.336
  491   1HD2  LEU  66          HD21      LEU  66   3.972   0.434  -4.725
  492   2HD2  LEU  66          HD22      LEU  66   4.896   1.383  -5.900
  493   3HD2  LEU  66          HD23      LEU  66   3.634   2.159  -4.953
  494    H    SER  67           H        SER  67   5.025   5.643  -5.859
  495    HA   SER  67           HA       SER  67   7.461   7.214  -5.723
  496   1HB   SER  67          HB2       SER  67   5.104   6.942  -7.444
  497   2HB   SER  67          HB1       SER  67   6.144   8.348  -7.710
  498    HG   SER  67           HG       SER  67   7.103   5.638  -7.606
  499    H    GLU  68           H        GLU  68   4.024   7.861  -5.473
  500    HA   GLU  68           HA       GLU  68   4.443  10.586  -4.766
  501   1HB   GLU  68          HB2       GLU  68   1.919   9.303  -3.942
  502   2HB   GLU  68          HB1       GLU  68   2.238  10.841  -4.713
  503   1HG   GLU  68          HG2       GLU  68   2.849   9.506  -6.798
  504   2HG   GLU  68          HG1       GLU  68   2.174   8.181  -5.956
  505    H    HIS  69           H        HIS  69   4.509   7.683  -3.155
  506    HA   HIS  69           HA       HIS  69   3.565   8.101  -0.620
  507   1HB   HIS  69          HB2       HIS  69   4.704   6.071  -1.651
  508   2HB   HIS  69          HB1       HIS  69   6.190   6.779  -0.979
  509    HD1  HIS  69           HD1      HIS  69   2.738   5.776   0.228
  510    HD2  HIS  69           HD2      HIS  69   6.672   5.966   1.441
  511    HE1  HIS  69           HE1      HIS  69   2.771   4.815   2.554
  512    H    ASN  70           H        ASN  70   7.002   8.751  -1.518
  513    HA   ASN  70           HA       ASN  70   7.479  10.250   0.893
  514   1HB   ASN  70          HB2       ASN  70   9.645  10.817  -0.187
  515   2HB   ASN  70          HB1       ASN  70   9.349   9.096  -0.063
  516   1HD2  ASN  70          HD21      ASN  70  11.145  10.180  -1.671
  517   2HD2  ASN  70          HD22      ASN  70  10.679   9.896  -3.345
  518    H    LEU  71           H        LEU  71   5.949  11.032  -1.903
  519    HA   LEU  71           HA       LEU  71   6.538  13.848  -1.824
  520   1HB   LEU  71          HB2       LEU  71   5.976  13.156  -3.970
  521   2HB   LEU  71          HB1       LEU  71   4.776  12.029  -3.387
  522    HG   LEU  71           HG       LEU  71   3.228  13.806  -3.011
  523   1HD1  LEU  71          HD11      LEU  71   5.361  15.611  -4.245
  524   2HD1  LEU  71          HD12      LEU  71   4.809  15.679  -2.572
  525   3HD1  LEU  71          HD13      LEU  71   3.708  16.112  -3.882
  526   1HD2  LEU  71          HD21      LEU  71   3.197  12.692  -5.134
  527   2HD2  LEU  71          HD22      LEU  71   4.407  13.802  -5.780
  528   3HD2  LEU  71          HD23      LEU  71   2.798  14.393  -5.366
  529    H    LYS  72           H        LYS  72   3.807  11.794  -0.930
  530    HA   LYS  72           HA       LYS  72   2.694  14.073   0.524
  531   1HB   LYS  72          HB2       LYS  72   0.627  12.308   0.375
  532   2HB   LYS  72          HB1       LYS  72   0.827  13.708  -0.700
  533   1HG   LYS  72          HG2       LYS  72   2.137  12.043  -2.148
  534   2HG   LYS  72          HG1       LYS  72   1.481  10.796  -1.131
  535   1HD   LYS  72          HD2       LYS  72  -0.110  12.747  -2.778
  536   2HD   LYS  72          HD1       LYS  72   0.132  11.026  -3.098
  537   1HE   LYS  72          HE2       LYS  72  -1.095  10.506  -0.980
  538   2HE   LYS  72          HE1       LYS  72  -1.363  12.219  -0.752
  539   1HZ   LYS  72          HZ1       LYS  72  -2.350  10.641  -3.055
  540   2HZ   LYS  72          HZ2       LYS  72  -2.654  12.274  -2.768
  541   3HZ   LYS  72          HZ3       LYS  72  -3.245  11.106  -1.707
  542    H    TYR  73           H        TYR  73   3.454  10.787   0.874
  543    HA   TYR  73           HA       TYR  73   2.313  10.544   3.550
  544   1HB   TYR  73          HB2       TYR  73   3.884   8.644   1.852
  545   2HB   TYR  73          HB1       TYR  73   3.240   8.204   3.439
  546    HD1  TYR  73           HD1      TYR  73   1.317   6.932   3.340
  547    HD2  TYR  73           HD2      TYR  73   2.034   9.723   0.229
  548    HE1  TYR  73           HE1      TYR  73  -0.721   6.215   2.212
  549    HE2  TYR  73           HE2      TYR  73   0.031   9.005  -0.903
  550    HH   TYR  73           HH       TYR  73  -2.311   7.279   0.624
  551    H    HIS  74           H        HIS  74   5.566  10.123   2.087
  552    HA   HIS  74           HA       HIS  74   6.726  10.921   4.730
  553   1HB   HIS  74          HB2       HIS  74   7.987   9.259   2.518
  554   2HB   HIS  74          HB1       HIS  74   8.849   9.789   3.940
  555    HD1  HIS  74           HD1      HIS  74   8.989   7.987   5.744
  556    HD2  HIS  74           HD2      HIS  74   5.849   7.434   3.087
  557    HE1  HIS  74           HE1      HIS  74   8.103   5.691   6.214
  558    HA   PRO  75           HA       PRO  75   7.699  14.186   1.548
  559   1HB   PRO  75          HB2       PRO  75   6.855  16.329   2.882
  560   2HB   PRO  75          HB1       PRO  75   5.725  15.287   2.002
  561   1HG   PRO  75          HG2       PRO  75   6.384  15.264   4.941
  562   2HG   PRO  75          HG1       PRO  75   4.782  15.198   4.169
  563   1HD   PRO  75          HD2       PRO  75   6.066  12.991   5.077
  564   2HD   PRO  75          HD1       PRO  75   5.006  13.001   3.656
  565    H    GLY  76           H        GLY  76   9.390  15.480   1.368
  566   1HA   GLY  76          HA2       GLY  76  10.775  17.055   2.993
  567   2HA   GLY  76          HA1       GLY  76  11.337  15.474   3.524
  568    H    GLU  77           H        GLU  77  11.416  14.106   1.174
  569    HA   GLU  77           HA       GLU  77  13.010  15.543  -0.735
  570   1HB   GLU  77          HB2       GLU  77  14.964  14.038  -0.468
  571   2HB   GLU  77          HB1       GLU  77  14.709  15.050   0.943
  572   1HG   GLU  77          HG2       GLU  77  14.987  13.123   2.097
  573   2HG   GLU  77          HG1       GLU  77  13.312  12.836   1.603
  574    H    GLU  78           H        GLU  78  13.760  13.803  -2.411
  575    HA   GLU  78           HA       GLU  78  11.718  11.715  -2.479
  576   1HB   GLU  78          HB2       GLU  78  11.082  13.649  -3.941
  577   2HB   GLU  78          HB1       GLU  78  12.598  13.338  -4.805
  578   1HG   GLU  78          HG2       GLU  78  11.832  11.169  -5.472
  579   2HG   GLU  78          HG1       GLU  78  10.350  11.350  -4.536
  580    H    ASN  79           H        ASN  79  13.292  10.244  -1.839
  581    HA   ASN  79           HA       ASN  79  14.993   9.325  -4.021
  582   1HB   ASN  79          HB2       ASN  79  15.875   9.916  -1.215
  583   2HB   ASN  79          HB1       ASN  79  16.880   9.002  -2.357
  584   1HD2  ASN  79          HD21      ASN  79  15.610  11.985  -1.437
  585   2HD2  ASN  79          HD22      ASN  79  16.388  13.072  -2.533
  586    H    PHE  80           H        PHE  80  13.687   7.592  -4.219
  587    HA   PHE  80           HA       PHE  80  13.483   5.790  -1.923
  588   1HB   PHE  80          HB2       PHE  80  11.668   6.438  -4.113
  589   2HB   PHE  80          HB1       PHE  80  11.928   4.715  -3.934
  590    HD1  PHE  80           HD1      PHE  80  10.062   7.486  -2.836
  591    HD2  PHE  80           HD2      PHE  80  11.650   3.788  -1.516
  592    HE1  PHE  80           HE1      PHE  80   8.347   7.381  -1.050
  593    HE2  PHE  80           HE2      PHE  80   9.927   3.662   0.224
  594    HZ   PHE  80           HZ       PHE  80   8.281   5.453   0.455
  595    H    LYS  81           H        LYS  81  14.204   3.736  -2.101
  596    HA   LYS  81           HA       LYS  81  15.917   3.136  -4.427
  597   1HB   LYS  81          HB2       LYS  81  17.505   2.300  -2.959
  598   2HB   LYS  81          HB1       LYS  81  16.659   3.393  -1.859
  599   1HG   LYS  81          HG2       LYS  81  15.367   1.635  -0.944
  600   2HG   LYS  81          HG1       LYS  81  15.969   0.495  -2.138
  601   1HD   LYS  81          HD2       LYS  81  18.300   1.109  -1.203
  602   2HD   LYS  81          HD1       LYS  81  17.356   1.698   0.181
  603   1HE   LYS  81          HE2       LYS  81  16.335  -0.478   0.466
  604   2HE   LYS  81          HE1       LYS  81  17.163  -1.062  -0.978
  605   1HZ   LYS  81          HZ1       LYS  81  18.527  -0.165   1.508
  606   2HZ   LYS  81          HZ2       LYS  81  19.274  -0.829   0.144
  607   3HZ   LYS  81          HZ3       LYS  81  18.265  -1.773   1.093
  608    H    LEU  82           H        LEU  82  16.044   0.633  -4.774
  609    HA   LEU  82           HA       LEU  82  13.458  -0.523  -4.114
  610   1HB   LEU  82          HB2       LEU  82  13.393  -1.702  -6.263
  611   2HB   LEU  82          HB1       LEU  82  13.350   0.029  -6.474
  612    HG   LEU  82           HG       LEU  82  15.927  -1.480  -6.773
  613   1HD1  LEU  82          HD11      LEU  82  13.809  -0.994  -8.883
  614   2HD1  LEU  82          HD12      LEU  82  14.293  -2.569  -8.254
  615   3HD1  LEU  82          HD13      LEU  82  15.429  -1.608  -9.199
  616   1HD2  LEU  82          HD21      LEU  82  16.481   0.376  -8.254
  617   2HD2  LEU  82          HD22      LEU  82  16.005   0.968  -6.659
  618   3HD2  LEU  82          HD23      LEU  82  14.875   1.062  -8.010
  619    H    THR  83           H        THR  83  13.491  -2.487  -3.321
  620    HA   THR  83           HA       THR  83  15.812  -4.146  -3.664
  621    HB   THR  83           HB       THR  83  16.410  -2.960  -1.643
  622    HG1  THR  83           HG1      THR  83  15.642  -5.014  -0.142
  623   1HG2  THR  83          HG21      THR  83  13.727  -3.705  -0.479
  624   2HG2  THR  83          HG22      THR  83  14.189  -2.095  -1.022
  625   3HG2  THR  83          HG23      THR  83  15.007  -2.828   0.363
  626    H    MET  84           H        MET  84  14.841  -6.056  -4.428
  627    HA   MET  84           HA       MET  84  12.058  -6.496  -3.537
  628   1HB   MET  84          HB2       MET  84  12.544  -6.703  -5.932
  629   2HB   MET  84          HB1       MET  84  13.810  -7.857  -5.574
  630   1HG   MET  84          HG2       MET  84  12.101  -9.443  -4.772
  631   2HG   MET  84          HG1       MET  84  10.847  -8.287  -5.236
  632   1HE   MET  84          HE1       MET  84  10.981 -11.329  -6.380
  633   2HE   MET  84          HE2       MET  84  10.578 -11.029  -8.070
  634   3HE   MET  84          HE3       MET  84   9.715 -10.173  -6.793
  635    H    VAL  85           H        VAL  85  12.163  -7.276  -1.567
  636    HA   VAL  85           HA       VAL  85  13.138  -9.943  -1.244
  637    HB   VAL  85           HB       VAL  85  14.033  -9.179   1.123
  638   1HG1  VAL  85          HG11      VAL  85  16.309  -8.854   0.193
  639   2HG1  VAL  85          HG12      VAL  85  15.595  -8.633  -1.410
  640   3HG1  VAL  85          HG13      VAL  85  15.462 -10.187  -0.595
  641   1HG2  VAL  85          HG21      VAL  85  14.392  -6.661  -0.495
  642   2HG2  VAL  85          HG22      VAL  85  15.043  -6.937   1.126
  643   3HG2  VAL  85          HG23      VAL  85  13.291  -6.838   0.866
  644    H    LYS  86           H        LYS  86  11.180 -10.867  -0.618
  645    HA   LYS  86           HA       LYS  86   9.951  -9.524   1.621
  646   1HB   LYS  86          HB2       LYS  86   8.797  -8.853  -0.569
  647   2HB   LYS  86          HB1       LYS  86   8.237 -10.511  -0.636
  648   1HG   LYS  86          HG2       LYS  86   6.498  -9.276   0.172
  649   2HG   LYS  86          HG1       LYS  86   7.125 -10.142   1.577
  650   1HD   LYS  86          HD2       LYS  86   8.192  -8.182   2.441
  651   2HD   LYS  86          HD1       LYS  86   8.041  -7.331   0.911
  652   1HE   LYS  86          HE2       LYS  86   6.378  -6.298   2.244
  653   2HE   LYS  86          HE1       LYS  86   5.520  -7.487   1.303
  654   1HZ   LYS  86          HZ1       LYS  86   5.468  -8.991   3.210
  655   2HZ   LYS  86          HZ2       LYS  86   4.871  -7.493   3.665
  656   3HZ   LYS  86          HZ3       LYS  86   6.420  -7.929   4.087
  657    H    ARG  87           H        ARG  87   9.519 -10.925   3.112
  658    HA   ARG  87           HA       ARG  87   9.699 -13.716   2.298
  659   1HB   ARG  87          HB2       ARG  87  10.653 -12.441   4.886
  660   2HB   ARG  87          HB1       ARG  87  10.728 -14.148   4.507
  661   1HG   ARG  87          HG2       ARG  87  12.958 -13.366   4.142
  662   2HG   ARG  87          HG1       ARG  87  12.207 -13.510   2.549
  663   1HD   ARG  87          HD2       ARG  87  13.597 -11.460   2.860
  664   2HD   ARG  87          HD1       ARG  87  11.943 -11.219   2.301
  665    HE   ARG  87           HE       ARG  87  11.726 -10.862   4.967
  666   1HH1  ARG  87          HH11      ARG  87  14.170  -9.468   2.801
  667   2HH1  ARG  87          HH12      ARG  87  14.014  -7.909   3.461
  668   1HH2  ARG  87          HH21      ARG  87  11.625  -8.711   5.884
  669   2HH2  ARG  87          HH22      ARG  87  12.623  -7.489   5.241
  670    H    ASN  88           H        ASN  88   8.405 -15.179   3.598
  671    HA   ASN  88           HA       ASN  88   6.552 -15.887   4.675
  672   1HB   ASN  88          HB2       ASN  88   6.483 -13.133   5.943
  673   2HB   ASN  88          HB1       ASN  88   5.498 -14.498   6.439
  674   1HD2  ASN  88          HD21      ASN  88   6.461 -16.180   7.565
  675   2HD2  ASN  88          HD22      ASN  88   8.030 -16.028   8.266
  676    H    ASN  89           H        ASN  89   6.484 -14.186   2.151
  677    HA   ASN  89           HA       ASN  89   3.582 -13.908   2.045
  678   1HB   ASN  89          HB2       ASN  89   5.473 -11.638   1.352
  679   2HB   ASN  89          HB1       ASN  89   3.786 -11.683   0.879
  680   1HD2  ASN  89          HD21      ASN  89   6.062 -11.130   3.458
  681   2HD2  ASN  89          HD22      ASN  89   4.896 -10.573   4.592
  682    H    GLN  90           H        GLN  90   5.974 -12.536  -0.126
  683    HA   GLN  90           HA       GLN  90   6.288 -14.626  -1.927
  684   1HB   GLN  90          HB2       GLN  90   5.162 -13.650  -3.821
  685   2HB   GLN  90          HB1       GLN  90   3.946 -13.877  -2.536
  686   1HG   GLN  90          HG2       GLN  90   5.276 -11.307  -3.134
  687   2HG   GLN  90          HG1       GLN  90   3.824 -11.820  -4.003
  688   1HE2  GLN  90          HE21      GLN  90   5.147 -10.469  -1.218
  689   2HE2  GLN  90          HE22      GLN  90   3.630 -10.231  -0.386
  690    H    THR  91           H        THR  91   7.587 -13.542  -3.793
  691    HA   THR  91           HA       THR  91   8.941 -11.373  -2.495
  692    HB   THR  91           HB       THR  91  10.682 -11.760  -4.379
  693    HG1  THR  91           HG1      THR  91   9.468 -14.320  -4.294
  694   1HG2  THR  91          HG21      THR  91  11.114 -12.189  -1.999
  695   2HG2  THR  91          HG22      THR  91  11.805 -13.473  -2.978
  696   3HG2  THR  91          HG23      THR  91  10.296 -13.735  -2.117
  697    H    ILE  92           H        ILE  92   8.541  -9.551  -2.875
  698    HA   ILE  92           HA       ILE  92   7.671  -8.563  -5.402
  699    HB   ILE  92           HB       ILE  92   6.090  -7.008  -4.071
  700   1HG1  ILE  92          HG12      ILE  92   5.067  -8.399  -2.075
  701   2HG1  ILE  92          HG11      ILE  92   6.653  -9.111  -2.091
  702   1HG2  ILE  92          HG21      ILE  92   5.211  -8.556  -5.623
  703   2HG2  ILE  92          HG22      ILE  92   4.219  -8.566  -4.169
  704   3HG2  ILE  92          HG23      ILE  92   5.358  -9.881  -4.475
  705   1HD1  ILE  92          HD11      ILE  92   6.293  -6.149  -1.926
  706   2HD1  ILE  92          HD12      ILE  92   7.770  -7.084  -1.733
  707   3HD1  ILE  92          HD13      ILE  92   6.483  -7.215  -0.542
  708    H    PHE  93           H        PHE  93   7.887  -6.099  -5.437
  709    HA   PHE  93           HA       PHE  93  10.680  -5.723  -4.687
  710   1HB   PHE  93          HB2       PHE  93   8.729  -4.169  -6.364
  711   2HB   PHE  93          HB1       PHE  93  10.382  -3.669  -6.148
  712    HD1  PHE  93           HD1      PHE  93  12.157  -4.934  -7.203
  713    HD2  PHE  93           HD2      PHE  93   8.079  -5.944  -7.798
  714    HE1  PHE  93           HE1      PHE  93  12.782  -6.252  -9.208
  715    HE2  PHE  93           HE2      PHE  93   8.677  -7.269  -9.784
  716    HZ   PHE  93           HZ       PHE  93  11.035  -7.422 -10.493
  717    H    GLU  94           H        GLU  94  11.120  -4.646  -2.824
  718    HA   GLU  94           HA       GLU  94   9.073  -3.019  -1.642
  719   1HB   GLU  94          HB2       GLU  94  11.754  -3.803  -0.479
  720   2HB   GLU  94          HB1       GLU  94  10.344  -3.187   0.356
  721   1HG   GLU  94          HG2       GLU  94   9.223  -5.334  -0.468
  722   2HG   GLU  94          HG1       GLU  94  10.879  -5.927  -0.621
  723    H    GLN  95           H        GLN  95   9.476  -0.934  -1.187
  724    HA   GLN  95           HA       GLN  95  11.849   0.243  -2.492
  725   1HB   GLN  95          HB2       GLN  95   9.488   0.452  -3.600
  726   2HB   GLN  95          HB1       GLN  95   9.188   1.631  -2.333
  727   1HG   GLN  95          HG2       GLN  95  11.005   2.988  -3.089
  728   2HG   GLN  95          HG1       GLN  95  11.489   1.748  -4.241
  729   1HE2  GLN  95          HE21      GLN  95   9.212   4.247  -3.482
  730   2HE2  GLN  95          HE22      GLN  95   8.556   4.380  -5.070
  731    H    THR  96           H        THR  96  13.165   1.123  -0.937
  732    HA   THR  96           HA       THR  96  11.936   2.163   1.540
  733    HB   THR  96           HB       THR  96  14.769   1.863   1.763
  734    HG1  THR  96           HG1      THR  96  13.722  -0.687   1.439
  735   1HG2  THR  96          HG21      THR  96  14.121   0.295   3.606
  736   2HG2  THR  96          HG22      THR  96  12.442   0.419   3.061
  737   3HG2  THR  96          HG23      THR  96  13.263   1.831   3.663
  738    H    ILE  97           H        ILE  97  13.074   3.997   2.497
  739    HA   ILE  97           HA       ILE  97  14.147   5.835   0.449
  740    HB   ILE  97           HB       ILE  97  13.118   6.635   3.195
  741   1HG1  ILE  97          HG12      ILE  97  11.422   6.706   0.752
  742   2HG1  ILE  97          HG11      ILE  97  11.481   5.210   1.657
  743   1HG2  ILE  97          HG21      ILE  97  13.143   8.027   0.507
  744   2HG2  ILE  97          HG22      ILE  97  14.433   8.170   1.688
  745   3HG2  ILE  97          HG23      ILE  97  12.822   8.751   2.093
  746   1HD1  ILE  97          HD11      ILE  97  10.351   7.882   2.421
  747   2HD1  ILE  97          HD12      ILE  97  10.785   6.681   3.645
  748   3HD1  ILE  97          HD13      ILE  97   9.585   6.288   2.428
  749    H    ASN  98           H        ASN  98  15.902   7.108   1.108
  750    HA   ASN  98           HA       ASN  98  17.657   5.705   2.972
  751   1HB   ASN  98          HB2       ASN  98  19.399   7.242   1.889
  752   2HB   ASN  98          HB1       ASN  98  18.721   5.968   0.872
  753   1HD2  ASN  98          HD21      ASN  98  17.182   9.091   1.720
  754   2HD2  ASN  98          HD22      ASN  98  17.141   9.677   0.131
  755    H    ASP  99           H        ASP  99  15.439   7.900   3.407
  756    HA   ASP  99           HA       ASP  99  17.012   9.449   5.342
  757   1HB   ASP  99          HB2       ASP  99  17.067  10.521   3.032
  758   2HB   ASP  99          HB1       ASP  99  15.397  10.922   3.322
  759    H    LEU 100           H        LEU 100  13.871   9.346   3.693
  760    HA   LEU 100           HA       LEU 100  12.419  10.504   5.882
  761   1HB   LEU 100          HB2       LEU 100  11.289   9.118   3.432
  762   2HB   LEU 100          HB1       LEU 100  10.577  10.289   4.513
  763    HG   LEU 100           HG       LEU 100  12.988  11.217   3.091
  764   1HD1  LEU 100          HD11      LEU 100  11.907  10.104   1.224
  765   2HD1  LEU 100          HD12      LEU 100  11.552  11.805   1.121
  766   3HD1  LEU 100          HD13      LEU 100  10.337  10.692   1.756
  767   1HD2  LEU 100          HD21      LEU 100  11.746  13.237   3.024
  768   2HD2  LEU 100          HD22      LEU 100  11.605  12.574   4.669
  769   3HD2  LEU 100          HD23      LEU 100  10.282  12.403   3.493
  770    H    THR 101           H        THR 101  13.788   7.708   5.753
  771    HA   THR 101           HA       THR 101  12.054   5.624   6.187
  772    HB   THR 101           HB       THR 101  14.792   6.119   7.325
  773    HG1  THR 101           HG1      THR 101  14.081   5.118   4.804
  774   1HG2  THR 101          HG21      THR 101  13.690   3.957   7.955
  775   2HG2  THR 101          HG22      THR 101  15.117   3.743   6.928
  776   3HG2  THR 101          HG23      THR 101  13.519   3.603   6.228
  777    H    PHE 102           H        PHE 102  13.226   8.201   8.237
  778    HA   PHE 102           HA       PHE 102  11.963   6.992  10.605
  779   1HB   PHE 102          HB2       PHE 102  14.523   8.607  10.544
  780   2HB   PHE 102          HB1       PHE 102  13.731   8.018  11.996
  781    HD1  PHE 102           HD1      PHE 102  13.540   5.498  12.311
  782    HD2  PHE 102           HD2      PHE 102  16.050   7.285   9.381
  783    HE1  PHE 102           HE1      PHE 102  14.833   3.413  12.152
  784    HE2  PHE 102           HE2      PHE 102  17.347   5.198   9.219
  785    HZ   PHE 102           HZ       PHE 102  16.738   3.265  10.602
  Start of MODEL   15
    1    HA   MET   1           HA       MET   1  -5.267  -6.442 -23.378
    2   1HB   MET   1          HB2       MET   1  -7.438  -5.208 -23.404
    3   2HB   MET   1          HB1       MET   1  -7.540  -6.787 -22.660
    4   1HG   MET   1          HG2       MET   1  -8.867  -5.389 -21.336
    5   2HG   MET   1          HG1       MET   1  -7.373  -5.593 -20.433
    6   1HE   MET   1          HE1       MET   1  -8.417  -1.997 -19.417
    7   2HE   MET   1          HE2       MET   1  -7.911  -3.590 -18.855
    8   3HE   MET   1          HE3       MET   1  -9.460  -3.396 -19.673
    9    H    ALA   2           H        ALA   2  -5.251  -4.459 -24.566
   10    HA   ALA   2           HA       ALA   2  -4.460  -2.461 -25.124
   11   1HB   ALA   2          HB1       ALA   2  -5.070  -1.659 -22.276
   12   2HB   ALA   2          HB2       ALA   2  -6.224  -1.654 -23.604
   13   3HB   ALA   2          HB3       ALA   2  -4.833  -0.568 -23.643
   14    H    HIS   3           H        HIS   3  -2.933  -0.576 -24.013
   15    HA   HIS   3           HA       HIS   3  -0.557  -1.910 -22.895
   16   1HB   HIS   3          HB2       HIS   3  -0.508   0.160 -25.131
   17   2HB   HIS   3          HB1       HIS   3   0.872  -0.675 -24.441
   18    HD1  HIS   3           HD1      HIS   3   1.289  -3.159 -25.305
   19    HD2  HIS   3           HD2      HIS   3  -1.954  -1.215 -27.033
   20    HE1  HIS   3           HE1      HIS   3   0.602  -4.544 -27.292
   21    H    HIS   4           H        HIS   4  -2.803  -0.248 -21.935
   22    HA   HIS   4           HA       HIS   4  -1.686   2.448 -21.678
   23   1HB   HIS   4          HB2       HIS   4  -4.450   1.463 -20.940
   24   2HB   HIS   4          HB1       HIS   4  -3.907   3.136 -20.923
   25    HD1  HIS   4           HD1      HIS   4  -6.270   1.729 -22.733
   26    HD2  HIS   4           HD2      HIS   4  -2.521   3.065 -23.956
   27    HE1  HIS   4           HE1      HIS   4  -6.435   2.124 -25.215
   28    H    HIS   5           H        HIS   5  -1.811  -0.379 -19.946
   29    HA   HIS   5           HA       HIS   5  -1.141  -1.008 -17.904
   30   1HB   HIS   5          HB2       HIS   5   0.582   0.803 -17.999
   31   2HB   HIS   5          HB1       HIS   5  -0.582   1.929 -17.325
   32    HD1  HIS   5           HD1      HIS   5  -0.221   2.290 -14.845
   33    HD2  HIS   5           HD2      HIS   5   0.950  -1.505 -16.086
   34    HE1  HIS   5           HE1      HIS   5   0.679   1.128 -12.811
   35    H    HIS   6           H        HIS   6  -3.230   1.783 -17.906
   36    HA   HIS   6           HA       HIS   6  -4.509   1.166 -15.420
   37   1HB   HIS   6          HB2       HIS   6  -5.420   2.961 -17.674
   38   2HB   HIS   6          HB1       HIS   6  -6.154   2.865 -16.083
   39    HD1  HIS   6           HD1      HIS   6  -4.470   5.283 -17.695
   40    HD2  HIS   6           HD2      HIS   6  -3.526   3.202 -14.226
   41    HE1  HIS   6           HE1      HIS   6  -2.857   6.738 -16.427
   42    H    HIS   7           H        HIS   7  -6.227  -0.079 -15.080
   43    HA   HIS   7           HA       HIS   7  -7.228  -1.679 -17.258
   44   1HB   HIS   7          HB2       HIS   7  -6.780  -2.562 -14.906
   45   2HB   HIS   7          HB1       HIS   7  -8.181  -1.642 -14.374
   46    HD1  HIS   7           HD1      HIS   7  -7.280  -4.951 -15.492
   47    HD2  HIS   7           HD2      HIS   7 -10.615  -2.509 -15.872
   48    HE1  HIS   7           HE1      HIS   7  -9.176  -6.455 -16.140
   49    H    HIS   8           H        HIS   8  -8.325   0.877 -15.125
   50    HA   HIS   8           HA       HIS   8 -10.593   1.321 -16.945
   51   1HB   HIS   8          HB2       HIS   8 -10.684   1.640 -13.928
   52   2HB   HIS   8          HB1       HIS   8 -11.952   2.151 -15.022
   53    HD1  HIS   8           HD1      HIS   8 -13.216   0.064 -16.298
   54    HD2  HIS   8           HD2      HIS   8 -10.850  -0.860 -13.006
   55    HE1  HIS   8           HE1      HIS   8 -13.964  -2.185 -15.508
   56    H    ASN   9           H        ASN   9  -9.265   2.870 -14.096
   57    HA   ASN   9           HA       ASN   9  -8.768   4.956 -13.522
   58   1HB   ASN   9          HB2       ASN   9  -6.859   4.447 -15.142
   59   2HB   ASN   9          HB1       ASN   9  -7.733   5.396 -16.343
   60   1HD2  ASN   9          HD21      ASN   9  -7.734   7.621 -16.128
   61   2HD2  ASN   9          HD22      ASN   9  -6.753   8.486 -15.009
   62    H    GLN  10           H        GLN  10 -11.351   4.523 -14.272
   63    HA   GLN  10           HA       GLN  10 -12.236   6.862 -15.747
   64   1HB   GLN  10          HB2       GLN  10 -13.779   4.758 -14.217
   65   2HB   GLN  10          HB1       GLN  10 -14.507   6.018 -15.198
   66   1HG   GLN  10          HG2       GLN  10 -13.492   5.080 -17.189
   67   2HG   GLN  10          HG1       GLN  10 -12.696   3.842 -16.219
   68   1HE2  GLN  10          HE21      GLN  10 -14.600   3.562 -18.392
   69   2HE2  GLN  10          HE22      GLN  10 -15.930   2.673 -17.743
   70    H    GLN  11           H        GLN  11 -12.714   5.499 -12.558
   71    HA   GLN  11           HA       GLN  11 -12.933   8.179 -11.398
   72   1HB   GLN  11          HB2       GLN  11 -14.681   6.567 -10.753
   73   2HB   GLN  11          HB1       GLN  11 -13.459   5.408 -10.272
   74   1HG   GLN  11          HG2       GLN  11 -12.716   7.079  -8.537
   75   2HG   GLN  11          HG1       GLN  11 -14.163   8.007  -8.935
   76   1HE2  GLN  11          HE21      GLN  11 -14.980   7.698  -6.863
   77   2HE2  GLN  11          HE22      GLN  11 -15.660   6.182  -6.380
   78    H    ASN  12           H        ASN  12 -11.676   5.065 -10.412
   79    HA   ASN  12           HA       ASN  12  -9.817   4.273  -9.535
   80   1HB   ASN  12          HB2       ASN  12  -8.849   4.992 -11.667
   81   2HB   ASN  12          HB1       ASN  12  -8.390   6.540 -10.954
   82   1HD2  ASN  12          HD21      ASN  12  -6.207   6.109 -11.405
   83   2HD2  ASN  12          HD22      ASN  12  -5.305   4.956 -10.494
   84    H    LYS  13           H        LYS  13 -10.287   4.523  -7.486
   85    HA   LYS  13           HA       LYS  13 -10.198   6.817  -5.975
   86   1HB   LYS  13          HB2       LYS  13  -9.982   3.943  -5.277
   87   2HB   LYS  13          HB1       LYS  13  -9.676   5.120  -4.018
   88   1HG   LYS  13          HG2       LYS  13 -12.215   4.838  -5.643
   89   2HG   LYS  13          HG1       LYS  13 -11.983   4.363  -3.958
   90   1HD   LYS  13          HD2       LYS  13 -11.919   7.192  -5.066
   91   2HD   LYS  13          HD1       LYS  13 -13.146   6.477  -4.033
   92   1HE   LYS  13          HE2       LYS  13 -11.573   6.267  -2.205
   93   2HE   LYS  13          HE1       LYS  13 -10.255   6.821  -3.230
   94   1HZ   LYS  13          HZ1       LYS  13 -12.579   8.434  -2.341
   95   2HZ   LYS  13          HZ2       LYS  13 -11.392   8.966  -3.424
   96   3HZ   LYS  13          HZ3       LYS  13 -10.967   8.590  -1.844
   97    H    LYS  14           H        LYS  14  -7.569   4.534  -6.473
   98    HA   LYS  14           HA       LYS  14  -5.364   4.720  -6.279
   99   1HB   LYS  14          HB2       LYS  14  -6.112   7.557  -6.588
  100   2HB   LYS  14          HB1       LYS  14  -4.554   7.300  -5.835
  101   1HG   LYS  14          HG2       LYS  14  -5.421   6.191  -8.509
  102   2HG   LYS  14          HG1       LYS  14  -4.400   7.611  -8.266
  103   1HD   LYS  14          HD2       LYS  14  -3.701   4.818  -7.305
  104   2HD   LYS  14          HD1       LYS  14  -3.111   5.546  -8.790
  105   1HE   LYS  14          HE2       LYS  14  -2.676   6.842  -6.098
  106   2HE   LYS  14          HE1       LYS  14  -1.593   5.623  -6.740
  107   1HZ   LYS  14          HZ1       LYS  14  -0.957   7.963  -7.123
  108   2HZ   LYS  14          HZ2       LYS  14  -2.182   8.101  -8.306
  109   3HZ   LYS  14          HZ3       LYS  14  -0.950   6.926  -8.420
  110    H    VAL  15           H        VAL  15  -3.620   5.894  -4.784
  111    HA   VAL  15           HA       VAL  15  -4.368   5.011  -2.178
  112    HB   VAL  15           HB       VAL  15  -2.124   4.596  -3.481
  113   1HG1  VAL  15          HG11      VAL  15  -0.301   6.141  -2.989
  114   2HG1  VAL  15          HG12      VAL  15  -1.521   7.267  -2.357
  115   3HG1  VAL  15          HG13      VAL  15  -1.560   6.803  -4.053
  116   1HG2  VAL  15          HG21      VAL  15  -2.501   3.784  -1.251
  117   2HG2  VAL  15          HG22      VAL  15  -2.108   5.367  -0.588
  118   3HG2  VAL  15          HG23      VAL  15  -0.851   4.409  -1.386
  119    H    GLU  16           H        GLU  16  -5.234   6.374  -0.753
  120    HA   GLU  16           HA       GLU  16  -5.183   9.194  -1.402
  121   1HB   GLU  16          HB2       GLU  16  -6.667   7.776   0.784
  122   2HB   GLU  16          HB1       GLU  16  -6.933   9.429   0.236
  123   1HG   GLU  16          HG2       GLU  16  -7.499   8.516  -1.989
  124   2HG   GLU  16          HG1       GLU  16  -7.328   6.909  -1.290
  125    H    GLY  17           H        GLY  17  -5.144   7.923   1.879
  126   1HA   GLY  17          HA2       GLY  17  -2.609   9.353   2.209
  127   2HA   GLY  17          HA1       GLY  17  -3.970   9.801   3.237
  128    H    GLY  18           H        GLY  18  -4.330   6.618   2.727
  129   1HA   GLY  18          HA2       GLY  18  -2.747   6.024   5.114
  130   2HA   GLY  18          HA1       GLY  18  -4.303   5.277   4.729
  131    H    TYR  19           H        TYR  19  -3.664   3.206   4.678
  132    HA   TYR  19           HA       TYR  19  -1.504   2.536   2.795
  133   1HB   TYR  19          HB2       TYR  19  -2.476   0.869   5.119
  134   2HB   TYR  19          HB1       TYR  19  -1.024   0.627   4.158
  135    HD1  TYR  19           HD1      TYR  19   0.500   2.931   4.148
  136    HD2  TYR  19           HD2      TYR  19  -2.084   1.613   7.265
  137    HE1  TYR  19           HE1      TYR  19   1.746   4.301   5.762
  138    HE2  TYR  19           HE2      TYR  19  -0.866   2.955   8.869
  139    HH   TYR  19           HH       TYR  19   1.386   3.975   9.105
  140    H    GLU  20           H        GLU  20  -2.308   2.042   1.023
  141    HA   GLU  20           HA       GLU  20  -4.866   0.758   0.827
  142   1HB   GLU  20          HB2       GLU  20  -4.292   2.553  -0.743
  143   2HB   GLU  20          HB1       GLU  20  -2.868   1.647  -1.252
  144   1HG   GLU  20          HG2       GLU  20  -4.371  -0.168  -2.011
  145   2HG   GLU  20          HG1       GLU  20  -5.739   0.870  -1.630
  146    H    CYS  21           H        CYS  21  -5.000  -1.220   0.607
  147    HA   CYS  21           HA       CYS  21  -2.713  -2.985   0.620
  148   1HB   CYS  21          HB2       CYS  21  -5.611  -3.657   0.268
  149   2HB   CYS  21          HB1       CYS  21  -4.324  -4.810   0.623
  150    H    LYS  22           H        LYS  22  -2.041  -4.294  -0.985
  151    HA   LYS  22           HA       LYS  22  -2.604  -3.835  -3.714
  152   1HB   LYS  22          HB2       LYS  22  -0.471  -4.703  -3.164
  153   2HB   LYS  22          HB1       LYS  22  -1.147  -5.976  -2.166
  154   1HG   LYS  22          HG2       LYS  22  -0.242  -6.949  -4.149
  155   2HG   LYS  22          HG1       LYS  22  -1.995  -7.078  -4.210
  156   1HD   LYS  22          HD2       LYS  22  -2.040  -5.100  -5.681
  157   2HD   LYS  22          HD1       LYS  22  -0.265  -5.095  -5.659
  158   1HE   LYS  22          HE2       LYS  22  -0.304  -7.417  -6.540
  159   2HE   LYS  22          HE1       LYS  22  -2.051  -7.313  -6.668
  160   1HZ   LYS  22          HZ1       LYS  22  -0.103  -5.618  -8.142
  161   2HZ   LYS  22          HZ2       LYS  22  -1.791  -5.531  -8.300
  162   3HZ   LYS  22          HZ3       LYS  22  -0.973  -6.908  -8.784
  163    H    TYR  23           H        TYR  23  -3.934  -5.936  -1.261
  164    HA   TYR  23           HA       TYR  23  -5.219  -7.530  -3.315
  165   1HB   TYR  23          HB2       TYR  23  -5.524  -8.657  -0.690
  166   2HB   TYR  23          HB1       TYR  23  -4.767  -9.342  -2.114
  167    HD1  TYR  23           HD1      TYR  23  -2.261  -8.944  -2.468
  168    HD2  TYR  23           HD2      TYR  23  -4.267  -7.863   1.102
  169    HE1  TYR  23           HE1      TYR  23  -0.105  -8.906  -1.269
  170    HE2  TYR  23           HE2      TYR  23  -2.144  -7.809   2.316
  171    HH   TYR  23           HH       TYR  23   0.110  -8.927   2.050
  172    H    CYS  24           H        CYS  24  -6.060  -4.864  -1.757
  173    HA   CYS  24           HA       CYS  24  -8.785  -5.444  -2.146
  174   1HB   CYS  24          HB2       CYS  24  -9.677  -5.093   0.059
  175   2HB   CYS  24          HB1       CYS  24  -8.405  -6.300   0.195
  176    H    THR  25           H        THR  25 -10.047  -3.460  -2.145
  177    HA   THR  25           HA       THR  25  -8.370  -1.170  -2.651
  178    HB   THR  25           HB       THR  25 -11.394  -1.319  -2.850
  179    HG1  THR  25           HG1      THR  25 -11.215  -2.542  -4.570
  180   1HG2  THR  25          HG21      THR  25 -10.274   0.876  -3.225
  181   2HG2  THR  25          HG22      THR  25 -11.049   0.269  -4.686
  182   3HG2  THR  25          HG23      THR  25  -9.300   0.136  -4.497
  183    H    PHE  26           H        PHE  26  -9.444  -2.519   0.031
  184    HA   PHE  26           HA       PHE  26 -10.584  -0.208   1.335
  185   1HB   PHE  26          HB2       PHE  26  -9.930  -2.965   2.409
  186   2HB   PHE  26          HB1       PHE  26 -10.691  -1.688   3.350
  187    HD1  PHE  26           HD1      PHE  26 -12.877  -0.699   2.339
  188    HD2  PHE  26           HD2      PHE  26 -11.261  -4.494   1.302
  189    HE1  PHE  26           HE1      PHE  26 -15.091  -1.420   1.553
  190    HE2  PHE  26           HE2      PHE  26 -13.468  -5.221   0.508
  191    HZ   PHE  26           HZ       PHE  26 -15.389  -3.683   0.629
  192    H    GLN  27           H        GLN  27  -9.305   1.304   1.858
  193    HA   GLN  27           HA       GLN  27  -6.558   0.761   2.684
  194   1HB   GLN  27          HB2       GLN  27  -6.536   2.055   0.747
  195   2HB   GLN  27          HB1       GLN  27  -7.853   3.126   1.297
  196   1HG   GLN  27          HG2       GLN  27  -6.285   4.043   2.883
  197   2HG   GLN  27          HG1       GLN  27  -5.075   2.874   2.370
  198   1HE2  GLN  27          HE21      GLN  27  -3.703   4.142   1.679
  199   2HE2  GLN  27          HE22      GLN  27  -3.780   5.229   0.332
  200    H    THR  28           H        THR  28  -5.783   1.711   4.548
  201    HA   THR  28           HA       THR  28  -7.442   3.559   6.007
  202    HB   THR  28           HB       THR  28  -8.223   1.422   6.937
  203    HG1  THR  28           HG1      THR  28  -8.128   2.160   8.890
  204   1HG2  THR  28          HG21      THR  28  -6.702  -0.095   8.114
  205   2HG2  THR  28          HG22      THR  28  -5.347   0.926   7.702
  206   3HG2  THR  28          HG23      THR  28  -6.208   0.057   6.425
  207    HA   PRO  29           HA       PRO  29  -3.334   5.091   6.738
  208   1HB   PRO  29          HB2       PRO  29  -3.993   7.162   8.328
  209   2HB   PRO  29          HB1       PRO  29  -4.262   7.159   6.571
  210   1HG   PRO  29          HG2       PRO  29  -6.208   6.625   8.785
  211   2HG   PRO  29          HG1       PRO  29  -6.427   7.598   7.320
  212   1HD   PRO  29          HD2       PRO  29  -7.348   5.044   7.543
  213   2HD   PRO  29          HD1       PRO  29  -6.819   5.752   5.996
  214    H    ASP  30           H        ASP  30  -5.235   3.472   8.904
  215    HA   ASP  30           HA       ASP  30  -3.504   3.932  11.208
  216   1HB   ASP  30          HB2       ASP  30  -6.202   3.343  11.035
  217   2HB   ASP  30          HB1       ASP  30  -5.457   1.807  11.095
  218    H    LEU  31           H        LEU  31  -1.742   2.636  11.336
  219    HA   LEU  31           HA       LEU  31  -1.302   0.490   9.628
  220   1HB   LEU  31          HB2       LEU  31   0.270   2.000  11.100
  221   2HB   LEU  31          HB1       LEU  31   0.066   0.720  12.274
  222    HG   LEU  31           HG       LEU  31   2.129   0.314  11.119
  223   1HD1  LEU  31          HD11      LEU  31   0.883  -1.724  11.521
  224   2HD1  LEU  31          HD12      LEU  31   1.724  -1.848   9.957
  225   3HD1  LEU  31          HD13      LEU  31  -0.003  -1.455  10.028
  226   1HD2  LEU  31          HD21      LEU  31   2.272   0.137   8.684
  227   2HD2  LEU  31          HD22      LEU  31   1.668   1.725   9.218
  228   3HD2  LEU  31          HD23      LEU  31   0.546   0.531   8.597
  229    H    ASN  32           H        ASN  32  -2.556   0.705  12.987
  230    HA   ASN  32           HA       ASN  32  -2.421  -2.004  13.645
  231   1HB   ASN  32          HB2       ASN  32  -2.947   0.079  15.106
  232   2HB   ASN  32          HB1       ASN  32  -4.576  -0.127  14.442
  233   1HD2  ASN  32          HD21      ASN  32  -4.366  -3.113  14.537
  234   2HD2  ASN  32          HD22      ASN  32  -4.511  -3.471  16.209
  235    H    MET  33           H        MET  33  -4.905   0.030  12.222
  236    HA   MET  33           HA       MET  33  -6.822  -2.091  11.948
  237   1HB   MET  33          HB2       MET  33  -6.768   0.514  10.416
  238   2HB   MET  33          HB1       MET  33  -8.104  -0.612  10.517
  239   1HG   MET  33          HG2       MET  33  -6.896   0.869  12.776
  240   2HG   MET  33          HG1       MET  33  -8.406   1.297  11.970
  241   1HE   MET  33          HE1       MET  33  -9.728   1.259  14.311
  242   2HE   MET  33          HE2       MET  33  -8.227   0.849  15.142
  243   3HE   MET  33          HE3       MET  33  -9.687  -0.098  15.437
  244    H    PHE  34           H        PHE  34  -4.431  -0.651   9.900
  245    HA   PHE  34           HA       PHE  34  -5.076  -2.012   7.535
  246   1HB   PHE  34          HB2       PHE  34  -3.506  -0.217   7.398
  247   2HB   PHE  34          HB1       PHE  34  -2.442  -0.959   8.567
  248    HD1  PHE  34           HD1      PHE  34  -3.811  -1.418   5.087
  249    HD2  PHE  34           HD2      PHE  34  -0.710  -2.301   7.884
  250    HE1  PHE  34           HE1      PHE  34  -2.495  -2.431   3.295
  251    HE2  PHE  34           HE2      PHE  34   0.623  -3.327   6.066
  252    HZ   PHE  34           HZ       PHE  34  -0.277  -3.388   3.773
  253    H    THR  35           H        THR  35  -2.695  -2.918   9.996
  254    HA   THR  35           HA       THR  35  -2.196  -5.385   8.689
  255    HB   THR  35           HB       THR  35  -0.406  -4.441  10.038
  256    HG1  THR  35           HG1      THR  35  -1.411  -6.964  10.725
  257   1HG2  THR  35          HG21      THR  35  -0.523  -4.454  12.514
  258   2HG2  THR  35          HG22      THR  35  -2.238  -4.895  12.389
  259   3HG2  THR  35          HG23      THR  35  -1.665  -3.356  11.740
  260    H    PHE  36           H        PHE  36  -4.478  -4.390  11.046
  261    HA   PHE  36           HA       PHE  36  -5.197  -6.973  11.919
  262   1HB   PHE  36          HB2       PHE  36  -5.835  -5.240  13.332
  263   2HB   PHE  36          HB1       PHE  36  -6.545  -4.275  12.059
  264    HD1  PHE  36           HD1      PHE  36  -8.821  -4.112  12.281
  265    HD2  PHE  36           HD2      PHE  36  -6.955  -7.765  13.339
  266    HE1  PHE  36           HE1      PHE  36 -11.032  -5.053  12.871
  267    HE2  PHE  36           HE2      PHE  36  -9.143  -8.727  13.956
  268    HZ   PHE  36           HZ       PHE  36 -11.188  -7.367  13.717
  269    H    HIS  37           H        HIS  37  -6.690  -4.776   9.517
  270    HA   HIS  37           HA       HIS  37  -8.528  -6.799   8.810
  271   1HB   HIS  37          HB2       HIS  37  -9.543  -5.301   7.325
  272   2HB   HIS  37          HB1       HIS  37  -8.746  -4.217   8.449
  273    HD1  HIS  37           HD1      HIS  37  -7.198  -2.498   7.412
  274    HD2  HIS  37           HD2      HIS  37  -8.295  -5.520   4.786
  275    HE1  HIS  37           HE1      HIS  37  -6.387  -1.756   5.129
  276    H    VAL  38           H        VAL  38  -5.360  -6.045   7.792
  277    HA   VAL  38           HA       VAL  38  -5.380  -7.611   5.424
  278    HB   VAL  38           HB       VAL  38  -3.127  -6.683   7.203
  279   1HG1  VAL  38          HG11      VAL  38  -1.549  -7.492   5.468
  280   2HG1  VAL  38          HG12      VAL  38  -2.904  -8.231   4.605
  281   3HG1  VAL  38          HG13      VAL  38  -2.448  -8.822   6.204
  282   1HG2  VAL  38          HG21      VAL  38  -2.545  -5.300   5.252
  283   2HG2  VAL  38          HG22      VAL  38  -4.170  -4.982   5.862
  284   3HG2  VAL  38          HG23      VAL  38  -3.954  -5.942   4.400
  285    H    ASP  39           H        ASP  39  -4.242  -8.322   8.738
  286    HA   ASP  39           HA       ASP  39  -3.541 -10.987   8.203
  287   1HB   ASP  39          HB2       ASP  39  -2.798  -9.766  10.208
  288   2HB   ASP  39          HB1       ASP  39  -4.447  -9.767  10.818
  289    H    SER  40           H        SER  40  -6.535  -9.497   8.858
  290    HA   SER  40           HA       SER  40  -7.937 -11.934   9.460
  291   1HB   SER  40          HB2       SER  40  -8.549  -9.771  10.486
  292   2HB   SER  40          HB1       SER  40  -8.966  -9.150   8.903
  293    HG   SER  40           HG       SER  40 -10.664 -10.559   8.765
  294    H    GLU  41           H        GLU  41  -7.752  -9.728   6.673
  295    HA   GLU  41           HA       GLU  41  -9.702 -11.473   5.316
  296   1HB   GLU  41          HB2       GLU  41  -8.751  -8.774   4.388
  297   2HB   GLU  41          HB1       GLU  41 -10.138  -9.672   3.805
  298   1HG   GLU  41          HG2       GLU  41  -9.832  -8.418   6.527
  299   2HG   GLU  41          HG1       GLU  41 -10.828  -7.823   5.205
  300    H    HIS  42           H        HIS  42  -6.411 -10.202   4.928
  301    HA   HIS  42           HA       HIS  42  -5.909 -12.068   2.813
  302   1HB   HIS  42          HB2       HIS  42  -4.652  -9.893   1.878
  303   2HB   HIS  42          HB1       HIS  42  -6.186 -10.445   1.200
  304    HD1  HIS  42           HD1      HIS  42  -8.283  -8.954   2.008
  305    HD2  HIS  42           HD2      HIS  42  -4.576  -7.407   3.075
  306    HE1  HIS  42           HE1      HIS  42  -8.713  -6.602   2.711
  307    HA   PRO  43           HA       PRO  43  -2.650 -11.363   6.141
  308   1HB   PRO  43          HB2       PRO  43  -2.259 -13.967   6.766
  309   2HB   PRO  43          HB1       PRO  43  -3.515 -12.973   7.510
  310   1HG   PRO  43          HG2       PRO  43  -3.739 -14.897   5.220
  311   2HG   PRO  43          HG1       PRO  43  -4.793 -14.734   6.633
  312   1HD   PRO  43          HD2       PRO  43  -5.488 -13.667   4.284
  313   2HD   PRO  43          HD1       PRO  43  -5.808 -12.824   5.821
  314    H    ASN  44           H        ASN  44  -2.584 -13.857   3.579
  315    HA   ASN  44           HA       ASN  44   0.336 -13.489   3.521
  316   1HB   ASN  44          HB2       ASN  44  -0.312 -15.789   4.202
  317   2HB   ASN  44          HB1       ASN  44  -1.239 -15.954   2.726
  318   1HD2  ASN  44          HD21      ASN  44   1.965 -15.713   4.046
  319   2HD2  ASN  44          HD22      ASN  44   2.809 -16.384   2.701
  320    H    VAL  45           H        VAL  45  -2.029 -14.878   1.279
  321    HA   VAL  45           HA       VAL  45  -2.586 -14.501  -0.846
  322    HB   VAL  45           HB       VAL  45  -1.496 -11.695  -0.432
  323   1HG1  VAL  45          HG11      VAL  45  -3.043 -11.043  -2.188
  324   2HG1  VAL  45          HG12      VAL  45  -3.547 -12.720  -2.371
  325   3HG1  VAL  45          HG13      VAL  45  -1.895 -12.246  -2.800
  326   1HG2  VAL  45          HG21      VAL  45  -3.777 -11.121   0.104
  327   2HG2  VAL  45          HG22      VAL  45  -3.084 -12.331   1.215
  328   3HG2  VAL  45          HG23      VAL  45  -4.208 -12.836  -0.060
  329    H    VAL  46           H        VAL  46  -1.796 -14.568  -2.963
  330    HA   VAL  46           HA       VAL  46   1.065 -14.584  -2.958
  331    HB   VAL  46           HB       VAL  46  -0.702 -16.280  -4.758
  332   1HG1  VAL  46          HG11      VAL  46   1.306 -15.652  -5.966
  333   2HG1  VAL  46          HG12      VAL  46   1.375 -17.359  -5.524
  334   3HG1  VAL  46          HG13      VAL  46   2.306 -16.173  -4.609
  335   1HG2  VAL  46          HG21      VAL  46  -0.620 -17.068  -2.454
  336   2HG2  VAL  46          HG22      VAL  46   1.145 -17.074  -2.510
  337   3HG2  VAL  46          HG23      VAL  46   0.226 -18.181  -3.529
  338    H    LEU  47           H        LEU  47  -1.448 -14.461  -5.475
  339    HA   LEU  47           HA       LEU  47  -1.744 -13.265  -7.314
  340   1HB   LEU  47          HB2       LEU  47  -0.601 -11.039  -5.632
  341   2HB   LEU  47          HB1       LEU  47  -1.319 -10.794  -7.207
  342    HG   LEU  47           HG       LEU  47  -2.760 -11.842  -4.767
  343   1HD1  LEU  47          HD11      LEU  47  -2.949  -9.191  -6.183
  344   2HD1  LEU  47          HD12      LEU  47  -2.176  -9.466  -4.624
  345   3HD1  LEU  47          HD13      LEU  47  -3.917  -9.703  -4.800
  346   1HD2  LEU  47          HD21      LEU  47  -3.697 -12.781  -6.798
  347   2HD2  LEU  47          HD22      LEU  47  -3.745 -11.182  -7.533
  348   3HD2  LEU  47          HD23      LEU  47  -4.773 -11.542  -6.148
  349    H    ASN  48           H        ASN  48   0.996 -11.179  -6.811
  350    HA   ASN  48           HA       ASN  48   2.759 -12.551  -8.589
  351   1HB   ASN  48          HB2       ASN  48   1.281 -10.077  -9.582
  352   2HB   ASN  48          HB1       ASN  48   2.770 -10.644 -10.298
  353   1HD2  ASN  48          HD21      ASN  48   2.738 -12.638 -11.426
  354   2HD2  ASN  48          HD22      ASN  48   1.294 -13.257 -12.111
  355    H    SER  49           H        SER  49   4.213 -10.220  -9.381
  356    HA   SER  49           HA       SER  49   5.110  -9.376  -6.782
  357   1HB   SER  49          HB2       SER  49   6.336  -8.915  -9.519
  358   2HB   SER  49          HB1       SER  49   7.084  -8.510  -7.977
  359    HG   SER  49           HG       SER  49   6.830 -10.817  -7.465
  360    H    SER  50           H        SER  50   5.312  -7.152  -6.220
  361    HA   SER  50           HA       SER  50   3.899  -5.114  -7.590
  362   1HB   SER  50          HB2       SER  50   2.960  -6.443  -5.058
  363   2HB   SER  50          HB1       SER  50   2.339  -4.921  -5.682
  364    HG   SER  50           HG       SER  50   2.305  -6.679  -7.636
  365    H    TYR  51           H        TYR  51   3.837  -3.254  -5.760
  366    HA   TYR  51           HA       TYR  51   6.526  -3.290  -4.614
  367   1HB   TYR  51          HB2       TYR  51   4.971  -1.282  -6.071
  368   2HB   TYR  51          HB1       TYR  51   5.935  -0.719  -4.727
  369    HD1  TYR  51           HD1      TYR  51   6.544  -3.171  -7.526
  370    HD2  TYR  51           HD2      TYR  51   7.824   0.281  -5.410
  371    HE1  TYR  51           HE1      TYR  51   8.500  -2.991  -9.021
  372    HE2  TYR  51           HE2      TYR  51   9.796   0.455  -6.878
  373    HH   TYR  51           HH       TYR  51  10.042  -1.155  -9.773
  374    H    VAL  52           H        VAL  52   6.847  -2.617  -2.605
  375    HA   VAL  52           HA       VAL  52   4.533  -1.807  -0.980
  376    HB   VAL  52           HB       VAL  52   5.011  -4.213  -0.650
  377   1HG1  VAL  52          HG11      VAL  52   7.322  -4.178  -1.240
  378   2HG1  VAL  52          HG12      VAL  52   7.032  -4.968   0.298
  379   3HG1  VAL  52          HG13      VAL  52   7.696  -3.328   0.266
  380   1HG2  VAL  52          HG21      VAL  52   5.857  -2.590   1.728
  381   2HG2  VAL  52          HG22      VAL  52   5.359  -4.283   1.754
  382   3HG2  VAL  52          HG23      VAL  52   4.209  -3.032   1.284
  383    H    CYS  53           H        CYS  53   4.985  -0.245   0.514
  384    HA   CYS  53           HA       CYS  53   7.625   1.028   0.511
  385   1HB   CYS  53          HB2       CYS  53   5.650   2.432   0.610
  386   2HB   CYS  53          HB1       CYS  53   5.041   1.570   2.006
  387    H    VAL  54           H        VAL  54   9.070  -0.269   1.529
  388    HA   VAL  54           HA       VAL  54   8.569  -2.147   3.497
  389    HB   VAL  54           HB       VAL  54  11.094  -0.820   3.943
  390   1HG1  VAL  54          HG11      VAL  54  11.984  -2.966   3.459
  391   2HG1  VAL  54          HG12      VAL  54  10.446  -3.392   2.723
  392   3HG1  VAL  54          HG13      VAL  54  10.529  -3.148   4.489
  393   1HG2  VAL  54          HG21      VAL  54  12.014  -1.489   1.691
  394   2HG2  VAL  54          HG22      VAL  54  11.084  -0.008   1.810
  395   3HG2  VAL  54          HG23      VAL  54  10.337  -1.419   1.117
  396    H    GLU  55           H        GLU  55   9.116   1.230   3.685
  397    HA   GLU  55           HA       GLU  55   9.770   1.563   6.341
  398   1HB   GLU  55          HB2       GLU  55   8.123   3.518   4.739
  399   2HB   GLU  55          HB1       GLU  55   9.240   3.872   6.045
  400   1HG   GLU  55          HG2       GLU  55  10.038   2.755   3.359
  401   2HG   GLU  55          HG1       GLU  55  10.100   4.449   3.804
  402    H    CYS  56           H        CYS  56   6.769   1.405   4.673
  403    HA   CYS  56           HA       CYS  56   5.198   1.637   7.197
  404   1HB   CYS  56          HB2       CYS  56   4.143   1.631   4.402
  405   2HB   CYS  56          HB1       CYS  56   3.329   2.218   5.849
  406    H    ASN  57           H        ASN  57   6.369  -0.652   5.082
  407    HA   ASN  57           HA       ASN  57   5.856  -2.684   4.316
  408   1HB   ASN  57          HB2       ASN  57   5.031  -2.718   7.139
  409   2HB   ASN  57          HB1       ASN  57   4.731  -4.190   6.177
  410   1HD2  ASN  57          HD21      ASN  57   7.268  -3.718   4.632
  411   2HD2  ASN  57          HD22      ASN  57   8.475  -4.178   5.765
  412    H    PHE  58           H        PHE  58   4.288  -1.225   3.027
  413    HA   PHE  58           HA       PHE  58   1.652  -2.466   3.221
  414   1HB   PHE  58          HB2       PHE  58   0.439  -0.535   3.339
  415   2HB   PHE  58          HB1       PHE  58   1.916   0.148   3.987
  416    HD1  PHE  58           HD1      PHE  58   3.168   1.777   2.678
  417    HD2  PHE  58           HD2      PHE  58  -0.279  -0.065   1.090
  418    HE1  PHE  58           HE1      PHE  58   3.083   3.498   0.862
  419    HE2  PHE  58           HE2      PHE  58  -0.372   1.649  -0.720
  420    HZ   PHE  58           HZ       PHE  58   1.324   3.403  -0.836
  421    H    LEU  59           H        LEU  59   1.031  -3.332   1.457
  422    HA   LEU  59           HA       LEU  59   2.631  -3.007  -0.958
  423   1HB   LEU  59          HB2       LEU  59   1.016  -5.151   0.239
  424   2HB   LEU  59          HB1       LEU  59   0.878  -4.986  -1.495
  425    HG   LEU  59           HG       LEU  59   3.522  -5.299  -0.135
  426   1HD1  LEU  59          HD11      LEU  59   1.762  -7.361  -1.444
  427   2HD1  LEU  59          HD12      LEU  59   1.932  -7.164   0.295
  428   3HD1  LEU  59          HD13      LEU  59   3.324  -7.647  -0.663
  429   1HD2  LEU  59          HD21      LEU  59   2.543  -5.627  -2.992
  430   2HD2  LEU  59          HD22      LEU  59   4.157  -5.994  -2.436
  431   3HD2  LEU  59          HD23      LEU  59   3.580  -4.336  -2.400
  432    H    THR  60           H        THR  60   1.634  -2.199  -2.803
  433    HA   THR  60           HA       THR  60  -1.208  -1.636  -2.522
  434    HB   THR  60           HB       THR  60  -0.313   0.414  -2.074
  435    HG1  THR  60           HG1      THR  60  -1.763   1.002  -3.638
  436   1HG2  THR  60          HG21      THR  60   2.030  -0.163  -2.582
  437   2HG2  THR  60          HG22      THR  60   1.631   1.439  -3.112
  438   3HG2  THR  60          HG23      THR  60   1.729   0.129  -4.288
  439    H    LYS  61           H        LYS  61  -2.195  -0.999  -4.568
  440    HA   LYS  61           HA       LYS  61  -1.944  -3.169  -6.404
  441   1HB   LYS  61          HB2       LYS  61  -4.089  -2.297  -5.637
  442   2HB   LYS  61          HB1       LYS  61  -3.742  -0.742  -6.363
  443   1HG   LYS  61          HG2       LYS  61  -3.810  -1.760  -8.584
  444   2HG   LYS  61          HG1       LYS  61  -4.129  -3.332  -7.849
  445   1HD   LYS  61          HD2       LYS  61  -5.902  -0.911  -7.525
  446   2HD   LYS  61          HD1       LYS  61  -6.171  -2.180  -8.716
  447   1HE   LYS  61          HE2       LYS  61  -6.114  -2.559  -5.710
  448   2HE   LYS  61          HE1       LYS  61  -7.555  -2.487  -6.716
  449   1HZ   LYS  61          HZ1       LYS  61  -6.992  -4.773  -6.246
  450   2HZ   LYS  61          HZ2       LYS  61  -5.442  -4.589  -6.861
  451   3HZ   LYS  61          HZ3       LYS  61  -6.758  -4.492  -7.885
  452    H    ARG  62           H        ARG  62  -0.503  -0.112  -6.249
  453    HA   ARG  62           HA       ARG  62   0.382  -0.409  -9.008
  454   1HB   ARG  62          HB2       ARG  62   0.238   1.990  -9.467
  455   2HB   ARG  62          HB1       ARG  62  -1.345   1.295  -9.180
  456   1HG   ARG  62          HG2       ARG  62   0.131   2.673  -6.968
  457   2HG   ARG  62          HG1       ARG  62  -0.763   3.602  -8.172
  458   1HD   ARG  62          HD2       ARG  62  -1.830   1.435  -6.419
  459   2HD   ARG  62          HD1       ARG  62  -2.106   3.160  -6.190
  460    HE   ARG  62           HE       ARG  62  -2.855   2.553  -8.797
  461   1HH1  ARG  62          HH11      ARG  62  -4.088   1.747  -5.534
  462   2HH1  ARG  62          HH12      ARG  62  -5.671   1.760  -6.031
  463   1HH2  ARG  62          HH21      ARG  62  -5.046   2.528  -9.418
  464   2HH2  ARG  62          HH22      ARG  62  -6.271   2.225  -8.282
  465    H    TYR  63           H        TYR  63   2.411   0.551  -9.421
  466    HA   TYR  63           HA       TYR  63   3.934   0.596  -7.014
  467   1HB   TYR  63          HB2       TYR  63   5.940   0.819  -8.698
  468   2HB   TYR  63          HB1       TYR  63   5.111  -0.714  -8.494
  469    HD1  TYR  63           HD1      TYR  63   5.852   2.024 -10.782
  470    HD2  TYR  63           HD2      TYR  63   3.596  -1.531 -10.223
  471    HE1  TYR  63           HE1      TYR  63   5.416   1.911 -13.206
  472    HE2  TYR  63           HE2      TYR  63   3.154  -1.648 -12.621
  473    HH   TYR  63           HH       TYR  63   3.059  -0.182 -14.474
  474    H    ASP  64           H        ASP  64   2.489   2.847  -8.947
  475    HA   ASP  64           HA       ASP  64   4.286   5.003  -8.422
  476   1HB   ASP  64          HB2       ASP  64   2.472   6.501  -9.061
  477   2HB   ASP  64          HB1       ASP  64   2.873   5.317 -10.322
  478    H    ALA  65           H        ALA  65   1.648   3.709  -6.604
  479    HA   ALA  65           HA       ALA  65   1.231   5.776  -4.742
  480   1HB   ALA  65          HB1       ALA  65   1.231   2.803  -4.376
  481   2HB   ALA  65          HB2       ALA  65  -0.158   3.804  -4.797
  482   3HB   ALA  65          HB3       ALA  65   0.585   3.942  -3.202
  483    H    LEU  66           H        LEU  66   3.879   3.636  -5.068
  484    HA   LEU  66           HA       LEU  66   5.029   4.226  -2.485
  485   1HB   LEU  66          HB2       LEU  66   6.337   2.865  -4.820
  486   2HB   LEU  66          HB1       LEU  66   6.948   2.938  -3.186
  487    HG   LEU  66           HG       LEU  66   6.110   0.832  -3.404
  488   1HD1  LEU  66          HD11      LEU  66   4.187   0.698  -1.915
  489   2HD1  LEU  66          HD12      LEU  66   3.861   2.400  -2.214
  490   3HD1  LEU  66          HD13      LEU  66   5.339   1.927  -1.354
  491   1HD2  LEU  66          HD21      LEU  66   4.969   1.147  -5.474
  492   2HD2  LEU  66          HD22      LEU  66   3.651   1.985  -4.652
  493   3HD2  LEU  66          HD23      LEU  66   3.940   0.266  -4.342
  494    H    SER  67           H        SER  67   5.234   5.357  -5.678
  495    HA   SER  67           HA       SER  67   7.742   6.774  -5.412
  496   1HB   SER  67          HB2       SER  67   6.505   5.897  -7.569
  497   2HB   SER  67          HB1       SER  67   5.574   7.365  -7.414
  498    HG   SER  67           HG       SER  67   7.305   8.601  -7.769
  499    H    GLU  68           H        GLU  68   4.322   7.601  -5.544
  500    HA   GLU  68           HA       GLU  68   4.622  10.343  -4.902
  501   1HB   GLU  68          HB2       GLU  68   2.153   8.962  -4.057
  502   2HB   GLU  68          HB1       GLU  68   2.360  10.498  -4.863
  503   1HG   GLU  68          HG2       GLU  68   3.099   9.126  -6.896
  504   2HG   GLU  68          HG1       GLU  68   2.469   7.782  -6.021
  505    H    HIS  69           H        HIS  69   4.678   7.554  -3.115
  506    HA   HIS  69           HA       HIS  69   3.681   8.144  -0.627
  507   1HB   HIS  69          HB2       HIS  69   4.815   6.021  -1.499
  508   2HB   HIS  69          HB1       HIS  69   6.286   6.795  -0.865
  509    HD1  HIS  69           HD1      HIS  69   2.888   5.647   0.346
  510    HD2  HIS  69           HD2      HIS  69   6.716   6.421   1.673
  511    HE1  HIS  69           HE1      HIS  69   2.922   4.916   2.751
  512    H    ASN  70           H        ASN  70   7.087   8.761  -1.563
  513    HA   ASN  70           HA       ASN  70   7.530  10.324   0.799
  514   1HB   ASN  70          HB2       ASN  70   9.701  10.996  -0.168
  515   2HB   ASN  70          HB1       ASN  70   9.455   9.249  -0.141
  516   1HD2  ASN  70          HD21      ASN  70  11.243   9.517  -1.538
  517   2HD2  ASN  70          HD22      ASN  70  10.943   9.600  -3.265
  518    H    LEU  71           H        LEU  71   6.011  11.008  -1.948
  519    HA   LEU  71           HA       LEU  71   6.502  13.839  -1.966
  520   1HB   LEU  71          HB2       LEU  71   6.004  13.128  -4.084
  521   2HB   LEU  71          HB1       LEU  71   4.906  11.885  -3.545
  522    HG   LEU  71           HG       LEU  71   3.200  13.530  -3.181
  523   1HD1  LEU  71          HD11      LEU  71   3.502  15.858  -4.084
  524   2HD1  LEU  71          HD12      LEU  71   5.187  15.482  -4.446
  525   3HD1  LEU  71          HD13      LEU  71   4.634  15.536  -2.771
  526   1HD2  LEU  71          HD21      LEU  71   2.755  14.039  -5.557
  527   2HD2  LEU  71          HD22      LEU  71   3.284  12.380  -5.282
  528   3HD2  LEU  71          HD23      LEU  71   4.409  13.568  -5.940
  529    H    LYS  72           H        LYS  72   3.833  11.698  -1.015
  530    HA   LYS  72           HA       LYS  72   2.641  13.987   0.350
  531   1HB   LYS  72          HB2       LYS  72   0.632  12.146   0.299
  532   2HB   LYS  72          HB1       LYS  72   0.800  13.474  -0.854
  533   1HG   LYS  72          HG2       LYS  72   2.142  11.800  -2.214
  534   2HG   LYS  72          HG1       LYS  72   1.551  10.570  -1.141
  535   1HD   LYS  72          HD2       LYS  72  -0.118  12.386  -2.874
  536   2HD   LYS  72          HD1       LYS  72   0.133  10.652  -3.068
  537   1HE   LYS  72          HE2       LYS  72  -1.102  10.253  -0.940
  538   2HE   LYS  72          HE1       LYS  72  -1.312  11.984  -0.766
  539   1HZ   LYS  72          HZ1       LYS  72  -2.393  10.371  -3.012
  540   2HZ   LYS  72          HZ2       LYS  72  -2.678  12.014  -2.721
  541   3HZ   LYS  72          HZ3       LYS  72  -3.245  10.856  -1.646
  542    H    TYR  73           H        TYR  73   3.460  10.694   0.840
  543    HA   TYR  73           HA       TYR  73   2.348  10.583   3.518
  544   1HB   TYR  73          HB2       TYR  73   3.894   8.641   1.862
  545   2HB   TYR  73          HB1       TYR  73   3.325   8.264   3.495
  546    HD1  TYR  73           HD1      TYR  73   2.064   9.527   0.222
  547    HD2  TYR  73           HD2      TYR  73   1.336   7.134   3.641
  548    HE1  TYR  73           HE1      TYR  73   0.010   8.769  -0.775
  549    HE2  TYR  73           HE2      TYR  73  -0.763   6.376   2.657
  550    HH   TYR  73           HH       TYR  73  -2.370   7.350   1.014
  551    H    HIS  74           H        HIS  74   5.577  10.197   2.057
  552    HA   HIS  74           HA       HIS  74   6.732  10.989   4.678
  553   1HB   HIS  74          HB2       HIS  74   7.908   9.185   2.538
  554   2HB   HIS  74          HB1       HIS  74   8.777   9.687   3.983
  555    HD1  HIS  74           HD1      HIS  74   6.099   8.978   5.859
  556    HD2  HIS  74           HD2      HIS  74   8.141   6.539   3.185
  557    HE1  HIS  74           HE1      HIS  74   5.540   6.626   6.505
  558    HA   PRO  75           HA       PRO  75   7.789  14.091   1.358
  559   1HB   PRO  75          HB2       PRO  75   6.987  16.310   2.596
  560   2HB   PRO  75          HB1       PRO  75   5.837  15.246   1.777
  561   1HG   PRO  75          HG2       PRO  75   6.533  15.338   4.706
  562   2HG   PRO  75          HG1       PRO  75   4.918  15.295   3.958
  563   1HD   PRO  75          HD2       PRO  75   6.121  13.090   4.936
  564   2HD   PRO  75          HD1       PRO  75   5.068  13.071   3.507
  565    H    GLY  76           H        GLY  76   9.506  15.361   1.142
  566   1HA   GLY  76          HA2       GLY  76  10.883  16.955   2.766
  567   2HA   GLY  76          HA1       GLY  76  11.435  15.374   3.306
  568    H    GLU  77           H        GLU  77  11.511  14.031   0.884
  569    HA   GLU  77           HA       GLU  77  13.115  15.440  -1.028
  570   1HB   GLU  77          HB2       GLU  77  15.147  14.043  -0.679
  571   2HB   GLU  77          HB1       GLU  77  14.839  15.139   0.657
  572   1HG   GLU  77          HG2       GLU  77  15.069  13.385   2.015
  573   2HG   GLU  77          HG1       GLU  77  13.552  12.775   1.337
  574    H    GLU  78           H        GLU  78  14.057  13.696  -2.606
  575    HA   GLU  78           HA       GLU  78  12.015  11.605  -2.811
  576   1HB   GLU  78          HB2       GLU  78  11.523  13.484  -4.380
  577   2HB   GLU  78          HB1       GLU  78  13.134  13.234  -5.048
  578   1HG   GLU  78          HG2       GLU  78  12.495  10.990  -5.778
  579   2HG   GLU  78          HG1       GLU  78  10.889  11.249  -5.101
  580    H    ASN  79           H        ASN  79  13.469  10.108  -2.020
  581    HA   ASN  79           HA       ASN  79  15.312   9.049  -4.011
  582   1HB   ASN  79          HB2       ASN  79  16.117   9.721  -1.175
  583   2HB   ASN  79          HB1       ASN  79  17.104   8.755  -2.273
  584   1HD2  ASN  79          HD21      ASN  79  15.797  11.829  -1.572
  585   2HD2  ASN  79          HD22      ASN  79  16.764  12.824  -2.611
  586    H    PHE  80           H        PHE  80  13.952   7.371  -4.163
  587    HA   PHE  80           HA       PHE  80  13.598   5.683  -1.798
  588   1HB   PHE  80          HB2       PHE  80  11.875   6.385  -4.022
  589   2HB   PHE  80          HB1       PHE  80  12.043   4.652  -3.848
  590    HD1  PHE  80           HD1      PHE  80  10.259   7.499  -2.806
  591    HD2  PHE  80           HD2      PHE  80  11.644   3.734  -1.418
  592    HE1  PHE  80           HE1      PHE  80   8.458   7.453  -1.102
  593    HE2  PHE  80           HE2      PHE  80   9.849   3.670   0.228
  594    HZ   PHE  80           HZ       PHE  80   8.244   5.532   0.389
  595    H    LYS  81           H        LYS  81  14.239   3.607  -1.916
  596    HA   LYS  81           HA       LYS  81  15.918   2.889  -4.218
  597   1HB   LYS  81          HB2       LYS  81  17.454   1.992  -2.725
  598   2HB   LYS  81          HB1       LYS  81  16.666   3.173  -1.672
  599   1HG   LYS  81          HG2       LYS  81  15.270   1.522  -0.712
  600   2HG   LYS  81          HG1       LYS  81  15.821   0.311  -1.856
  601   1HD   LYS  81          HD2       LYS  81  18.156   0.743  -0.884
  602   2HD   LYS  81          HD1       LYS  81  17.260   1.523   0.439
  603   1HE   LYS  81          HE2       LYS  81  15.951  -0.495   0.753
  604   2HE   LYS  81          HE1       LYS  81  16.824  -1.239  -0.588
  605   1HZ   LYS  81          HZ1       LYS  81  18.857  -1.148   0.719
  606   2HZ   LYS  81          HZ2       LYS  81  17.662  -1.939   1.604
  607   3HZ   LYS  81          HZ3       LYS  81  18.057  -0.364   1.977
  608    H    LEU  82           H        LEU  82  15.939   0.432  -4.520
  609    HA   LEU  82           HA       LEU  82  13.352  -0.702  -3.813
  610   1HB   LEU  82          HB2       LEU  82  13.235  -1.888  -5.974
  611   2HB   LEU  82          HB1       LEU  82  13.141  -0.155  -6.166
  612    HG   LEU  82           HG       LEU  82  15.750  -1.588  -6.586
  613   1HD1  LEU  82          HD11      LEU  82  14.083  -2.726  -7.999
  614   2HD1  LEU  82          HD12      LEU  82  15.161  -1.744  -8.986
  615   3HD1  LEU  82          HD13      LEU  82  13.536  -1.168  -8.614
  616   1HD2  LEU  82          HD21      LEU  82  16.198   0.305  -8.052
  617   2HD2  LEU  82          HD22      LEU  82  15.702   0.884  -6.455
  618   3HD2  LEU  82          HD23      LEU  82  14.562   0.909  -7.793
  619    H    THR  83           H        THR  83  13.391  -2.674  -3.044
  620    HA   THR  83           HA       THR  83  15.742  -4.312  -3.344
  621    HB   THR  83           HB       THR  83  16.262  -3.103  -1.318
  622    HG1  THR  83           HG1      THR  83  15.954  -4.795   0.322
  623   1HG2  THR  83          HG21      THR  83  13.535  -3.803  -0.249
  624   2HG2  THR  83          HG22      THR  83  13.997  -2.215  -0.843
  625   3HG2  THR  83          HG23      THR  83  14.769  -2.872   0.606
  626    H    MET  84           H        MET  84  14.863  -6.323  -3.970
  627    HA   MET  84           HA       MET  84  12.002  -6.580  -3.296
  628   1HB   MET  84          HB2       MET  84  12.621  -6.839  -5.672
  629   2HB   MET  84          HB1       MET  84  13.719  -8.136  -5.211
  630   1HG   MET  84          HG2       MET  84  11.847  -9.511  -4.510
  631   2HG   MET  84          HG1       MET  84  10.721  -8.216  -4.913
  632   1HE   MET  84          HE1       MET  84   9.313  -9.862  -6.452
  633   2HE   MET  84          HE2       MET  84  10.411 -11.182  -6.056
  634   3HE   MET  84          HE3       MET  84  10.013 -10.840  -7.739
  635    H    VAL  85           H        VAL  85  11.883  -7.362  -1.367
  636    HA   VAL  85           HA       VAL  85  12.726 -10.063  -0.970
  637    HB   VAL  85           HB       VAL  85  13.460  -9.342   1.470
  638   1HG1  VAL  85          HG11      VAL  85  15.241  -8.835  -0.917
  639   2HG1  VAL  85          HG12      VAL  85  14.988 -10.392  -0.130
  640   3HG1  VAL  85          HG13      VAL  85  15.812  -9.090   0.735
  641   1HG2  VAL  85          HG21      VAL  85  14.039  -6.815  -0.087
  642   2HG2  VAL  85          HG22      VAL  85  14.591  -7.148   1.559
  643   3HG2  VAL  85          HG23      VAL  85  12.864  -6.966   1.219
  644    H    LYS  86           H        LYS  86  10.647 -10.912  -0.585
  645    HA   LYS  86           HA       LYS  86   9.434  -9.588   1.684
  646   1HB   LYS  86          HB2       LYS  86   8.299  -8.871  -0.539
  647   2HB   LYS  86          HB1       LYS  86   7.593 -10.507  -0.502
  648   1HG   LYS  86          HG2       LYS  86   6.026  -9.002   0.348
  649   2HG   LYS  86          HG1       LYS  86   6.640 -10.012   1.653
  650   1HD   LYS  86          HD2       LYS  86   7.925  -8.320   2.603
  651   2HD   LYS  86          HD1       LYS  86   7.950  -7.377   1.126
  652   1HE   LYS  86          HE2       LYS  86   5.768  -6.471   1.539
  653   2HE   LYS  86          HE1       LYS  86   5.374  -7.743   2.691
  654   1HZ   LYS  86          HZ1       LYS  86   7.025  -6.848   4.138
  655   2HZ   LYS  86          HZ2       LYS  86   5.900  -5.659   3.734
  656   3HZ   LYS  86          HZ3       LYS  86   7.469  -5.697   2.994
  657    H    ARG  87           H        ARG  87   9.111 -10.922   3.200
  658    HA   ARG  87           HA       ARG  87   9.063 -13.738   2.480
  659   1HB   ARG  87          HB2       ARG  87  10.411 -12.454   4.881
  660   2HB   ARG  87          HB1       ARG  87  10.394 -14.172   4.509
  661   1HG   ARG  87          HG2       ARG  87  12.546 -13.484   3.803
  662   2HG   ARG  87          HG1       ARG  87  11.583 -13.499   2.324
  663   1HD   ARG  87          HD2       ARG  87  12.954 -11.496   2.351
  664   2HD   ARG  87          HD1       ARG  87  11.261 -11.070   2.492
  665    HE   ARG  87           HE       ARG  87  12.737 -11.305   4.973
  666   1HH1  ARG  87          HH11      ARG  87  11.416  -8.959   2.547
  667   2HH1  ARG  87          HH12      ARG  87  11.601  -7.657   3.560
  668   1HH2  ARG  87          HH21      ARG  87  12.965  -9.403   6.310
  669   2HH2  ARG  87          HH22      ARG  87  12.486  -7.882   5.708
  670    H    ASN  88           H        ASN  88   7.777 -15.055   3.850
  671    HA   ASN  88           HA       ASN  88   5.982 -15.609   5.048
  672   1HB   ASN  88          HB2       ASN  88   6.438 -12.958   6.451
  673   2HB   ASN  88          HB1       ASN  88   5.116 -14.035   6.874
  674   1HD2  ASN  88          HD21      ASN  88   5.852 -14.383   8.893
  675   2HD2  ASN  88          HD22      ASN  88   7.266 -15.297   9.290
  676    H    ASN  89           H        ASN  89   6.031 -13.753   2.708
  677    HA   ASN  89           HA       ASN  89   3.160 -13.429   2.370
  678   1HB   ASN  89          HB2       ASN  89   5.160 -11.195   1.810
  679   2HB   ASN  89          HB1       ASN  89   3.460 -11.146   1.427
  680   1HD2  ASN  89          HD21      ASN  89   5.847 -10.741   3.845
  681   2HD2  ASN  89          HD22      ASN  89   4.827 -10.086   5.072
  682    H    GLN  90           H        GLN  90   3.755 -11.976  -0.142
  683    HA   GLN  90           HA       GLN  90   4.826 -14.214  -1.656
  684   1HB   GLN  90          HB2       GLN  90   3.881 -13.079  -3.589
  685   2HB   GLN  90          HB1       GLN  90   2.630 -13.301  -2.350
  686   1HG   GLN  90          HG2       GLN  90   4.121 -10.768  -2.777
  687   2HG   GLN  90          HG1       GLN  90   2.643 -11.146  -3.663
  688   1HE2  GLN  90          HE21      GLN  90   4.028 -10.186  -0.668
  689   2HE2  GLN  90          HE22      GLN  90   2.517  -9.899   0.153
  690    H    THR  91           H        THR  91   6.185 -13.364  -3.612
  691    HA   THR  91           HA       THR  91   8.063 -11.563  -2.378
  692    HB   THR  91           HB       THR  91   9.536 -12.317  -4.406
  693    HG1  THR  91           HG1      THR  91   7.375 -13.606  -5.008
  694   1HG2  THR  91          HG21      THR  91  10.332 -14.267  -3.081
  695   2HG2  THR  91          HG22      THR  91   8.867 -14.197  -2.112
  696   3HG2  THR  91          HG23      THR  91  10.021 -12.890  -2.031
  697    H    ILE  92           H        ILE  92   7.956  -9.664  -2.711
  698    HA   ILE  92           HA       ILE  92   7.186  -8.472  -5.191
  699    HB   ILE  92           HB       ILE  92   5.802  -6.825  -3.801
  700   1HG1  ILE  92          HG12      ILE  92   4.743  -8.164  -1.807
  701   2HG1  ILE  92          HG11      ILE  92   6.293  -8.944  -1.847
  702   1HG2  ILE  92          HG21      ILE  92   4.636  -8.235  -5.261
  703   2HG2  ILE  92          HG22      ILE  92   3.795  -8.319  -3.722
  704   3HG2  ILE  92          HG23      ILE  92   4.873  -9.634  -4.230
  705   1HD1  ILE  92          HD11      ILE  92   7.503  -6.935  -1.575
  706   2HD1  ILE  92          HD12      ILE  92   6.290  -7.036  -0.308
  707   3HD1  ILE  92          HD13      ILE  92   6.046  -5.965  -1.684
  708    H    PHE  93           H        PHE  93   7.741  -6.071  -5.168
  709    HA   PHE  93           HA       PHE  93  10.518  -5.922  -4.291
  710   1HB   PHE  93          HB2       PHE  93   8.762  -4.183  -5.998
  711   2HB   PHE  93          HB1       PHE  93  10.441  -3.831  -5.686
  712    HD1  PHE  93           HD1      PHE  93   8.096  -6.176  -7.314
  713    HD2  PHE  93           HD2      PHE  93  12.099  -4.839  -6.926
  714    HE1  PHE  93           HE1      PHE  93   8.685  -7.404  -9.369
  715    HE2  PHE  93           HE2      PHE  93  12.720  -6.069  -8.983
  716    HZ   PHE  93           HZ       PHE  93  11.002  -7.353 -10.205
  717    H    GLU  94           H        GLU  94  11.043  -4.713  -2.497
  718    HA   GLU  94           HA       GLU  94   9.000  -3.052  -1.340
  719   1HB   GLU  94          HB2       GLU  94  11.635  -3.955  -0.149
  720   2HB   GLU  94          HB1       GLU  94  10.316  -3.176   0.690
  721   1HG   GLU  94          HG2       GLU  94   8.984  -5.263  -0.135
  722   2HG   GLU  94          HG1       GLU  94  10.584  -6.004  -0.157
  723    H    GLN  95           H        GLN  95   9.368  -0.924  -0.973
  724    HA   GLN  95           HA       GLN  95  11.750   0.203  -2.300
  725   1HB   GLN  95          HB2       GLN  95   9.324   0.418  -3.341
  726   2HB   GLN  95          HB1       GLN  95   9.125   1.659  -2.115
  727   1HG   GLN  95          HG2       GLN  95  11.023   2.877  -3.001
  728   2HG   GLN  95          HG1       GLN  95  11.311   1.594  -4.167
  729   1HE2  GLN  95          HE21      GLN  95   9.317   4.258  -3.284
  730   2HE2  GLN  95          HE22      GLN  95   8.531   4.445  -4.803
  731    H    THR  96           H        THR  96  13.063   1.094  -0.804
  732    HA   THR  96           HA       THR  96  11.909   2.145   1.725
  733    HB   THR  96           HB       THR  96  14.753   1.662   1.814
  734    HG1  THR  96           HG1      THR  96  13.025  -0.286   0.785
  735   1HG2  THR  96          HG21      THR  96  12.385   0.436   3.273
  736   2HG2  THR  96          HG22      THR  96  13.302   1.812   3.798
  737   3HG2  THR  96          HG23      THR  96  14.068   0.219   3.741
  738    H    ILE  97           H        ILE  97  13.063   3.996   2.669
  739    HA   ILE  97           HA       ILE  97  14.285   5.749   0.614
  740    HB   ILE  97           HB       ILE  97  13.037   6.657   3.223
  741   1HG1  ILE  97          HG12      ILE  97  11.582   6.713   0.630
  742   2HG1  ILE  97          HG11      ILE  97  11.513   5.245   1.552
  743   1HG2  ILE  97          HG21      ILE  97  14.527   8.149   1.814
  744   2HG2  ILE  97          HG22      ILE  97  12.909   8.749   2.070
  745   3HG2  ILE  97          HG23      ILE  97  13.334   8.006   0.516
  746   1HD1  ILE  97          HD11      ILE  97   9.638   6.367   2.052
  747   2HD1  ILE  97          HD12      ILE  97  10.391   7.931   2.191
  748   3HD1  ILE  97          HD13      ILE  97  10.641   6.682   3.457
  749    H    ASN  98           H        ASN  98  15.973   7.040   1.312
  750    HA   ASN  98           HA       ASN  98  17.676   5.790   3.332
  751   1HB   ASN  98          HB2       ASN  98  19.434   7.224   2.166
  752   2HB   ASN  98          HB1       ASN  98  18.738   5.911   1.210
  753   1HD2  ASN  98          HD21      ASN  98  17.235   9.117   1.864
  754   2HD2  ASN  98          HD22      ASN  98  17.251   9.606   0.240
  755    H    ASP  99           H        ASP  99  15.422   7.860   3.708
  756    HA   ASP  99           HA       ASP  99  16.870   9.687   5.474
  757   1HB   ASP  99          HB2       ASP  99  16.917  10.574   3.135
  758   2HB   ASP  99          HB1       ASP  99  15.193  10.724   3.237
  759    H    LEU 100           H        LEU 100  13.870   9.456   3.694
  760    HA   LEU 100           HA       LEU 100  12.172  10.394   5.820
  761   1HB   LEU 100          HB2       LEU 100  11.349   9.139   3.217
  762   2HB   LEU 100          HB1       LEU 100  10.532  10.327   4.201
  763    HG   LEU 100           HG       LEU 100  13.121  11.177   3.047
  764   1HD1  LEU 100          HD11      LEU 100  12.196  10.149   1.098
  765   2HD1  LEU 100          HD12      LEU 100  11.781  11.860   0.986
  766   3HD1  LEU 100          HD13      LEU 100  10.589  10.685   1.548
  767   1HD2  LEU 100          HD21      LEU 100  10.431  12.431   3.293
  768   2HD2  LEU 100          HD22      LEU 100  11.920  13.220   2.813
  769   3HD2  LEU 100          HD23      LEU 100  11.733  12.622   4.487
  770    H    THR 101           H        THR 101  13.710   7.783   5.855
  771    HA   THR 101           HA       THR 101  12.385   5.439   5.603
  772    HB   THR 101           HB       THR 101  14.289   6.165   7.823
  773    HG1  THR 101           HG1      THR 101  15.007   5.512   5.169
  774   1HG2  THR 101          HG21      THR 101  13.492   3.816   7.675
  775   2HG2  THR 101          HG22      THR 101  15.221   3.959   7.330
  776   3HG2  THR 101          HG23      THR 101  14.073   3.752   6.010
  777    H    PHE 102           H        PHE 102  12.155   7.808   8.155
  778    HA   PHE 102           HA       PHE 102  10.822   6.373  10.140
  779   1HB   PHE 102          HB2       PHE 102   9.962   8.660  10.850
  780   2HB   PHE 102          HB1       PHE 102  11.709   8.492  10.728
  781    HD1  PHE 102           HD1      PHE 102  12.930   9.992   9.455
  782    HD2  PHE 102           HD2      PHE 102   8.736   9.734   8.836
  783    HE1  PHE 102           HE1      PHE 102  13.039  11.946   7.967
  784    HE2  PHE 102           HE2      PHE 102   8.835  11.684   7.342
  785    HZ   PHE 102           HZ       PHE 102  10.983  12.794   6.906
  Start of MODEL   16
    1    HA   MET   1           HA       MET   1 -28.409  -1.901  -4.177
    2   1HB   MET   1          HB2       MET   1 -28.111  -3.602  -1.698
    3   2HB   MET   1          HB1       MET   1 -26.885  -2.496  -2.282
    4   1HG   MET   1          HG2       MET   1 -28.465  -0.629  -1.978
    5   2HG   MET   1          HG1       MET   1 -29.636  -1.768  -1.307
    6   1HE   MET   1          HE1       MET   1 -27.706  -3.731   0.380
    7   2HE   MET   1          HE2       MET   1 -29.255  -3.120   0.942
    8   3HE   MET   1          HE3       MET   1 -27.825  -2.971   1.967
    9    H    ALA   2           H        ALA   2 -27.003  -2.464  -5.634
   10    HA   ALA   2           HA       ALA   2 -26.091  -5.232  -5.661
   11   1HB   ALA   2          HB1       ALA   2 -26.733  -3.517  -8.065
   12   2HB   ALA   2          HB2       ALA   2 -27.672  -4.899  -7.499
   13   3HB   ALA   2          HB3       ALA   2 -26.035  -5.136  -8.111
   14    H    HIS   3           H        HIS   3 -24.087  -4.987  -4.851
   15    HA   HIS   3           HA       HIS   3 -22.614  -2.656  -5.633
   16   1HB   HIS   3          HB2       HIS   3 -20.860  -3.323  -4.010
   17   2HB   HIS   3          HB1       HIS   3 -22.435  -3.222  -3.258
   18    HD1  HIS   3           HD1      HIS   3 -23.514  -5.597  -2.543
   19    HD2  HIS   3           HD2      HIS   3 -19.553  -5.683  -3.785
   20    HE1  HIS   3           HE1      HIS   3 -22.591  -7.793  -1.767
   21    H    HIS   4           H        HIS   4 -22.044  -2.705  -7.533
   22    HA   HIS   4           HA       HIS   4 -21.246  -4.975  -9.021
   23   1HB   HIS   4          HB2       HIS   4 -20.713  -3.362 -10.819
   24   2HB   HIS   4          HB1       HIS   4 -22.298  -3.074 -10.116
   25    HD1  HIS   4           HD1      HIS   4 -19.058  -1.396 -10.796
   26    HD2  HIS   4           HD2      HIS   4 -22.414  -0.752  -8.422
   27    HE1  HIS   4           HE1      HIS   4 -18.937   0.992 -10.044
   28    H    HIS   5           H        HIS   5 -19.546  -3.704  -6.640
   29    HA   HIS   5           HA       HIS   5 -17.013  -3.180  -7.825
   30   1HB   HIS   5          HB2       HIS   5 -17.593  -3.866  -4.939
   31   2HB   HIS   5          HB1       HIS   5 -16.123  -3.127  -5.554
   32    HD1  HIS   5           HD1      HIS   5 -17.206  -0.806  -7.238
   33    HD2  HIS   5           HD2      HIS   5 -18.852  -1.956  -3.600
   34    HE1  HIS   5           HE1      HIS   5 -18.513   1.174  -6.393
   35    H    HIS   6           H        HIS   6 -18.604  -6.065  -6.769
   36    HA   HIS   6           HA       HIS   6 -16.138  -7.567  -6.810
   37   1HB   HIS   6          HB2       HIS   6 -17.544  -9.569  -6.326
   38   2HB   HIS   6          HB1       HIS   6 -17.769  -8.285  -5.157
   39    HD1  HIS   6           HD1      HIS   6 -20.208  -8.017  -4.520
   40    HD2  HIS   6           HD2      HIS   6 -19.762  -9.456  -8.402
   41    HE1  HIS   6           HE1      HIS   6 -22.506  -8.407  -5.378
   42    H    HIS   7           H        HIS   7 -18.518  -6.633  -9.033
   43    HA   HIS   7           HA       HIS   7 -17.772  -8.785 -10.857
   44   1HB   HIS   7          HB2       HIS   7 -20.233  -8.347 -10.398
   45   2HB   HIS   7          HB1       HIS   7 -20.034  -6.788 -11.186
   46    HD1  HIS   7           HD1      HIS   7 -20.905  -6.906 -13.566
   47    HD2  HIS   7           HD2      HIS   7 -19.163 -10.468 -12.314
   48    HE1  HIS   7           HE1      HIS   7 -21.117  -8.496 -15.483
   49    H    HIS   8           H        HIS   8 -16.018  -8.240 -11.876
   50    HA   HIS   8           HA       HIS   8 -14.454  -7.194 -13.049
   51   1HB   HIS   8          HB2       HIS   8 -16.643  -5.235 -13.863
   52   2HB   HIS   8          HB1       HIS   8 -15.039  -5.299 -14.571
   53    HD1  HIS   8           HD1      HIS   8 -14.940  -6.622 -16.722
   54    HD2  HIS   8           HD2      HIS   8 -18.089  -7.792 -14.284
   55    HE1  HIS   8           HE1      HIS   8 -16.260  -8.295 -18.045
   56    H    ASN   9           H        ASN   9 -13.397  -6.767 -11.149
   57    HA   ASN   9           HA       ASN   9 -13.702  -4.078 -10.050
   58   1HB   ASN   9          HB2       ASN   9 -13.553  -6.076  -8.503
   59   2HB   ASN   9          HB1       ASN   9 -11.896  -6.302  -9.055
   60   1HD2  ASN   9          HD21      ASN   9 -14.033  -4.468  -7.122
   61   2HD2  ASN   9          HD22      ASN   9 -12.874  -3.509  -6.279
   62    H    GLN  10           H        GLN  10 -12.856  -3.010 -11.802
   63    HA   GLN  10           HA       GLN  10  -9.963  -3.346 -12.217
   64   1HB   GLN  10          HB2       GLN  10 -11.347  -3.982 -14.164
   65   2HB   GLN  10          HB1       GLN  10 -12.078  -2.391 -14.155
   66   1HG   GLN  10          HG2       GLN  10  -9.953  -1.380 -14.730
   67   2HG   GLN  10          HG1       GLN  10  -9.169  -2.956 -14.657
   68   1HE2  GLN  10          HE21      GLN  10  -9.464  -1.048 -16.852
   69   2HE2  GLN  10          HE22      GLN  10 -10.177  -1.949 -18.144
   70    H    GLN  11           H        GLN  11 -12.323  -1.415 -10.921
   71    HA   GLN  11           HA       GLN  11 -11.239   1.131 -11.614
   72   1HB   GLN  11          HB2       GLN  11 -13.628   0.895 -11.104
   73   2HB   GLN  11          HB1       GLN  11 -13.233   0.379  -9.471
   74   1HG   GLN  11          HG2       GLN  11 -12.211   2.587  -9.058
   75   2HG   GLN  11          HG1       GLN  11 -12.698   3.088 -10.674
   76   1HE2  GLN  11          HE21      GLN  11 -13.748   2.349  -7.478
   77   2HE2  GLN  11          HE22      GLN  11 -15.341   2.967  -7.628
   78    H    ASN  12           H        ASN  12  -9.167   1.186 -11.019
   79    HA   ASN  12           HA       ASN  12  -8.406   0.717  -8.281
   80   1HB   ASN  12          HB2       ASN  12  -6.877   1.777 -10.676
   81   2HB   ASN  12          HB1       ASN  12  -6.178   1.694  -9.071
   82   1HD2  ASN  12          HD21      ASN  12  -7.273  -0.130 -11.810
   83   2HD2  ASN  12          HD22      ASN  12  -6.535  -1.620 -11.345
   84    H    LYS  13           H        LYS  13  -9.355   2.077  -6.996
   85    HA   LYS  13           HA       LYS  13 -10.297   4.611  -7.542
   86   1HB   LYS  13          HB2       LYS  13 -10.472   4.965  -5.123
   87   2HB   LYS  13          HB1       LYS  13 -11.106   3.416  -5.646
   88   1HG   LYS  13          HG2       LYS  13  -9.198   2.251  -4.788
   89   2HG   LYS  13          HG1       LYS  13  -8.367   3.761  -4.436
   90   1HD   LYS  13          HD2       LYS  13 -10.982   2.953  -3.162
   91   2HD   LYS  13          HD1       LYS  13  -9.404   2.639  -2.434
   92   1HE   LYS  13          HE2       LYS  13  -8.935   5.042  -2.420
   93   2HE   LYS  13          HE1       LYS  13 -10.494   5.354  -3.171
   94   1HZ   LYS  13          HZ1       LYS  13 -10.332   5.697  -0.749
   95   2HZ   LYS  13          HZ2       LYS  13 -10.250   4.021  -0.529
   96   3HZ   LYS  13          HZ3       LYS  13 -11.617   4.731  -1.225
   97    H    LYS  14           H        LYS  14  -7.111   3.710  -6.663
   98    HA   LYS  14           HA       LYS  14  -5.158   4.779  -6.750
   99   1HB   LYS  14          HB2       LYS  14  -6.364   6.454  -8.405
  100   2HB   LYS  14          HB1       LYS  14  -6.458   7.517  -7.018
  101   1HG   LYS  14          HG2       LYS  14  -3.909   6.460  -8.262
  102   2HG   LYS  14          HG1       LYS  14  -4.572   8.076  -8.486
  103   1HD   LYS  14          HD2       LYS  14  -4.233   8.589  -6.171
  104   2HD   LYS  14          HD1       LYS  14  -3.775   6.927  -5.831
  105   1HE   LYS  14          HE2       LYS  14  -1.793   8.213  -5.912
  106   2HE   LYS  14          HE1       LYS  14  -1.846   7.225  -7.365
  107   1HZ   LYS  14          HZ1       LYS  14  -1.130   9.504  -7.741
  108   2HZ   LYS  14          HZ2       LYS  14  -2.595  10.094  -7.205
  109   3HZ   LYS  14          HZ3       LYS  14  -2.532   9.178  -8.630
  110    H    VAL  15           H        VAL  15  -4.065   4.832  -5.055
  111    HA   VAL  15           HA       VAL  15  -4.820   5.019  -2.487
  112    HB   VAL  15           HB       VAL  15  -2.667   4.251  -3.644
  113   1HG1  VAL  15          HG11      VAL  15  -0.730   5.731  -3.374
  114   2HG1  VAL  15          HG12      VAL  15  -1.854   7.044  -3.064
  115   3HG1  VAL  15          HG13      VAL  15  -1.878   6.219  -4.633
  116   1HG2  VAL  15          HG21      VAL  15  -1.357   4.303  -1.585
  117   2HG2  VAL  15          HG22      VAL  15  -3.050   3.929  -1.251
  118   3HG2  VAL  15          HG23      VAL  15  -2.424   5.543  -0.945
  119    H    GLU  16           H        GLU  16  -5.383   6.623  -1.107
  120    HA   GLU  16           HA       GLU  16  -5.245   9.397  -2.019
  121   1HB   GLU  16          HB2       GLU  16  -6.699   8.223   0.354
  122   2HB   GLU  16          HB1       GLU  16  -6.964   9.802  -0.379
  123   1HG   GLU  16          HG2       GLU  16  -7.809   8.791  -2.382
  124   2HG   GLU  16          HG1       GLU  16  -7.359   7.196  -1.783
  125    H    GLY  17           H        GLY  17  -5.053   8.136   1.279
  126   1HA   GLY  17          HA2       GLY  17  -2.442   9.419   1.499
  127   2HA   GLY  17          HA1       GLY  17  -3.725  10.057   2.526
  128    H    GLY  18           H        GLY  18  -4.317   6.881   2.190
  129   1HA   GLY  18          HA2       GLY  18  -2.818   6.229   4.631
  130   2HA   GLY  18          HA1       GLY  18  -4.420   5.616   4.243
  131    H    TYR  19           H        TYR  19  -3.598   3.460   4.510
  132    HA   TYR  19           HA       TYR  19  -1.653   2.654   2.483
  133   1HB   TYR  19          HB2       TYR  19  -2.655   1.056   4.830
  134   2HB   TYR  19          HB1       TYR  19  -1.186   0.772   3.887
  135    HD1  TYR  19           HD1      TYR  19   0.442   2.928   3.858
  136    HD2  TYR  19           HD2      TYR  19  -2.413   2.034   6.882
  137    HE1  TYR  19           HE1      TYR  19   1.602   4.432   5.415
  138    HE2  TYR  19           HE2      TYR  19  -1.273   3.508   8.417
  139    HH   TYR  19           HH       TYR  19   0.728   4.595   8.768
  140    H    GLU  20           H        GLU  20  -2.458   2.087   0.710
  141    HA   GLU  20           HA       GLU  20  -5.079   0.915   0.378
  142   1HB   GLU  20          HB2       GLU  20  -4.272   2.492  -1.251
  143   2HB   GLU  20          HB1       GLU  20  -2.800   1.554  -1.523
  144   1HG   GLU  20          HG2       GLU  20  -4.423  -0.273  -2.333
  145   2HG   GLU  20          HG1       GLU  20  -5.626   1.009  -2.379
  146    H    CYS  21           H        CYS  21  -5.307  -1.128   0.715
  147    HA   CYS  21           HA       CYS  21  -3.302  -3.134   0.869
  148   1HB   CYS  21          HB2       CYS  21  -6.203  -3.283   0.179
  149   2HB   CYS  21          HB1       CYS  21  -5.213  -4.736   0.279
  150    H    LYS  22           H        LYS  22  -2.270  -4.357  -0.749
  151    HA   LYS  22           HA       LYS  22  -2.732  -3.915  -3.537
  152   1HB   LYS  22          HB2       LYS  22  -0.584  -4.638  -2.582
  153   2HB   LYS  22          HB1       LYS  22  -1.302  -6.164  -2.078
  154   1HG   LYS  22          HG2       LYS  22  -1.842  -6.150  -4.752
  155   2HG   LYS  22          HG1       LYS  22  -0.307  -5.283  -4.709
  156   1HD   LYS  22          HD2       LYS  22   0.157  -7.629  -5.022
  157   2HD   LYS  22          HD1       LYS  22   0.636  -7.202  -3.378
  158   1HE   LYS  22          HE2       LYS  22  -1.368  -8.164  -2.471
  159   2HE   LYS  22          HE1       LYS  22  -2.041  -8.400  -4.079
  160   1HZ   LYS  22          HZ1       LYS  22  -1.255 -10.438  -3.165
  161   2HZ   LYS  22          HZ2       LYS  22   0.326  -9.883  -2.958
  162   3HZ   LYS  22          HZ3       LYS  22  -0.352 -10.047  -4.504
  163    H    TYR  23           H        TYR  23  -4.342  -5.633  -1.155
  164    HA   TYR  23           HA       TYR  23  -4.834  -8.070  -2.672
  165   1HB   TYR  23          HB2       TYR  23  -5.839  -7.606   0.091
  166   2HB   TYR  23          HB1       TYR  23  -5.236  -9.083  -0.647
  167    HD1  TYR  23           HD1      TYR  23  -4.463  -6.353   1.496
  168    HD2  TYR  23           HD2      TYR  23  -2.707  -9.175  -1.118
  169    HE1  TYR  23           HE1      TYR  23  -2.299  -5.966   2.574
  170    HE2  TYR  23           HE2      TYR  23  -0.520  -8.806  -0.036
  171    HH   TYR  23           HH       TYR  23  -0.168  -7.186   2.883
  172    H    CYS  24           H        CYS  24  -6.282  -5.251  -1.651
  173    HA   CYS  24           HA       CYS  24  -8.845  -5.951  -2.755
  174   1HB   CYS  24          HB2       CYS  24 -10.076  -5.430  -0.657
  175   2HB   CYS  24          HB1       CYS  24  -8.973  -6.806  -0.494
  176    H    THR  25           H        THR  25 -10.113  -3.985  -3.115
  177    HA   THR  25           HA       THR  25  -8.361  -1.701  -3.240
  178    HB   THR  25           HB       THR  25 -11.226  -1.924  -4.222
  179    HG1  THR  25           HG1      THR  25  -9.360  -3.348  -5.042
  180   1HG2  THR  25          HG21      THR  25 -10.378   0.383  -4.003
  181   2HG2  THR  25          HG22      THR  25 -10.582  -0.059  -5.699
  182   3HG2  THR  25          HG23      THR  25  -8.972  -0.050  -4.976
  183    H    PHE  26           H        PHE  26  -8.237  -1.620  -0.968
  184    HA   PHE  26           HA       PHE  26 -10.212   0.143   0.197
  185   1HB   PHE  26          HB2       PHE  26 -10.987  -2.092   0.894
  186   2HB   PHE  26          HB1       PHE  26  -9.378  -2.476   1.485
  187    HD1  PHE  26           HD1      PHE  26  -8.750  -1.931   3.691
  188    HD2  PHE  26           HD2      PHE  26 -12.269  -0.210   2.020
  189    HE1  PHE  26           HE1      PHE  26  -9.344  -1.025   5.894
  190    HE2  PHE  26           HE2      PHE  26 -12.866   0.702   4.225
  191    HZ   PHE  26           HZ       PHE  26 -11.406   0.294   6.165
  192    H    GLN  27           H        GLN  27  -9.297   1.501   1.642
  193    HA   GLN  27           HA       GLN  27  -6.508   1.115   2.282
  194   1HB   GLN  27          HB2       GLN  27  -6.082   2.648   0.632
  195   2HB   GLN  27          HB1       GLN  27  -7.724   3.265   0.679
  196   1HG   GLN  27          HG2       GLN  27  -7.227   4.650   2.577
  197   2HG   GLN  27          HG1       GLN  27  -5.697   3.789   2.746
  198   1HE2  GLN  27          HE21      GLN  27  -4.588   3.831   0.595
  199   2HE2  GLN  27          HE22      GLN  27  -4.215   5.355  -0.098
  200    H    THR  28           H        THR  28  -5.908   1.904   4.183
  201    HA   THR  28           HA       THR  28  -7.668   3.632   5.660
  202    HB   THR  28           HB       THR  28  -8.337   1.420   6.513
  203    HG1  THR  28           HG1      THR  28  -8.471   2.562   8.255
  204   1HG2  THR  28          HG21      THR  28  -6.255   0.169   5.992
  205   2HG2  THR  28          HG22      THR  28  -6.748  -0.047   7.675
  206   3HG2  THR  28          HG23      THR  28  -5.436   1.047   7.284
  207    HA   PRO  29           HA       PRO  29  -3.635   5.403   6.286
  208   1HB   PRO  29          HB2       PRO  29  -4.502   7.538   7.760
  209   2HB   PRO  29          HB1       PRO  29  -4.524   7.471   5.995
  210   1HG   PRO  29          HG2       PRO  29  -6.748   7.063   7.932
  211   2HG   PRO  29          HG1       PRO  29  -6.752   7.820   6.324
  212   1HD   PRO  29          HD2       PRO  29  -7.673   5.283   6.802
  213   2HD   PRO  29          HD1       PRO  29  -7.004   5.809   5.240
  214    H    ASP  30           H        ASP  30  -5.625   4.018   8.583
  215    HA   ASP  30           HA       ASP  30  -3.740   4.523  10.751
  216   1HB   ASP  30          HB2       ASP  30  -6.357   3.039  10.635
  217   2HB   ASP  30          HB1       ASP  30  -5.290   2.937  12.032
  218    H    LEU  31           H        LEU  31  -1.984   3.333  10.792
  219    HA   LEU  31           HA       LEU  31  -1.458   1.072   9.295
  220   1HB   LEU  31          HB2       LEU  31   0.041   2.754  10.702
  221   2HB   LEU  31          HB1       LEU  31  -0.131   1.526  11.934
  222    HG   LEU  31           HG       LEU  31   1.970   1.156  10.851
  223   1HD1  LEU  31          HD11      LEU  31   1.767  -1.054   9.865
  224   2HD1  LEU  31          HD12      LEU  31   0.030  -0.777   9.691
  225   3HD1  LEU  31          HD13      LEU  31   0.739  -0.901  11.307
  226   1HD2  LEU  31          HD21      LEU  31   2.187   0.852   8.435
  227   2HD2  LEU  31          HD22      LEU  31   1.543   2.449   8.878
  228   3HD2  LEU  31          HD23      LEU  31   0.457   1.203   8.283
  229    H    ASN  32           H        ASN  32  -2.618   1.503  12.643
  230    HA   ASN  32           HA       ASN  32  -2.473  -1.075  13.600
  231   1HB   ASN  32          HB2       ASN  32  -3.180   1.198  14.751
  232   2HB   ASN  32          HB1       ASN  32  -4.765   0.707  14.135
  233   1HD2  ASN  32          HD21      ASN  32  -4.408  -2.142  14.603
  234   2HD2  ASN  32          HD22      ASN  32  -4.456  -2.339  16.298
  235    H    MET  33           H        MET  33  -4.956   0.597  11.756
  236    HA   MET  33           HA       MET  33  -6.752  -1.640  11.823
  237   1HB   MET  33          HB2       MET  33  -6.818   0.835  10.110
  238   2HB   MET  33          HB1       MET  33  -8.104  -0.354  10.220
  239   1HG   MET  33          HG2       MET  33  -7.031   1.334  12.403
  240   2HG   MET  33          HG1       MET  33  -8.565   1.613  11.560
  241   1HE   MET  33          HE1       MET  33 -10.536  -1.690  12.691
  242   2HE   MET  33          HE2       MET  33  -9.432  -1.602  11.326
  243   3HE   MET  33          HE3       MET  33 -10.571  -0.285  11.623
  244    H    PHE  34           H        PHE  34  -4.445  -0.264   9.634
  245    HA   PHE  34           HA       PHE  34  -5.028  -1.838   7.405
  246   1HB   PHE  34          HB2       PHE  34  -3.578   0.049   7.134
  247   2HB   PHE  34          HB1       PHE  34  -2.448  -0.565   8.313
  248    HD1  PHE  34           HD1      PHE  34  -3.860  -1.288   4.882
  249    HD2  PHE  34           HD2      PHE  34  -0.695  -1.939   7.694
  250    HE1  PHE  34           HE1      PHE  34  -2.562  -2.402   3.153
  251    HE2  PHE  34           HE2      PHE  34   0.619  -3.066   5.921
  252    HZ   PHE  34           HZ       PHE  34  -0.324  -3.293   3.656
  253    H    THR  35           H        THR  35  -2.586  -2.364   9.911
  254    HA   THR  35           HA       THR  35  -1.887  -4.882   8.831
  255    HB   THR  35           HB       THR  35  -0.196  -3.735  10.133
  256    HG1  THR  35           HG1      THR  35  -0.357  -6.100  10.191
  257   1HG2  THR  35          HG21      THR  35  -0.370  -3.491  12.584
  258   2HG2  THR  35          HG22      THR  35  -2.048  -4.057  12.499
  259   3HG2  THR  35          HG23      THR  35  -1.566  -2.557  11.687
  260    H    PHE  36           H        PHE  36  -4.267  -3.886  11.104
  261    HA   PHE  36           HA       PHE  36  -4.901  -6.459  12.099
  262   1HB   PHE  36          HB2       PHE  36  -5.723  -4.744  13.401
  263   2HB   PHE  36          HB1       PHE  36  -6.314  -3.794  12.057
  264    HD1  PHE  36           HD1      PHE  36  -8.578  -3.818  11.639
  265    HD2  PHE  36           HD2      PHE  36  -6.841  -7.056  13.740
  266    HE1  PHE  36           HE1      PHE  36 -10.836  -4.747  12.037
  267    HE2  PHE  36           HE2      PHE  36  -9.084  -8.004  14.166
  268    HZ   PHE  36           HZ       PHE  36 -11.085  -6.845  13.306
  269    H    HIS  37           H        HIS  37  -6.428  -4.432   9.641
  270    HA   HIS  37           HA       HIS  37  -8.256  -6.290   8.671
  271   1HB   HIS  37          HB2       HIS  37  -8.649  -4.062   8.139
  272   2HB   HIS  37          HB1       HIS  37  -7.006  -3.760   7.643
  273    HD1  HIS  37           HD1      HIS  37 -10.321  -5.006   6.397
  274    HD2  HIS  37           HD2      HIS  37  -6.492  -4.288   4.978
  275    HE1  HIS  37           HE1      HIS  37 -10.504  -5.066   3.878
  276    H    VAL  38           H        VAL  38  -4.900  -5.812   7.956
  277    HA   VAL  38           HA       VAL  38  -4.893  -7.622   5.772
  278    HB   VAL  38           HB       VAL  38  -2.717  -6.384   7.417
  279   1HG1  VAL  38          HG11      VAL  38  -2.379  -8.260   5.035
  280   2HG1  VAL  38          HG12      VAL  38  -1.926  -8.636   6.696
  281   3HG1  VAL  38          HG13      VAL  38  -1.066  -7.373   5.814
  282   1HG2  VAL  38          HG21      VAL  38  -3.527  -6.087   4.532
  283   2HG2  VAL  38          HG22      VAL  38  -2.179  -5.243   5.300
  284   3HG2  VAL  38          HG23      VAL  38  -3.833  -4.950   5.843
  285    H    ASP  39           H        ASP  39  -3.824  -7.900   9.181
  286    HA   ASP  39           HA       ASP  39  -2.984 -10.576   8.889
  287   1HB   ASP  39          HB2       ASP  39  -2.212  -9.146  10.719
  288   2HB   ASP  39          HB1       ASP  39  -3.842  -9.069  11.367
  289    H    SER  40           H        SER  40  -6.013  -9.138   9.415
  290    HA   SER  40           HA       SER  40  -7.288 -11.586  10.264
  291   1HB   SER  40          HB2       SER  40  -7.987  -9.387  11.156
  292   2HB   SER  40          HB1       SER  40  -8.496  -8.917   9.544
  293    HG   SER  40           HG       SER  40 -10.128 -10.336   9.594
  294    H    GLU  41           H        GLU  41  -7.306  -9.539   7.328
  295    HA   GLU  41           HA       GLU  41  -9.212 -11.466   6.190
  296   1HB   GLU  41          HB2       GLU  41  -8.495  -8.746   5.101
  297   2HB   GLU  41          HB1       GLU  41  -9.798  -9.792   4.556
  298   1HG   GLU  41          HG2       GLU  41  -9.592  -8.421   7.235
  299   2HG   GLU  41          HG1       GLU  41 -10.671  -7.986   5.917
  300    H    HIS  42           H        HIS  42  -5.992 -10.200   5.647
  301    HA   HIS  42           HA       HIS  42  -5.567 -12.201   3.571
  302   1HB   HIS  42          HB2       HIS  42  -4.177  -9.773   2.804
  303   2HB   HIS  42          HB1       HIS  42  -5.221 -10.753   1.815
  304    HD1  HIS  42           HD1      HIS  42  -7.766  -9.901   1.652
  305    HD2  HIS  42           HD2      HIS  42  -5.162  -7.377   3.696
  306    HE1  HIS  42           HE1      HIS  42  -8.924  -7.691   1.784
  307    HA   PRO  43           HA       PRO  43  -2.327 -11.448   6.931
  308   1HB   PRO  43          HB2       PRO  43  -1.914 -14.080   7.594
  309   2HB   PRO  43          HB1       PRO  43  -3.161 -13.052   8.326
  310   1HG   PRO  43          HG2       PRO  43  -3.425 -15.018   6.088
  311   2HG   PRO  43          HG1       PRO  43  -4.468 -14.811   7.506
  312   1HD   PRO  43          HD2       PRO  43  -5.147 -13.801   5.125
  313   2HD   PRO  43          HD1       PRO  43  -5.482 -12.911   6.627
  314    H    ASN  44           H        ASN  44  -2.287 -14.082   4.585
  315    HA   ASN  44           HA       ASN  44   0.154 -13.044   3.563
  316   1HB   ASN  44          HB2       ASN  44   1.273 -15.304   3.464
  317   2HB   ASN  44          HB1       ASN  44   1.152 -14.628   5.066
  318   1HD2  ASN  44          HD21      ASN  44  -1.521 -16.335   3.447
  319   2HD2  ASN  44          HD22      ASN  44  -1.503 -17.681   4.519
  320    H    VAL  45           H        VAL  45   0.289 -13.218   1.462
  321    HA   VAL  45           HA       VAL  45  -1.824 -14.741   0.078
  322    HB   VAL  45           HB       VAL  45  -2.130 -12.809  -1.469
  323   1HG1  VAL  45          HG11      VAL  45  -3.504 -11.457   0.015
  324   2HG1  VAL  45          HG12      VAL  45  -2.735 -12.237   1.410
  325   3HG1  VAL  45          HG13      VAL  45  -3.722 -13.191   0.290
  326   1HG2  VAL  45          HG21      VAL  45  -1.355 -10.603  -0.790
  327   2HG2  VAL  45          HG22      VAL  45  -0.003 -11.706  -1.043
  328   3HG2  VAL  45          HG23      VAL  45  -0.526 -11.312   0.592
  329    H    VAL  46           H        VAL  46  -1.378 -14.378  -2.393
  330    HA   VAL  46           HA       VAL  46   1.455 -14.324  -2.837
  331    HB   VAL  46           HB       VAL  46   0.678 -16.700  -2.621
  332   1HG1  VAL  46          HG11      VAL  46  -0.968 -16.141  -5.058
  333   2HG1  VAL  46          HG12      VAL  46  -1.549 -16.500  -3.432
  334   3HG1  VAL  46          HG13      VAL  46  -0.686 -17.733  -4.353
  335   1HG2  VAL  46          HG21      VAL  46   1.717 -17.606  -4.657
  336   2HG2  VAL  46          HG22      VAL  46   2.653 -16.280  -3.965
  337   3HG2  VAL  46          HG23      VAL  46   1.644 -16.005  -5.388
  338    H    LEU  47           H        LEU  47   1.799 -14.059  -5.415
  339    HA   LEU  47           HA       LEU  47  -0.359 -13.403  -7.055
  340   1HB   LEU  47          HB2       LEU  47  -0.491 -11.371  -5.650
  341   2HB   LEU  47          HB1       LEU  47   1.159 -10.961  -6.058
  342    HG   LEU  47           HG       LEU  47   0.424 -10.767  -8.453
  343   1HD1  LEU  47          HD11      LEU  47  -1.971 -10.506  -8.897
  344   2HD1  LEU  47          HD12      LEU  47  -2.325 -11.012  -7.247
  345   3HD1  LEU  47          HD13      LEU  47  -1.568 -12.139  -8.370
  346   1HD2  LEU  47          HD21      LEU  47   0.702  -8.792  -7.047
  347   2HD2  LEU  47          HD22      LEU  47  -0.957  -8.965  -6.471
  348   3HD2  LEU  47          HD23      LEU  47  -0.646  -8.586  -8.164
  349    H    ASN  48           H        ASN  48   2.511 -11.412  -7.164
  350    HA   ASN  48           HA       ASN  48   4.283 -13.050  -8.475
  351   1HB   ASN  48          HB2       ASN  48   2.681 -13.181 -10.345
  352   2HB   ASN  48          HB1       ASN  48   2.600 -11.427 -10.424
  353   1HD2  ASN  48          HD21      ASN  48   4.582 -14.239 -11.061
  354   2HD2  ASN  48          HD22      ASN  48   5.688 -13.444 -12.108
  355    H    SER  49           H        SER  49   3.221  -9.697  -9.328
  356    HA   SER  49           HA       SER  49   5.698  -8.795  -8.062
  357   1HB   SER  49          HB2       SER  49   4.704  -7.941 -10.785
  358   2HB   SER  49          HB1       SER  49   6.116  -7.295  -9.954
  359    HG   SER  49           HG       SER  49   5.707  -9.925 -10.933
  360    H    SER  50           H        SER  50   5.489  -6.982  -6.848
  361    HA   SER  50           HA       SER  50   3.666  -4.925  -7.377
  362   1HB   SER  50          HB2       SER  50   2.064  -6.524  -6.292
  363   2HB   SER  50          HB1       SER  50   3.177  -6.684  -4.939
  364    HG   SER  50           HG       SER  50   1.459  -4.539  -5.548
  365    H    TYR  51           H        TYR  51   3.844  -3.458  -5.307
  366    HA   TYR  51           HA       TYR  51   6.637  -3.509  -4.446
  367   1HB   TYR  51          HB2       TYR  51   4.990  -1.241  -5.473
  368   2HB   TYR  51          HB1       TYR  51   6.354  -0.997  -4.407
  369    HD1  TYR  51           HD1      TYR  51   6.474  -3.532  -7.115
  370    HD2  TYR  51           HD2      TYR  51   7.491   0.420  -5.939
  371    HE1  TYR  51           HE1      TYR  51   7.918  -3.323  -9.090
  372    HE2  TYR  51           HE2      TYR  51   8.954   0.634  -7.903
  373    HH   TYR  51           HH       TYR  51  10.144  -0.769  -9.485
  374    H    VAL  52           H        VAL  52   6.969  -2.801  -2.413
  375    HA   VAL  52           HA       VAL  52   4.624  -2.089  -0.816
  376    HB   VAL  52           HB       VAL  52   5.055  -4.494  -0.508
  377   1HG1  VAL  52          HG11      VAL  52   7.745  -3.685   0.483
  378   2HG1  VAL  52          HG12      VAL  52   7.387  -4.501  -1.043
  379   3HG1  VAL  52          HG13      VAL  52   7.063  -5.314   0.484
  380   1HG2  VAL  52          HG21      VAL  52   4.240  -3.330   1.421
  381   2HG2  VAL  52          HG22      VAL  52   5.893  -2.937   1.910
  382   3HG2  VAL  52          HG23      VAL  52   5.345  -4.615   1.897
  383    H    CYS  53           H        CYS  53   5.006  -0.515   0.604
  384    HA   CYS  53           HA       CYS  53   7.629   0.810   0.623
  385   1HB   CYS  53          HB2       CYS  53   5.678   2.243   0.705
  386   2HB   CYS  53          HB1       CYS  53   5.013   1.353   2.060
  387    H    VAL  54           H        VAL  54   9.080  -0.503   1.656
  388    HA   VAL  54           HA       VAL  54   8.565  -2.340   3.641
  389    HB   VAL  54           HB       VAL  54  11.109  -1.066   4.115
  390   1HG1  VAL  54          HG11      VAL  54  11.971  -3.177   3.596
  391   2HG1  VAL  54          HG12      VAL  54  10.465  -3.611   2.810
  392   3HG1  VAL  54          HG13      VAL  54  10.502  -3.405   4.589
  393   1HG2  VAL  54          HG21      VAL  54  10.421  -1.683   1.266
  394   2HG2  VAL  54          HG22      VAL  54  12.073  -1.624   1.868
  395   3HG2  VAL  54          HG23      VAL  54  11.049  -0.193   1.942
  396    H    GLU  55           H        GLU  55   9.124   1.046   3.841
  397    HA   GLU  55           HA       GLU  55   9.684   1.422   6.510
  398   1HB   GLU  55          HB2       GLU  55   7.993   3.271   4.835
  399   2HB   GLU  55          HB1       GLU  55   9.027   3.705   6.185
  400   1HG   GLU  55          HG2       GLU  55  10.010   2.633   3.542
  401   2HG   GLU  55          HG1       GLU  55   9.949   4.329   3.983
  402    H    CYS  56           H        CYS  56   6.677   1.181   4.788
  403    HA   CYS  56           HA       CYS  56   5.085   1.370   7.321
  404   1HB   CYS  56          HB2       CYS  56   4.030   1.237   4.512
  405   2HB   CYS  56          HB1       CYS  56   3.187   1.824   5.949
  406    H    ASN  57           H        ASN  57   6.328  -0.808   5.163
  407    HA   ASN  57           HA       ASN  57   6.026  -2.889   4.415
  408   1HB   ASN  57          HB2       ASN  57   5.945  -3.117   7.189
  409   2HB   ASN  57          HB1       ASN  57   4.434  -3.832   6.633
  410   1HD2  ASN  57          HD21      ASN  57   7.217  -3.946   4.811
  411   2HD2  ASN  57          HD22      ASN  57   7.374  -5.675   4.912
  412    H    PHE  58           H        PHE  58   4.372  -1.368   3.223
  413    HA   PHE  58           HA       PHE  58   1.804  -2.672   3.487
  414   1HB   PHE  58          HB2       PHE  58   0.590  -0.747   3.671
  415   2HB   PHE  58          HB1       PHE  58   2.117  -0.016   4.115
  416    HD1  PHE  58           HD1      PHE  58   3.216   1.537   2.592
  417    HD2  PHE  58           HD2      PHE  58  -0.386  -0.389   1.486
  418    HE1  PHE  58           HE1      PHE  58   2.936   3.138   0.682
  419    HE2  PHE  58           HE2      PHE  58  -0.663   1.228  -0.384
  420    HZ   PHE  58           HZ       PHE  58   1.017   2.957  -0.763
  421    H    LEU  59           H        LEU  59   1.088  -3.576   1.696
  422    HA   LEU  59           HA       LEU  59   2.590  -3.224  -0.764
  423   1HB   LEU  59          HB2       LEU  59   1.014  -5.362   0.468
  424   2HB   LEU  59          HB1       LEU  59   0.779  -5.203  -1.250
  425    HG   LEU  59           HG       LEU  59   3.474  -5.629   0.042
  426   1HD1  LEU  59          HD11      LEU  59   1.971  -7.492   0.445
  427   2HD1  LEU  59          HD12      LEU  59   3.125  -7.966  -0.817
  428   3HD1  LEU  59          HD13      LEU  59   1.470  -7.470  -1.233
  429   1HD2  LEU  59          HD21      LEU  59   2.529  -5.822  -2.845
  430   2HD2  LEU  59          HD22      LEU  59   4.127  -6.233  -2.271
  431   3HD2  LEU  59          HD23      LEU  59   3.576  -4.574  -2.185
  432    H    THR  60           H        THR  60   1.604  -2.376  -2.558
  433    HA   THR  60           HA       THR  60  -1.235  -1.668  -2.344
  434    HB   THR  60           HB       THR  60  -0.258   0.398  -2.025
  435    HG1  THR  60           HG1      THR  60  -1.596   0.609  -3.927
  436   1HG2  THR  60          HG21      THR  60   1.823   1.193  -3.077
  437   2HG2  THR  60          HG22      THR  60   1.918  -0.317  -3.982
  438   3HG2  THR  60          HG23      THR  60   2.026  -0.327  -2.224
  439    H    LYS  61           H        LYS  61  -2.243  -1.279  -4.532
  440    HA   LYS  61           HA       LYS  61  -1.105  -3.308  -6.273
  441   1HB   LYS  61          HB2       LYS  61  -3.312  -3.626  -7.219
  442   2HB   LYS  61          HB1       LYS  61  -3.380  -3.786  -5.483
  443   1HG   LYS  61          HG2       LYS  61  -4.215  -1.369  -5.462
  444   2HG   LYS  61          HG1       LYS  61  -4.425  -1.564  -7.204
  445   1HD   LYS  61          HD2       LYS  61  -5.743  -3.185  -5.014
  446   2HD   LYS  61          HD1       LYS  61  -6.523  -2.052  -6.110
  447   1HE   LYS  61          HE2       LYS  61  -5.199  -4.654  -6.924
  448   2HE   LYS  61          HE1       LYS  61  -6.924  -4.409  -6.711
  449   1HZ   LYS  61          HZ1       LYS  61  -6.235  -4.307  -9.035
  450   2HZ   LYS  61          HZ2       LYS  61  -5.271  -2.953  -8.726
  451   3HZ   LYS  61          HZ3       LYS  61  -6.932  -2.870  -8.531
  452    H    ARG  62           H        ARG  62  -0.631  -0.268  -5.994
  453    HA   ARG  62           HA       ARG  62  -0.245   0.023  -8.855
  454   1HB   ARG  62          HB2       ARG  62  -0.863   2.405  -8.802
  455   2HB   ARG  62          HB1       ARG  62  -2.225   1.354  -8.478
  456   1HG   ARG  62          HG2       ARG  62  -2.170   1.901  -6.139
  457   2HG   ARG  62          HG1       ARG  62  -0.646   2.761  -6.342
  458   1HD   ARG  62          HD2       ARG  62  -2.590   4.272  -6.209
  459   2HD   ARG  62          HD1       ARG  62  -1.694   4.441  -7.703
  460    HE   ARG  62           HE       ARG  62  -4.280   3.089  -7.380
  461   1HH1  ARG  62          HH11      ARG  62  -1.820   4.399  -9.678
  462   2HH1  ARG  62          HH12      ARG  62  -2.973   4.757 -10.848
  463   1HH2  ARG  62          HH21      ARG  62  -5.840   3.621  -9.170
  464   2HH2  ARG  62          HH22      ARG  62  -5.229   4.271 -10.604
  465    H    TYR  63           H        TYR  63   1.587   1.018  -9.449
  466    HA   TYR  63           HA       TYR  63   3.738   0.990  -7.619
  467   1HB   TYR  63          HB2       TYR  63   5.107   1.796  -9.485
  468   2HB   TYR  63          HB1       TYR  63   4.006   0.550 -10.053
  469    HD1  TYR  63           HD1      TYR  63   4.944   4.057 -10.263
  470    HD2  TYR  63           HD2      TYR  63   2.073   1.173 -11.499
  471    HE1  TYR  63           HE1      TYR  63   4.125   5.617 -11.950
  472    HE2  TYR  63           HE2      TYR  63   1.243   2.734 -13.210
  473    HH   TYR  63           HH       TYR  63   1.197   5.138 -13.589
  474    H    ASP  64           H        ASP  64   1.539   3.438  -8.636
  475    HA   ASP  64           HA       ASP  64   2.922   5.826  -8.239
  476   1HB   ASP  64          HB2       ASP  64   0.030   5.395  -7.515
  477   2HB   ASP  64          HB1       ASP  64   0.801   6.908  -7.926
  478    H    ALA  65           H        ALA  65   1.218   3.795  -5.970
  479    HA   ALA  65           HA       ALA  65   1.040   5.664  -3.924
  480   1HB   ALA  65          HB1       ALA  65   0.533   3.735  -2.515
  481   2HB   ALA  65          HB2       ALA  65   1.051   2.677  -3.852
  482   3HB   ALA  65          HB3       ALA  65  -0.337   3.725  -4.046
  483    H    LEU  66           H        LEU  66   3.634   3.680  -4.897
  484    HA   LEU  66           HA       LEU  66   5.137   4.096  -2.459
  485   1HB   LEU  66          HB2       LEU  66   6.123   3.024  -5.069
  486   2HB   LEU  66          HB1       LEU  66   6.951   2.931  -3.529
  487    HG   LEU  66           HG       LEU  66   6.165   0.814  -3.858
  488   1HD1  LEU  66          HD11      LEU  66   5.660   1.559  -1.623
  489   2HD1  LEU  66          HD12      LEU  66   4.450   0.402  -2.186
  490   3HD1  LEU  66          HD13      LEU  66   4.077   2.126  -2.166
  491   1HD2  LEU  66          HD21      LEU  66   4.757   1.200  -5.763
  492   2HD2  LEU  66          HD22      LEU  66   3.547   1.980  -4.757
  493   3HD2  LEU  66          HD23      LEU  66   3.860   0.252  -4.572
  494    H    SER  67           H        SER  67   4.962   5.396  -5.664
  495    HA   SER  67           HA       SER  67   7.442   6.869  -5.605
  496   1HB   SER  67          HB2       SER  67   5.009   6.687  -7.242
  497   2HB   SER  67          HB1       SER  67   6.207   7.927  -7.612
  498    HG   SER  67           HG       SER  67   7.618   5.801  -7.458
  499    H    GLU  68           H        GLU  68   4.059   7.636  -5.322
  500    HA   GLU  68           HA       GLU  68   4.619  10.354  -4.706
  501   1HB   GLU  68          HB2       GLU  68   2.024   9.263  -3.872
  502   2HB   GLU  68          HB1       GLU  68   2.442  10.741  -4.720
  503   1HG   GLU  68          HG2       GLU  68   2.911   9.259  -6.726
  504   2HG   GLU  68          HG1       GLU  68   2.145   8.019  -5.812
  505    H    HIS  69           H        HIS  69   4.543   7.462  -3.043
  506    HA   HIS  69           HA       HIS  69   3.538   7.954  -0.564
  507   1HB   HIS  69          HB2       HIS  69   4.665   5.853  -1.482
  508   2HB   HIS  69          HB1       HIS  69   6.154   6.561  -0.823
  509    HD1  HIS  69           HD1      HIS  69   2.746   5.377   0.273
  510    HD2  HIS  69           HD2      HIS  69   6.517   6.135   1.713
  511    HE1  HIS  69           HE1      HIS  69   2.707   4.596   2.679
  512    H    ASN  70           H        ASN  70   6.996   8.522  -1.339
  513    HA   ASN  70           HA       ASN  70   7.463  10.025   1.062
  514   1HB   ASN  70          HB2       ASN  70   9.636  10.574  -0.046
  515   2HB   ASN  70          HB1       ASN  70   9.312   8.858   0.148
  516   1HD2  ASN  70          HD21      ASN  70  11.112   9.929  -1.507
  517   2HD2  ASN  70          HD22      ASN  70  10.656   9.520  -3.165
  518    H    LEU  71           H        LEU  71   6.061  10.827  -1.766
  519    HA   LEU  71           HA       LEU  71   6.666  13.636  -1.688
  520   1HB   LEU  71          HB2       LEU  71   6.223  12.881  -3.844
  521   2HB   LEU  71          HB1       LEU  71   4.930  11.835  -3.316
  522    HG   LEU  71           HG       LEU  71   3.485  13.713  -3.036
  523   1HD1  LEU  71          HD11      LEU  71   5.792  15.325  -4.208
  524   2HD1  LEU  71          HD12      LEU  71   5.120  15.506  -2.584
  525   3HD1  LEU  71          HD13      LEU  71   4.158  15.946  -3.995
  526   1HD2  LEU  71          HD21      LEU  71   3.450  12.536  -5.119
  527   2HD2  LEU  71          HD22      LEU  71   4.757  13.526  -5.757
  528   3HD2  LEU  71          HD23      LEU  71   3.183  14.250  -5.426
  529    H    LYS  72           H        LYS  72   3.855  11.615  -0.942
  530    HA   LYS  72           HA       LYS  72   2.660  13.892   0.458
  531   1HB   LYS  72          HB2       LYS  72   0.558  12.118   0.105
  532   2HB   LYS  72          HB1       LYS  72   0.848  13.550  -0.880
  533   1HG   LYS  72          HG2       LYS  72   2.354  11.985  -2.261
  534   2HG   LYS  72          HG1       LYS  72   1.556  10.691  -1.411
  535   1HD   LYS  72          HD2       LYS  72   0.131  12.756  -3.072
  536   2HD   LYS  72          HD1       LYS  72   0.646  11.175  -3.648
  537   1HE   LYS  72          HE2       LYS  72  -0.855  10.304  -1.624
  538   2HE   LYS  72          HE1       LYS  72  -1.547  11.881  -1.743
  539   1HZ   LYS  72          HZ1       LYS  72  -2.221  11.564  -3.937
  540   2HZ   LYS  72          HZ2       LYS  72  -2.654  10.140  -3.146
  541   3HZ   LYS  72          HZ3       LYS  72  -1.272  10.197  -4.133
  542    H    TYR  73           H        TYR  73   3.298  10.568   0.777
  543    HA   TYR  73           HA       TYR  73   2.001  10.254   3.357
  544   1HB   TYR  73          HB2       TYR  73   3.664   8.381   1.715
  545   2HB   TYR  73          HB1       TYR  73   2.869   7.898   3.215
  546    HD1  TYR  73           HD1      TYR  73   2.086   9.486  -0.101
  547    HD2  TYR  73           HD2      TYR  73   0.773   6.831   2.959
  548    HE1  TYR  73           HE1      TYR  73   0.207   8.917  -1.424
  549    HE2  TYR  73           HE2      TYR  73  -1.223   6.282   1.542
  550    HH   TYR  73           HH       TYR  73  -2.465   7.682  -0.197
  551    H    HIS  74           H        HIS  74   5.393   9.883   2.174
  552    HA   HIS  74           HA       HIS  74   6.342  10.583   4.908
  553   1HB   HIS  74          HB2       HIS  74   7.718   8.924   2.772
  554   2HB   HIS  74          HB1       HIS  74   8.506   9.411   4.261
  555    HD1  HIS  74           HD1      HIS  74   6.073   8.530   6.167
  556    HD2  HIS  74           HD2      HIS  74   7.796   6.304   3.133
  557    HE1  HIS  74           HE1      HIS  74   5.474   6.135   6.646
  558    HA   PRO  75           HA       PRO  75   7.452  13.874   1.794
  559   1HB   PRO  75          HB2       PRO  75   6.660  16.005   3.187
  560   2HB   PRO  75          HB1       PRO  75   5.506  15.013   2.277
  561   1HG   PRO  75          HG2       PRO  75   6.171  14.898   5.212
  562   2HG   PRO  75          HG1       PRO  75   4.571  14.912   4.440
  563   1HD   PRO  75          HD2       PRO  75   5.743  12.601   5.254
  564   2HD   PRO  75          HD1       PRO  75   4.731  12.705   3.798
  565    H    GLY  76           H        GLY  76   9.084  15.233   1.619
  566   1HA   GLY  76          HA2       GLY  76  10.542  16.730   3.259
  567   2HA   GLY  76          HA1       GLY  76  11.137  15.128   3.678
  568    H    GLU  77           H        GLU  77  11.189  13.866   1.300
  569    HA   GLU  77           HA       GLU  77  12.645  15.371  -0.669
  570   1HB   GLU  77          HB2       GLU  77  14.688  13.959  -0.469
  571   2HB   GLU  77          HB1       GLU  77  14.436  14.975   0.935
  572   1HG   GLU  77          HG2       GLU  77  14.876  13.087   2.088
  573   2HG   GLU  77          HG1       GLU  77  13.184  12.735   1.706
  574    H    GLU  78           H        GLU  78  13.458  13.624  -2.372
  575    HA   GLU  78           HA       GLU  78  11.466  11.476  -2.399
  576   1HB   GLU  78          HB2       GLU  78  10.728  13.347  -3.896
  577   2HB   GLU  78          HB1       GLU  78  12.243  13.111  -4.776
  578   1HG   GLU  78          HG2       GLU  78  11.569  10.831  -5.348
  579   2HG   GLU  78          HG1       GLU  78  10.060  11.044  -4.471
  580    H    ASN  79           H        ASN  79  13.097  10.047  -1.775
  581    HA   ASN  79           HA       ASN  79  14.801   9.142  -3.964
  582   1HB   ASN  79          HB2       ASN  79  15.703   9.844  -1.192
  583   2HB   ASN  79          HB1       ASN  79  16.728   8.949  -2.329
  584   1HD2  ASN  79          HD21      ASN  79  15.338  11.876  -1.443
  585   2HD2  ASN  79          HD22      ASN  79  16.053  13.001  -2.556
  586    H    PHE  80           H        PHE  80  13.495   7.351  -4.031
  587    HA   PHE  80           HA       PHE  80  13.435   5.625  -1.663
  588   1HB   PHE  80          HB2       PHE  80  11.593   6.098  -3.879
  589   2HB   PHE  80          HB1       PHE  80  11.916   4.400  -3.610
  590    HD1  PHE  80           HD1      PHE  80   9.998   7.206  -2.583
  591    HD2  PHE  80           HD2      PHE  80  11.573   3.530  -1.220
  592    HE1  PHE  80           HE1      PHE  80   8.277   7.118  -0.811
  593    HE2  PHE  80           HE2      PHE  80   9.859   3.418   0.507
  594    HZ   PHE  80           HZ       PHE  80   8.196   5.210   0.715
  595    H    LYS  81           H        LYS  81  14.171   3.534  -1.794
  596    HA   LYS  81           HA       LYS  81  15.909   2.888  -4.088
  597   1HB   LYS  81          HB2       LYS  81  17.447   2.037  -2.554
  598   2HB   LYS  81          HB1       LYS  81  16.593   3.137  -1.479
  599   1HG   LYS  81          HG2       LYS  81  15.247   1.406  -0.603
  600   2HG   LYS  81          HG1       LYS  81  15.830   0.265  -1.802
  601   1HD   LYS  81          HD2       LYS  81  18.130   0.643  -0.798
  602   2HD   LYS  81          HD1       LYS  81  17.259   1.442   0.527
  603   1HE   LYS  81          HE2       LYS  81  15.872  -0.563   0.800
  604   2HE   LYS  81          HE1       LYS  81  16.795  -1.339  -0.479
  605   1HZ   LYS  81          HZ1       LYS  81  17.976  -0.385   2.078
  606   2HZ   LYS  81          HZ2       LYS  81  18.741  -1.349   0.919
  607   3HZ   LYS  81          HZ3       LYS  81  17.459  -1.954   1.822
  608    H    LEU  82           H        LEU  82  15.931   0.320  -4.403
  609    HA   LEU  82           HA       LEU  82  13.352  -0.735  -3.627
  610   1HB   LEU  82          HB2       LEU  82  12.952  -1.726  -5.821
  611   2HB   LEU  82          HB1       LEU  82  12.989   0.019  -5.904
  612    HG   LEU  82           HG       LEU  82  15.406  -1.581  -6.571
  613   1HD1  LEU  82          HD11      LEU  82  13.078  -0.867  -8.407
  614   2HD1  LEU  82          HD12      LEU  82  13.557  -2.503  -7.944
  615   3HD1  LEU  82          HD13      LEU  82  14.612  -1.527  -8.962
  616   1HD2  LEU  82          HD21      LEU  82  14.363   1.083  -7.533
  617   2HD2  LEU  82          HD22      LEU  82  15.877   0.339  -8.043
  618   3HD2  LEU  82          HD23      LEU  82  15.659   0.831  -6.364
  619    H    THR  83           H        THR  83  13.474  -2.615  -2.794
  620    HA   THR  83           HA       THR  83  15.741  -4.304  -3.404
  621    HB   THR  83           HB       THR  83  16.297  -3.217  -1.347
  622    HG1  THR  83           HG1      THR  83  16.064  -5.783  -1.538
  623   1HG2  THR  83          HG21      THR  83  14.898  -3.227   0.669
  624   2HG2  THR  83          HG22      THR  83  13.646  -4.100  -0.204
  625   3HG2  THR  83          HG23      THR  83  14.054  -2.448  -0.675
  626    H    MET  84           H        MET  84  14.944  -6.416  -3.895
  627    HA   MET  84           HA       MET  84  12.056  -6.709  -3.307
  628   1HB   MET  84          HB2       MET  84  12.683  -6.941  -5.650
  629   2HB   MET  84          HB1       MET  84  13.904  -8.124  -5.208
  630   1HG   MET  84          HG2       MET  84  12.134  -9.673  -4.525
  631   2HG   MET  84          HG1       MET  84  10.919  -8.488  -5.015
  632   1HE   MET  84          HE1       MET  84   9.882 -10.476  -6.493
  633   2HE   MET  84          HE2       MET  84  11.230 -11.590  -6.205
  634   3HE   MET  84          HE3       MET  84  10.725 -11.226  -7.848
  635    H    VAL  85           H        VAL  85  11.963  -7.511  -1.308
  636    HA   VAL  85           HA       VAL  85  12.841 -10.214  -1.005
  637    HB   VAL  85           HB       VAL  85  13.572  -9.555   1.470
  638   1HG1  VAL  85          HG11      VAL  85  15.308  -9.002  -0.933
  639   2HG1  VAL  85          HG12      VAL  85  15.072 -10.575  -0.164
  640   3HG1  VAL  85          HG13      VAL  85  15.900  -9.277   0.704
  641   1HG2  VAL  85          HG21      VAL  85  14.702  -7.379   1.596
  642   2HG2  VAL  85          HG22      VAL  85  12.980  -7.163   1.250
  643   3HG2  VAL  85          HG23      VAL  85  14.168  -6.998  -0.040
  644    H    LYS  86           H        LYS  86  10.813 -11.114  -0.642
  645    HA   LYS  86           HA       LYS  86   9.394 -10.017   1.649
  646   1HB   LYS  86          HB2       LYS  86   8.448  -9.102  -0.609
  647   2HB   LYS  86          HB1       LYS  86   7.775 -10.733  -0.757
  648   1HG   LYS  86          HG2       LYS  86   6.114  -9.428   0.079
  649   2HG   LYS  86          HG1       LYS  86   6.684 -10.359   1.467
  650   1HD   LYS  86          HD2       LYS  86   7.948  -8.510   2.317
  651   2HD   LYS  86          HD1       LYS  86   7.730  -7.560   0.859
  652   1HE   LYS  86          HE2       LYS  86   6.151  -6.527   2.259
  653   2HE   LYS  86          HE1       LYS  86   5.217  -7.769   1.468
  654   1HZ   LYS  86          HZ1       LYS  86   6.483  -8.125   4.127
  655   2HZ   LYS  86          HZ2       LYS  86   5.444  -9.224   3.428
  656   3HZ   LYS  86          HZ3       LYS  86   4.873  -7.737   3.935
  657    H    ARG  87           H        ARG  87   8.938 -11.565   2.937
  658    HA   ARG  87           HA       ARG  87   8.988 -14.229   1.769
  659   1HB   ARG  87          HB2       ARG  87   9.889 -13.361   4.527
  660   2HB   ARG  87          HB1       ARG  87   9.831 -15.024   3.976
  661   1HG   ARG  87          HG2       ARG  87  12.105 -14.436   3.738
  662   2HG   ARG  87          HG1       ARG  87  11.424 -14.264   2.114
  663   1HD   ARG  87          HD2       ARG  87  12.899 -12.383   2.642
  664   2HD   ARG  87          HD1       ARG  87  11.236 -11.873   2.396
  665    HE   ARG  87           HE       ARG  87  11.827 -12.365   5.141
  666   1HH1  ARG  87          HH11      ARG  87  12.022  -9.873   2.603
  667   2HH1  ARG  87          HH12      ARG  87  12.094  -8.590   3.696
  668   1HH2  ARG  87          HH21      ARG  87  11.908 -10.570   6.616
  669   2HH2  ARG  87          HH22      ARG  87  12.044  -8.984   6.010
  670    H    ASN  88           H        ASN  88   7.704 -15.823   3.060
  671    HA   ASN  88           HA       ASN  88   5.830 -16.591   4.073
  672   1HB   ASN  88          HB2       ASN  88   6.378 -15.055   5.955
  673   2HB   ASN  88          HB1       ASN  88   5.512 -13.769   5.146
  674   1HD2  ASN  88          HD21      ASN  88   4.408 -17.131   5.432
  675   2HD2  ASN  88          HD22      ASN  88   3.068 -16.774   6.443
  676    H    ASN  89           H        ASN  89   5.791 -14.283   1.687
  677    HA   ASN  89           HA       ASN  89   2.888 -14.593   1.293
  678   1HB   ASN  89          HB2       ASN  89   4.429 -12.011   0.883
  679   2HB   ASN  89          HB1       ASN  89   2.746 -12.269   0.462
  680   1HD2  ASN  89          HD21      ASN  89   5.068 -11.656   2.969
  681   2HD2  ASN  89          HD22      ASN  89   3.900 -11.373   4.215
  682    H    GLN  90           H        GLN  90   5.018 -12.610  -0.596
  683    HA   GLN  90           HA       GLN  90   5.402 -14.537  -2.658
  684   1HB   GLN  90          HB2       GLN  90   4.497 -13.160  -4.384
  685   2HB   GLN  90          HB1       GLN  90   3.168 -13.457  -3.238
  686   1HG   GLN  90          HG2       GLN  90   4.809 -10.974  -3.324
  687   2HG   GLN  90          HG1       GLN  90   3.401 -11.188  -4.363
  688   1HE2  GLN  90          HE21      GLN  90   4.597 -10.574  -1.245
  689   2HE2  GLN  90          HE22      GLN  90   3.068 -10.221  -0.495
  690    H    THR  91           H        THR  91   6.900 -13.446  -4.236
  691    HA   THR  91           HA       THR  91   8.497 -11.632  -2.674
  692    HB   THR  91           HB       THR  91  10.150 -12.103  -4.657
  693    HG1  THR  91           HG1      THR  91   8.687 -13.262  -5.940
  694   1HG2  THR  91          HG21      THR  91  10.529 -12.786  -2.317
  695   2HG2  THR  91          HG22      THR  91  10.997 -14.078  -3.412
  696   3HG2  THR  91          HG23      THR  91   9.469 -14.165  -2.542
  697    H    ILE  92           H        ILE  92   8.256  -9.677  -2.891
  698    HA   ILE  92           HA       ILE  92   7.570  -8.415  -5.345
  699    HB   ILE  92           HB       ILE  92   6.078  -6.856  -3.967
  700   1HG1  ILE  92          HG12      ILE  92   4.823  -8.238  -2.172
  701   2HG1  ILE  92          HG11      ILE  92   6.337  -9.132  -2.139
  702   1HG2  ILE  92          HG21      ILE  92   5.112  -8.197  -5.651
  703   2HG2  ILE  92          HG22      ILE  92   4.100  -8.397  -4.209
  704   3HG2  ILE  92          HG23      ILE  92   5.257  -9.647  -4.675
  705   1HD1  ILE  92          HD11      ILE  92   6.242  -7.322  -0.480
  706   2HD1  ILE  92          HD12      ILE  92   6.186  -6.164  -1.809
  707   3HD1  ILE  92          HD13      ILE  92   7.591  -7.200  -1.601
  708    H    PHE  93           H        PHE  93   7.901  -6.039  -5.225
  709    HA   PHE  93           HA       PHE  93  10.666  -5.828  -4.346
  710   1HB   PHE  93          HB2       PHE  93   8.870  -4.101  -6.034
  711   2HB   PHE  93          HB1       PHE  93  10.547  -3.730  -5.750
  712    HD1  PHE  93           HD1      PHE  93   8.148  -5.769  -7.567
  713    HD2  PHE  93           HD2      PHE  93  12.267  -5.102  -6.781
  714    HE1  PHE  93           HE1      PHE  93   8.726  -7.085  -9.565
  715    HE2  PHE  93           HE2      PHE  93  12.869  -6.423  -8.787
  716    HZ   PHE  93           HZ       PHE  93  11.092  -7.414 -10.177
  717    H    GLU  94           H        GLU  94  11.080  -4.798  -2.447
  718    HA   GLU  94           HA       GLU  94   9.002  -3.210  -1.274
  719   1HB   GLU  94          HB2       GLU  94  11.662  -4.041  -0.066
  720   2HB   GLU  94          HB1       GLU  94  10.239  -3.414   0.745
  721   1HG   GLU  94          HG2       GLU  94   9.073  -5.502  -0.014
  722   2HG   GLU  94          HG1       GLU  94  10.675  -6.169  -0.328
  723    H    GLN  95           H        GLN  95   9.410  -1.099  -0.814
  724    HA   GLN  95           HA       GLN  95  11.789   0.043  -2.118
  725   1HB   GLN  95          HB2       GLN  95   9.394   0.205  -3.204
  726   2HB   GLN  95          HB1       GLN  95   9.139   1.440  -1.984
  727   1HG   GLN  95          HG2       GLN  95  10.971   2.721  -2.824
  728   2HG   GLN  95          HG1       GLN  95  11.394   1.429  -3.943
  729   1HE2  GLN  95          HE21      GLN  95   9.217   4.026  -3.233
  730   2HE2  GLN  95          HE22      GLN  95   8.504   4.089  -4.804
  731    H    THR  96           H        THR  96  13.067   0.892  -0.568
  732    HA   THR  96           HA       THR  96  11.835   2.025   1.861
  733    HB   THR  96           HB       THR  96  14.661   1.642   2.092
  734    HG1  THR  96           HG1      THR  96  14.274  -0.815   2.043
  735   1HG2  THR  96          HG21      THR  96  12.329   0.251   3.435
  736   2HG2  THR  96          HG22      THR  96  13.067   1.735   3.971
  737   3HG2  THR  96          HG23      THR  96  13.993   0.230   4.004
  738    H    ILE  97           H        ILE  97  12.988   3.857   2.763
  739    HA   ILE  97           HA       ILE  97  14.032   5.638   0.652
  740    HB   ILE  97           HB       ILE  97  13.061   6.475   3.402
  741   1HG1  ILE  97          HG12      ILE  97  11.388   6.476   0.933
  742   2HG1  ILE  97          HG11      ILE  97  11.442   5.040   1.936
  743   1HG2  ILE  97          HG21      ILE  97  14.377   8.035   1.848
  744   2HG2  ILE  97          HG22      ILE  97  12.795   8.598   2.303
  745   3HG2  ILE  97          HG23      ILE  97  13.045   7.891   0.697
  746   1HD1  ILE  97          HD11      ILE  97   9.561   6.163   2.546
  747   2HD1  ILE  97          HD12      ILE  97  10.286   7.742   2.504
  748   3HD1  ILE  97          HD13      ILE  97  10.682   6.599   3.828
  749    H    ASN  98           H        ASN  98  15.762   6.955   1.180
  750    HA   ASN  98           HA       ASN  98  17.662   5.673   2.992
  751   1HB   ASN  98          HB2       ASN  98  19.307   7.151   1.739
  752   2HB   ASN  98          HB1       ASN  98  18.548   5.873   0.789
  753   1HD2  ASN  98          HD21      ASN  98  17.003   8.973   1.676
  754   2HD2  ASN  98          HD22      ASN  98  16.900   9.554   0.094
  755    H    ASP  99           H        ASP  99  15.403   7.713   3.619
  756    HA   ASP  99           HA       ASP  99  16.968   9.524   5.321
  757   1HB   ASP  99          HB2       ASP  99  16.840  10.455   2.982
  758   2HB   ASP  99          HB1       ASP  99  15.133  10.642   3.244
  759    H    LEU 100           H        LEU 100  13.783   9.184   3.839
  760    HA   LEU 100           HA       LEU 100  12.355  10.354   6.045
  761   1HB   LEU 100          HB2       LEU 100  11.248   8.916   3.620
  762   2HB   LEU 100          HB1       LEU 100  10.460  10.068   4.665
  763    HG   LEU 100           HG       LEU 100  12.882  11.032   3.253
  764   1HD1  LEU 100          HD11      LEU 100  11.798   9.877   1.433
  765   2HD1  LEU 100          HD12      LEU 100  11.469  11.586   1.287
  766   3HD1  LEU 100          HD13      LEU 100  10.231  10.500   1.941
  767   1HD2  LEU 100          HD21      LEU 100  10.172  12.200   3.727
  768   2HD2  LEU 100          HD22      LEU 100  11.591  13.025   3.122
  769   3HD2  LEU 100          HD23      LEU 100  11.567  12.424   4.798
  770    H    THR 101           H        THR 101  13.802   7.657   6.029
  771    HA   THR 101           HA       THR 101  12.010   5.560   6.517
  772    HB   THR 101           HB       THR 101  14.883   5.956   7.352
  773    HG1  THR 101           HG1      THR 101  13.769   4.862   5.014
  774   1HG2  THR 101          HG21      THR 101  13.784   3.876   8.270
  775   2HG2  THR 101          HG22      THR 101  15.078   3.539   7.111
  776   3HG2  THR 101          HG23      THR 101  13.406   3.413   6.601
  777    H    PHE 102           H        PHE 102  13.209   8.180   8.405
  778    HA   PHE 102           HA       PHE 102  12.797   6.870  10.974
  779   1HB   PHE 102          HB2       PHE 102  13.737   9.667  10.318
  780   2HB   PHE 102          HB1       PHE 102  13.659   8.983  11.937
  781    HD1  PHE 102           HD1      PHE 102  15.534   9.199   8.844
  782    HD2  PHE 102           HD2      PHE 102  15.215   7.136  12.556
  783    HE1  PHE 102           HE1      PHE 102  17.818   8.344   8.560
  784    HE2  PHE 102           HE2      PHE 102  17.499   6.280  12.276
  785    HZ   PHE 102           HZ       PHE 102  18.807   6.880  10.274
  Start of MODEL   17
    1    HA   MET   1           HA       MET   1   1.998  -9.621 -30.096
    2   1HB   MET   1          HB2       MET   1   0.246  -7.847 -29.910
    3   2HB   MET   1          HB1       MET   1   0.507  -8.399 -31.547
    4   1HG   MET   1          HG2       MET   1  -1.820  -8.042 -31.271
    5   2HG   MET   1          HG1       MET   1  -1.573  -9.780 -31.323
    6   1HE   MET   1          HE1       MET   1  -4.119  -9.963 -30.435
    7   2HE   MET   1          HE2       MET   1  -4.227  -8.208 -30.321
    8   3HE   MET   1          HE3       MET   1  -4.681  -9.209 -28.943
    9    H    ALA   2           H        ALA   2   1.819  -8.701 -27.997
   10    HA   ALA   2           HA       ALA   2   0.590 -10.576 -26.127
   11   1HB   ALA   2          HB1       ALA   2   2.634  -8.391 -25.674
   12   2HB   ALA   2          HB2       ALA   2   2.979 -10.112 -25.838
   13   3HB   ALA   2          HB3       ALA   2   2.058  -9.527 -24.455
   14    H    HIS   3           H        HIS   3  -1.391 -10.029 -25.536
   15    HA   HIS   3           HA       HIS   3  -2.247  -7.280 -25.760
   16   1HB   HIS   3          HB2       HIS   3  -3.671  -9.104 -26.640
   17   2HB   HIS   3          HB1       HIS   3  -3.813  -9.749 -25.011
   18    HD1  HIS   3           HD1      HIS   3  -5.680  -8.809 -23.571
   19    HD2  HIS   3           HD2      HIS   3  -4.947  -6.548 -26.978
   20    HE1  HIS   3           HE1      HIS   3  -7.509  -7.089 -23.670
   21    H    HIS   4           H        HIS   4  -2.483  -5.929 -24.062
   22    HA   HIS   4           HA       HIS   4  -2.393  -7.113 -21.383
   23   1HB   HIS   4          HB2       HIS   4  -1.118  -5.211 -20.560
   24   2HB   HIS   4          HB1       HIS   4  -0.278  -5.873 -21.949
   25    HD1  HIS   4           HD1      HIS   4  -0.296  -4.322 -24.163
   26    HD2  HIS   4           HD2      HIS   4  -1.948  -2.615 -20.754
   27    HE1  HIS   4           HE1      HIS   4  -0.427  -1.863 -24.610
   28    H    HIS   5           H        HIS   5  -3.328  -5.506 -19.732
   29    HA   HIS   5           HA       HIS   5  -5.795  -4.436 -20.888
   30   1HB   HIS   5          HB2       HIS   5  -5.217  -5.340 -18.049
   31   2HB   HIS   5          HB1       HIS   5  -6.724  -4.598 -18.571
   32    HD1  HIS   5           HD1      HIS   5  -8.492  -6.194 -19.522
   33    HD2  HIS   5           HD2      HIS   5  -4.719  -7.911 -19.243
   34    HE1  HIS   5           HE1      HIS   5  -8.782  -8.613 -20.092
   35    H    HIS   6           H        HIS   6  -6.562  -2.439 -20.066
   36    HA   HIS   6           HA       HIS   6  -4.631  -0.444 -20.049
   37   1HB   HIS   6          HB2       HIS   6  -6.515   1.091 -19.347
   38   2HB   HIS   6          HB1       HIS   6  -6.780   0.176 -20.822
   39    HD1  HIS   6           HD1      HIS   6  -8.016   0.438 -17.223
   40    HD2  HIS   6           HD2      HIS   6  -8.928  -1.564 -20.758
   41    HE1  HIS   6           HE1      HIS   6 -10.265  -0.598 -16.882
   42    H    HIS   7           H        HIS   7  -3.330   0.310 -18.591
   43    HA   HIS   7           HA       HIS   7  -3.703  -0.429 -15.783
   44   1HB   HIS   7          HB2       HIS   7  -1.313   0.802 -17.187
   45   2HB   HIS   7          HB1       HIS   7  -1.369   0.420 -15.475
   46    HD1  HIS   7           HD1      HIS   7  -0.842  -2.025 -14.822
   47    HD2  HIS   7           HD2      HIS   7  -1.227  -1.427 -18.915
   48    HE1  HIS   7           HE1      HIS   7  -0.066  -4.147 -15.909
   49    H    HIS   8           H        HIS   8  -3.901   2.281 -17.886
   50    HA   HIS   8           HA       HIS   8  -3.462   4.306 -15.952
   51   1HB   HIS   8          HB2       HIS   8  -3.212   4.735 -18.388
   52   2HB   HIS   8          HB1       HIS   8  -4.940   4.504 -18.596
   53    HD1  HIS   8           HD1      HIS   8  -6.388   6.565 -18.296
   54    HD2  HIS   8           HD2      HIS   8  -2.542   7.051 -16.814
   55    HE1  HIS   8           HE1      HIS   8  -6.195   8.987 -17.625
   56    H    ASN   9           H        ASN   9  -6.491   3.265 -17.560
   57    HA   ASN   9           HA       ASN   9  -7.991   4.337 -15.380
   58   1HB   ASN   9          HB2       ASN   9  -9.054   4.184 -17.611
   59   2HB   ASN   9          HB1       ASN   9  -8.905   2.430 -17.556
   60   1HD2  ASN   9          HD21      ASN   9  -9.842   4.472 -14.773
   61   2HD2  ASN   9          HD22      ASN   9 -11.435   3.840 -14.680
   62    H    GLN  10           H        GLN  10  -7.592   3.497 -13.608
   63    HA   GLN  10           HA       GLN  10  -7.499   0.585 -13.289
   64   1HB   GLN  10          HB2       GLN  10  -5.353   1.664 -13.079
   65   2HB   GLN  10          HB1       GLN  10  -6.002   2.801 -11.921
   66   1HG   GLN  10          HG2       GLN  10  -6.368   0.931 -10.361
   67   2HG   GLN  10          HG1       GLN  10  -5.597  -0.145 -11.535
   68   1HE2  GLN  10          HE21      GLN  10  -3.696   1.867 -12.449
   69   2HE2  GLN  10          HE22      GLN  10  -2.542   2.047 -11.205
   70    H    GLN  11           H        GLN  11  -7.636   3.414 -11.164
   71    HA   GLN  11           HA       GLN  11 -10.360   2.902 -10.417
   72   1HB   GLN  11          HB2       GLN  11  -8.149   3.179  -8.343
   73   2HB   GLN  11          HB1       GLN  11  -9.867   3.045  -8.007
   74   1HG   GLN  11          HG2       GLN  11  -9.779   0.774  -9.076
   75   2HG   GLN  11          HG1       GLN  11  -8.028   0.936  -9.078
   76   1HE2  GLN  11          HE21      GLN  11 -10.830   0.365  -7.235
   77   2HE2  GLN  11          HE22      GLN  11 -10.042  -0.027  -5.754
   78    H    ASN  12           H        ASN  12 -11.320   4.825  -9.943
   79    HA   ASN  12           HA       ASN  12 -10.107   7.054 -11.167
   80   1HB   ASN  12          HB2       ASN  12 -12.509   6.663 -11.278
   81   2HB   ASN  12          HB1       ASN  12 -12.646   6.927  -9.544
   82   1HD2  ASN  12          HD21      ASN  12 -12.153   8.409 -12.636
   83   2HD2  ASN  12          HD22      ASN  12 -12.392  10.033 -12.126
   84    H    LYS  13           H        LYS  13 -10.588   6.267  -7.770
   85    HA   LYS  13           HA       LYS  13  -9.921   8.909  -6.889
   86   1HB   LYS  13          HB2       LYS  13 -10.081   6.364  -5.319
   87   2HB   LYS  13          HB1       LYS  13  -9.832   7.946  -4.613
   88   1HG   LYS  13          HG2       LYS  13 -12.064   8.592  -5.636
   89   2HG   LYS  13          HG1       LYS  13 -12.300   6.871  -5.962
   90   1HD   LYS  13          HD2       LYS  13 -11.816   8.145  -3.260
   91   2HD   LYS  13          HD1       LYS  13 -13.338   7.482  -3.846
   92   1HE   LYS  13          HE2       LYS  13 -12.473   5.252  -3.815
   93   2HE   LYS  13          HE1       LYS  13 -10.829   5.823  -3.539
   94   1HZ   LYS  13          HZ1       LYS  13 -13.080   6.088  -1.611
   95   2HZ   LYS  13          HZ2       LYS  13 -11.506   6.653  -1.410
   96   3HZ   LYS  13          HZ3       LYS  13 -11.787   4.999  -1.508
   97    H    LYS  14           H        LYS  14  -8.045   6.105  -7.628
   98    HA   LYS  14           HA       LYS  14  -5.831   5.581  -7.417
   99   1HB   LYS  14          HB2       LYS  14  -5.844   8.529  -7.402
  100   2HB   LYS  14          HB1       LYS  14  -4.415   7.830  -6.668
  101   1HG   LYS  14          HG2       LYS  14  -5.374   7.043  -9.400
  102   2HG   LYS  14          HG1       LYS  14  -4.321   8.435  -9.132
  103   1HD   LYS  14          HD2       LYS  14  -3.678   5.630  -8.224
  104   2HD   LYS  14          HD1       LYS  14  -3.110   6.313  -9.752
  105   1HE   LYS  14          HE2       LYS  14  -2.480   7.309  -6.955
  106   2HE   LYS  14          HE1       LYS  14  -1.392   6.458  -8.027
  107   1HZ   LYS  14          HZ1       LYS  14  -2.503   9.195  -8.497
  108   2HZ   LYS  14          HZ2       LYS  14  -1.497   8.386  -9.568
  109   3HZ   LYS  14          HZ3       LYS  14  -0.934   8.818  -8.031
  110    H    VAL  15           H        VAL  15  -3.865   6.517  -5.592
  111    HA   VAL  15           HA       VAL  15  -4.917   5.313  -3.209
  112    HB   VAL  15           HB       VAL  15  -2.614   4.904  -4.300
  113   1HG1  VAL  15          HG11      VAL  15  -1.810   7.062  -4.650
  114   2HG1  VAL  15          HG12      VAL  15  -0.765   6.296  -3.420
  115   3HG1  VAL  15          HG13      VAL  15  -2.015   7.459  -2.946
  116   1HG2  VAL  15          HG21      VAL  15  -3.152   3.907  -2.168
  117   2HG2  VAL  15          HG22      VAL  15  -2.738   5.416  -1.342
  118   3HG2  VAL  15          HG23      VAL  15  -1.484   4.491  -2.144
  119    H    GLU  16           H        GLU  16  -5.503   6.501  -1.366
  120    HA   GLU  16           HA       GLU  16  -5.564   9.396  -1.776
  121   1HB   GLU  16          HB2       GLU  16  -6.860   7.864   0.467
  122   2HB   GLU  16          HB1       GLU  16  -7.301   9.453  -0.144
  123   1HG   GLU  16          HG2       GLU  16  -8.198   8.489  -2.131
  124   2HG   GLU  16          HG1       GLU  16  -7.548   6.910  -1.707
  125    H    GLY  17           H        GLY  17  -5.412   8.005   1.453
  126   1HA   GLY  17          HA2       GLY  17  -2.766   9.240   1.697
  127   2HA   GLY  17          HA1       GLY  17  -4.075   9.828   2.724
  128    H    GLY  18           H        GLY  18  -4.339   6.606   2.074
  129   1HA   GLY  18          HA2       GLY  18  -2.935   5.971   4.566
  130   2HA   GLY  18          HA1       GLY  18  -4.506   5.273   4.177
  131    H    TYR  19           H        TYR  19  -3.520   3.243   4.477
  132    HA   TYR  19           HA       TYR  19  -1.623   2.485   2.368
  133   1HB   TYR  19          HB2       TYR  19  -2.434   0.900   4.790
  134   2HB   TYR  19          HB1       TYR  19  -0.999   0.673   3.783
  135    HD1  TYR  19           HD1      TYR  19   0.432   3.040   3.645
  136    HD2  TYR  19           HD2      TYR  19  -2.014   1.740   6.867
  137    HE1  TYR  19           HE1      TYR  19   1.653   4.532   5.175
  138    HE2  TYR  19           HE2      TYR  19  -0.819   3.200   8.390
  139    HH   TYR  19           HH       TYR  19   1.207   5.670   7.308
  140    H    GLU  20           H        GLU  20  -2.492   1.781   0.657
  141    HA   GLU  20           HA       GLU  20  -5.038   0.382   0.821
  142   1HB   GLU  20          HB2       GLU  20  -5.008   2.338  -0.692
  143   2HB   GLU  20          HB1       GLU  20  -3.632   1.660  -1.534
  144   1HG   GLU  20          HG2       GLU  20  -5.852  -0.197  -1.474
  145   2HG   GLU  20          HG1       GLU  20  -6.297   1.339  -2.214
  146    H    CYS  21           H        CYS  21  -4.982  -1.619   0.681
  147    HA   CYS  21           HA       CYS  21  -2.664  -3.195   0.234
  148   1HB   CYS  21          HB2       CYS  21  -5.524  -4.042   0.022
  149   2HB   CYS  21          HB1       CYS  21  -4.146  -5.116   0.285
  150    H    LYS  22           H        LYS  22  -1.981  -4.209  -1.535
  151    HA   LYS  22           HA       LYS  22  -2.699  -3.725  -4.186
  152   1HB   LYS  22          HB2       LYS  22  -0.555  -4.569  -3.742
  153   2HB   LYS  22          HB1       LYS  22  -1.165  -5.844  -2.712
  154   1HG   LYS  22          HG2       LYS  22  -0.256  -6.791  -4.711
  155   2HG   LYS  22          HG1       LYS  22  -2.001  -7.010  -4.708
  156   1HD   LYS  22          HD2       LYS  22  -2.198  -5.057  -6.203
  157   2HD   LYS  22          HD1       LYS  22  -0.426  -4.970  -6.231
  158   1HE   LYS  22          HE2       LYS  22  -0.294  -7.207  -7.158
  159   2HE   LYS  22          HE1       LYS  22  -2.038  -7.384  -7.044
  160   1HZ   LYS  22          HZ1       LYS  22  -2.292  -5.629  -8.680
  161   2HZ   LYS  22          HZ2       LYS  22  -1.335  -6.833  -9.336
  162   3HZ   LYS  22          HZ3       LYS  22  -0.642  -5.404  -8.793
  163    H    TYR  23           H        TYR  23  -4.101  -5.734  -1.808
  164    HA   TYR  23           HA       TYR  23  -5.424  -7.421  -3.775
  165   1HB   TYR  23          HB2       TYR  23  -5.670  -8.585  -1.200
  166   2HB   TYR  23          HB1       TYR  23  -4.710  -9.156  -2.560
  167    HD1  TYR  23           HD1      TYR  23  -2.293  -8.512  -2.733
  168    HD2  TYR  23           HD2      TYR  23  -4.633  -7.530   0.684
  169    HE1  TYR  23           HE1      TYR  23  -0.248  -8.063  -1.461
  170    HE2  TYR  23           HE2      TYR  23  -2.584  -7.068   1.964
  171    HH   TYR  23           HH       TYR  23  -0.145  -7.729   1.892
  172    H    CYS  24           H        CYS  24  -6.184  -4.703  -2.232
  173    HA   CYS  24           HA       CYS  24  -8.939  -5.281  -2.480
  174   1HB   CYS  24          HB2       CYS  24  -9.697  -4.815  -0.194
  175   2HB   CYS  24          HB1       CYS  24  -8.535  -6.137  -0.206
  176    H    THR  25           H        THR  25 -10.186  -3.176  -1.641
  177    HA   THR  25           HA       THR  25  -8.486  -0.889  -2.293
  178    HB   THR  25           HB       THR  25 -11.478  -1.171  -2.852
  179    HG1  THR  25           HG1      THR  25 -10.529  -2.429  -4.356
  180   1HG2  THR  25          HG21      THR  25 -10.723   1.185  -2.552
  181   2HG2  THR  25          HG22      THR  25 -11.192   0.862  -4.221
  182   3HG2  THR  25          HG23      THR  25  -9.487   0.927  -3.785
  183    H    PHE  26           H        PHE  26  -9.454  -2.402   0.230
  184    HA   PHE  26           HA       PHE  26 -10.657  -0.199   1.650
  185   1HB   PHE  26          HB2       PHE  26 -11.369  -2.509   2.271
  186   2HB   PHE  26          HB1       PHE  26  -9.710  -2.876   2.739
  187    HD1  PHE  26           HD1      PHE  26 -12.607  -0.723   3.542
  188    HD2  PHE  26           HD2      PHE  26  -8.904  -2.306   4.885
  189    HE1  PHE  26           HE1      PHE  26 -13.052   0.156   5.792
  190    HE2  PHE  26           HE2      PHE  26  -9.339  -1.433   7.138
  191    HZ   PHE  26           HZ       PHE  26 -11.417  -0.198   7.599
  192    H    GLN  27           H        GLN  27  -9.391   1.352   1.999
  193    HA   GLN  27           HA       GLN  27  -6.599   0.874   2.672
  194   1HB   GLN  27          HB2       GLN  27  -6.509   2.078   0.723
  195   2HB   GLN  27          HB1       GLN  27  -7.988   2.966   1.062
  196   1HG   GLN  27          HG2       GLN  27  -6.803   4.355   2.649
  197   2HG   GLN  27          HG1       GLN  27  -5.373   3.340   2.452
  198   1HE2  GLN  27          HE21      GLN  27  -4.058   3.769   0.939
  199   2HE2  GLN  27          HE22      GLN  27  -4.157   5.017  -0.244
  200    H    THR  28           H        THR  28  -5.745   1.878   4.385
  201    HA   THR  28           HA       THR  28  -7.323   3.764   5.841
  202    HB   THR  28           HB       THR  28  -8.147   1.748   6.869
  203    HG1  THR  28           HG1      THR  28  -7.973   2.728   8.672
  204   1HG2  THR  28          HG21      THR  28  -6.327   0.214   6.178
  205   2HG2  THR  28          HG22      THR  28  -6.691   0.062   7.892
  206   3HG2  THR  28          HG23      THR  28  -5.269   0.954   7.378
  207    HA   PRO  29           HA       PRO  29  -3.124   5.242   6.368
  208   1HB   PRO  29          HB2       PRO  29  -3.744   7.434   7.843
  209   2HB   PRO  29          HB1       PRO  29  -3.959   7.336   6.086
  210   1HG   PRO  29          HG2       PRO  29  -5.986   6.976   8.257
  211   2HG   PRO  29          HG1       PRO  29  -6.127   7.884   6.741
  212   1HD   PRO  29          HD2       PRO  29  -7.162   5.400   7.039
  213   2HD   PRO  29          HD1       PRO  29  -6.495   5.962   5.481
  214    H    ASP  30           H        ASP  30  -5.140   3.936   8.664
  215    HA   ASP  30           HA       ASP  30  -3.258   4.301  10.837
  216   1HB   ASP  30          HB2       ASP  30  -5.893   2.825  10.652
  217   2HB   ASP  30          HB1       ASP  30  -4.861   2.794  12.073
  218    H    LEU  31           H        LEU  31  -1.513   3.094  10.592
  219    HA   LEU  31           HA       LEU  31  -1.135   0.858   9.078
  220   1HB   LEU  31          HB2       LEU  31   0.466   2.423  10.442
  221   2HB   LEU  31          HB1       LEU  31   0.280   1.227  11.700
  222    HG   LEU  31           HG       LEU  31   2.339   0.798  10.531
  223   1HD1  LEU  31          HD11      LEU  31   2.024  -1.467   9.667
  224   2HD1  LEU  31          HD12      LEU  31   0.280  -1.152   9.627
  225   3HD1  LEU  31          HD13      LEU  31   1.126  -1.198  11.177
  226   1HD2  LEU  31          HD21      LEU  31   1.797   1.992   8.506
  227   2HD2  LEU  31          HD22      LEU  31   0.700   0.706   8.030
  228   3HD2  LEU  31          HD23      LEU  31   2.440   0.385   8.139
  229    H    ASN  32           H        ASN  32  -2.173   1.147  12.499
  230    HA   ASN  32           HA       ASN  32  -2.107  -1.488  13.244
  231   1HB   ASN  32          HB2       ASN  32  -2.585   0.581  14.671
  232   2HB   ASN  32          HB1       ASN  32  -4.214   0.468  13.977
  233   1HD2  ASN  32          HD21      ASN  32  -5.604  -1.130  14.595
  234   2HD2  ASN  32          HD22      ASN  32  -5.239  -2.146  15.926
  235    H    MET  33           H        MET  33  -4.660   0.409  11.691
  236    HA   MET  33           HA       MET  33  -6.546  -1.753  11.691
  237   1HB   MET  33          HB2       MET  33  -6.592   0.757  10.017
  238   2HB   MET  33          HB1       MET  33  -7.939  -0.333  10.290
  239   1HG   MET  33          HG2       MET  33  -6.541   1.340  12.304
  240   2HG   MET  33          HG1       MET  33  -8.140   1.673  11.626
  241   1HE   MET  33          HE1       MET  33  -9.294   1.891  13.965
  242   2HE   MET  33          HE2       MET  33  -7.693   1.737  14.683
  243   3HE   MET  33          HE3       MET  33  -9.031   0.766  15.300
  244    H    PHE  34           H        PHE  34  -4.162  -0.460   9.542
  245    HA   PHE  34           HA       PHE  34  -4.943  -1.900   7.259
  246   1HB   PHE  34          HB2       PHE  34  -3.445  -0.056   6.959
  247   2HB   PHE  34          HB1       PHE  34  -2.276  -0.721   8.073
  248    HD1  PHE  34           HD1      PHE  34  -3.890  -1.373   4.718
  249    HD2  PHE  34           HD2      PHE  34  -0.578  -2.098   7.331
  250    HE1  PHE  34           HE1      PHE  34  -2.709  -2.481   2.907
  251    HE2  PHE  34           HE2      PHE  34   0.609  -3.219   5.481
  252    HZ   PHE  34           HZ       PHE  34  -0.466  -3.410   3.270
  253    H    THR  35           H        THR  35  -2.407  -2.594   9.635
  254    HA   THR  35           HA       THR  35  -1.964  -5.141   8.482
  255    HB   THR  35           HB       THR  35  -0.084  -4.164   9.635
  256    HG1  THR  35           HG1      THR  35  -1.113  -6.538  10.768
  257   1HG2  THR  35          HG21      THR  35  -1.265  -2.875  11.300
  258   2HG2  THR  35          HG22      THR  35  -0.032  -3.881  12.070
  259   3HG2  THR  35          HG23      THR  35  -1.742  -4.344  12.151
  260    H    PHE  36           H        PHE  36  -4.111  -3.996  10.894
  261    HA   PHE  36           HA       PHE  36  -4.809  -6.480  11.990
  262   1HB   PHE  36          HB2       PHE  36  -5.575  -4.626  13.236
  263   2HB   PHE  36          HB1       PHE  36  -6.214  -3.811  11.838
  264    HD1  PHE  36           HD1      PHE  36  -6.716  -7.201  13.298
  265    HD2  PHE  36           HD2      PHE  36  -8.471  -3.577  12.005
  266    HE1  PHE  36           HE1      PHE  36  -8.956  -8.110  13.827
  267    HE2  PHE  36           HE2      PHE  36 -10.714  -4.460  12.519
  268    HZ   PHE  36           HZ       PHE  36 -10.956  -6.738  13.428
  269    H    HIS  37           H        HIS  37  -6.293  -4.592   9.352
  270    HA   HIS  37           HA       HIS  37  -8.041  -6.751   8.824
  271   1HB   HIS  37          HB2       HIS  37  -9.150  -5.415   7.278
  272   2HB   HIS  37          HB1       HIS  37  -8.362  -4.201   8.270
  273    HD1  HIS  37           HD1      HIS  37  -6.631  -2.696   7.095
  274    HD2  HIS  37           HD2      HIS  37  -8.187  -5.706   4.697
  275    HE1  HIS  37           HE1      HIS  37  -5.976  -2.095   4.725
  276    H    VAL  38           H        VAL  38  -4.904  -5.920   7.754
  277    HA   VAL  38           HA       VAL  38  -4.855  -7.663   5.525
  278    HB   VAL  38           HB       VAL  38  -2.637  -6.548   7.226
  279   1HG1  VAL  38          HG11      VAL  38  -1.913  -8.730   6.321
  280   2HG1  VAL  38          HG12      VAL  38  -1.044  -7.418   5.516
  281   3HG1  VAL  38          HG13      VAL  38  -2.392  -8.221   4.700
  282   1HG2  VAL  38          HG21      VAL  38  -2.118  -5.223   5.257
  283   2HG2  VAL  38          HG22      VAL  38  -3.799  -4.987   5.744
  284   3HG2  VAL  38          HG23      VAL  38  -3.409  -6.014   4.362
  285    H    ASP  39           H        ASP  39  -3.758  -8.115   8.907
  286    HA   ASP  39           HA       ASP  39  -2.950 -10.791   8.437
  287   1HB   ASP  39          HB2       ASP  39  -2.201  -9.390  10.373
  288   2HB   ASP  39          HB1       ASP  39  -3.807  -9.573  11.070
  289    H    SER  40           H        SER  40  -5.948  -9.335   9.075
  290    HA   SER  40           HA       SER  40  -7.239 -11.804   9.848
  291   1HB   SER  40          HB2       SER  40  -7.809  -9.592  10.859
  292   2HB   SER  40          HB1       SER  40  -8.449  -9.097   9.300
  293    HG   SER  40           HG       SER  40 -10.023 -10.603   9.439
  294    H    GLU  41           H        GLU  41  -7.277  -9.598   7.025
  295    HA   GLU  41           HA       GLU  41  -9.216 -11.410   5.769
  296   1HB   GLU  41          HB2       GLU  41  -8.524  -8.617   4.876
  297   2HB   GLU  41          HB1       GLU  41  -9.864  -9.607   4.327
  298   1HG   GLU  41          HG2       GLU  41  -9.501  -8.415   7.061
  299   2HG   GLU  41          HG1       GLU  41 -10.652  -7.894   5.834
  300    H    HIS  42           H        HIS  42  -5.948 -10.266   5.457
  301    HA   HIS  42           HA       HIS  42  -5.670 -11.841   2.983
  302   1HB   HIS  42          HB2       HIS  42  -3.953  -9.408   3.254
  303   2HB   HIS  42          HB1       HIS  42  -4.546 -10.211   1.817
  304    HD1  HIS  42           HD1      HIS  42  -7.331  -9.631   1.464
  305    HD2  HIS  42           HD2      HIS  42  -4.943  -6.994   3.609
  306    HE1  HIS  42           HE1      HIS  42  -8.524  -7.413   1.413
  307    HA   PRO  43           HA       PRO  43  -2.625 -12.411   6.616
  308   1HB   PRO  43          HB2       PRO  43  -2.926 -15.122   6.898
  309   2HB   PRO  43          HB1       PRO  43  -3.907 -13.913   7.747
  310   1HG   PRO  43          HG2       PRO  43  -4.559 -15.412   5.231
  311   2HG   PRO  43          HG1       PRO  43  -5.585 -15.123   6.650
  312   1HD   PRO  43          HD2       PRO  43  -5.832 -13.667   4.443
  313   2HD   PRO  43          HD1       PRO  43  -5.999 -12.950   6.058
  314    H    ASN  44           H        ASN  44  -3.093 -14.624   3.870
  315    HA   ASN  44           HA       ASN  44  -0.205 -14.506   3.432
  316   1HB   ASN  44          HB2       ASN  44  -0.744 -16.740   4.307
  317   2HB   ASN  44          HB1       ASN  44  -1.993 -16.932   3.081
  318   1HD2  ASN  44          HD21      ASN  44   1.439 -16.861   3.689
  319   2HD2  ASN  44          HD22      ASN  44   1.914 -17.526   2.181
  320    H    VAL  45           H        VAL  45   0.072 -13.378   1.667
  321    HA   VAL  45           HA       VAL  45  -1.866 -13.767  -0.464
  322    HB   VAL  45           HB       VAL  45  -1.260 -11.433  -1.253
  323   1HG1  VAL  45          HG11      VAL  45  -3.362 -11.957  -0.254
  324   2HG1  VAL  45          HG12      VAL  45  -2.814 -10.374   0.309
  325   3HG1  VAL  45          HG13      VAL  45  -2.685 -11.793   1.368
  326   1HG2  VAL  45          HG21      VAL  45  -0.452  -9.875   0.449
  327   2HG2  VAL  45          HG22      VAL  45   0.753 -11.115   0.095
  328   3HG2  VAL  45          HG23      VAL  45  -0.210 -11.214   1.569
  329    H    VAL  46           H        VAL  46  -1.194 -14.462  -2.269
  330    HA   VAL  46           HA       VAL  46   1.489 -13.863  -3.085
  331    HB   VAL  46           HB       VAL  46   0.284 -16.655  -3.355
  332   1HG1  VAL  46          HG11      VAL  46   2.409 -17.327  -4.365
  333   2HG1  VAL  46          HG12      VAL  46   2.983 -15.665  -4.272
  334   3HG1  VAL  46          HG13      VAL  46   1.617 -16.064  -5.311
  335   1HG2  VAL  46          HG21      VAL  46   2.136 -17.425  -1.926
  336   2HG2  VAL  46          HG22      VAL  46   1.116 -16.257  -1.085
  337   3HG2  VAL  46          HG23      VAL  46   2.676 -15.757  -1.738
  338    H    LEU  47           H        LEU  47   0.929 -12.508  -4.702
  339    HA   LEU  47           HA       LEU  47  -1.137 -13.446  -6.569
  340   1HB   LEU  47          HB2       LEU  47  -0.312 -10.603  -5.998
  341   2HB   LEU  47          HB1       LEU  47  -1.503 -11.089  -7.186
  342    HG   LEU  47           HG       LEU  47  -1.743 -11.441  -4.193
  343   1HD1  LEU  47          HD11      LEU  47  -3.167  -9.590  -6.089
  344   2HD1  LEU  47          HD12      LEU  47  -1.952  -9.137  -4.893
  345   3HD1  LEU  47          HD13      LEU  47  -3.512  -9.777  -4.369
  346   1HD2  LEU  47          HD21      LEU  47  -2.884 -13.252  -5.373
  347   2HD2  LEU  47          HD22      LEU  47  -3.710 -12.079  -6.398
  348   3HD2  LEU  47          HD23      LEU  47  -4.056 -12.138  -4.671
  349    H    ASN  48           H        ASN  48   1.578 -11.105  -6.882
  350    HA   ASN  48           HA       ASN  48   2.841 -12.478  -9.024
  351   1HB   ASN  48          HB2       ASN  48   0.692 -11.620 -10.141
  352   2HB   ASN  48          HB1       ASN  48   1.205  -9.989  -9.747
  353   1HD2  ASN  48          HD21      ASN  48   1.849 -12.787 -11.729
  354   2HD2  ASN  48          HD22      ASN  48   2.825 -11.973 -12.892
  355    H    SER  49           H        SER  49   3.830  -9.845 -10.159
  356    HA   SER  49           HA       SER  49   5.581  -9.171  -7.947
  357   1HB   SER  49          HB2       SER  49   5.644  -8.282 -10.852
  358   2HB   SER  49          HB1       SER  49   6.948  -8.129  -9.675
  359    HG   SER  49           HG       SER  49   6.590 -10.035 -11.341
  360    H    SER  50           H        SER  50   5.497  -7.142  -6.963
  361    HA   SER  50           HA       SER  50   3.934  -5.008  -7.942
  362   1HB   SER  50          HB2       SER  50   3.145  -6.672  -5.557
  363   2HB   SER  50          HB1       SER  50   2.529  -5.058  -5.885
  364    HG   SER  50           HG       SER  50   2.370  -6.689  -8.039
  365    H    TYR  51           H        TYR  51   3.887  -3.357  -5.946
  366    HA   TYR  51           HA       TYR  51   6.578  -3.356  -4.818
  367   1HB   TYR  51          HB2       TYR  51   5.053  -1.355  -6.322
  368   2HB   TYR  51          HB1       TYR  51   5.937  -0.790  -4.925
  369    HD1  TYR  51           HD1      TYR  51   7.639   0.485  -5.868
  370    HD2  TYR  51           HD2      TYR  51   7.005  -3.447  -7.351
  371    HE1  TYR  51           HE1      TYR  51   9.699   0.653  -7.176
  372    HE2  TYR  51           HE2      TYR  51   9.067  -3.275  -8.677
  373    HH   TYR  51           HH       TYR  51  10.500  -1.603  -9.604
  374    H    VAL  52           H        VAL  52   6.799  -2.802  -2.793
  375    HA   VAL  52           HA       VAL  52   4.425  -2.015  -1.258
  376    HB   VAL  52           HB       VAL  52   4.856  -4.426  -0.973
  377   1HG1  VAL  52          HG11      VAL  52   7.510  -3.608   0.041
  378   2HG1  VAL  52          HG12      VAL  52   7.176  -4.389  -1.515
  379   3HG1  VAL  52          HG13      VAL  52   6.843  -5.237  -0.004
  380   1HG2  VAL  52          HG21      VAL  52   5.679  -2.893   1.469
  381   2HG2  VAL  52          HG22      VAL  52   5.178  -4.586   1.428
  382   3HG2  VAL  52          HG23      VAL  52   4.036  -3.319   0.985
  383    H    CYS  53           H        CYS  53   4.805  -0.498   0.252
  384    HA   CYS  53           HA       CYS  53   7.434   0.818   0.389
  385   1HB   CYS  53          HB2       CYS  53   5.432   2.206   0.395
  386   2HB   CYS  53          HB1       CYS  53   4.776   1.291   1.749
  387    H    VAL  54           H        VAL  54   8.866  -0.431   1.488
  388    HA   VAL  54           HA       VAL  54   8.262  -2.309   3.437
  389    HB   VAL  54           HB       VAL  54  10.755  -1.007   4.030
  390   1HG1  VAL  54          HG11      VAL  54  10.074  -3.578   2.815
  391   2HG1  VAL  54          HG12      VAL  54  10.234  -3.268   4.567
  392   3HG1  VAL  54          HG13      VAL  54  11.646  -3.143   3.472
  393   1HG2  VAL  54          HG21      VAL  54  10.836  -0.168   1.871
  394   2HG2  VAL  54          HG22      VAL  54  10.182  -1.606   1.174
  395   3HG2  VAL  54          HG23      VAL  54  11.830  -1.622   1.836
  396    H    GLU  55           H        GLU  55   8.793   1.075   3.629
  397    HA   GLU  55           HA       GLU  55   9.227   1.529   6.332
  398   1HB   GLU  55          HB2       GLU  55   7.541   3.196   4.468
  399   2HB   GLU  55          HB1       GLU  55   8.323   3.749   5.934
  400   1HG   GLU  55          HG2       GLU  55   9.811   2.734   3.527
  401   2HG   GLU  55          HG1       GLU  55   9.415   4.426   3.799
  402    H    CYS  56           H        CYS  56   6.312   1.174   4.507
  403    HA   CYS  56           HA       CYS  56   4.660   1.282   6.982
  404   1HB   CYS  56          HB2       CYS  56   3.686   1.206   4.158
  405   2HB   CYS  56          HB1       CYS  56   2.828   1.793   5.579
  406    H    ASN  57           H        ASN  57   6.030  -0.909   4.891
  407    HA   ASN  57           HA       ASN  57   5.631  -2.953   4.052
  408   1HB   ASN  57          HB2       ASN  57   4.678  -3.075   6.830
  409   2HB   ASN  57          HB1       ASN  57   4.450  -4.528   5.811
  410   1HD2  ASN  57          HD21      ASN  57   7.020  -3.959   4.374
  411   2HD2  ASN  57          HD22      ASN  57   8.189  -4.436   5.530
  412    H    PHE  58           H        PHE  58   4.105  -1.525   2.723
  413    HA   PHE  58           HA       PHE  58   1.473  -2.769   2.807
  414   1HB   PHE  58          HB2       PHE  58   0.260  -0.857   2.958
  415   2HB   PHE  58          HB1       PHE  58   1.726  -0.165   3.622
  416    HD1  PHE  58           HD1      PHE  58   2.984   1.454   2.298
  417    HD2  PHE  58           HD2      PHE  58  -0.505  -0.341   0.774
  418    HE1  PHE  58           HE1      PHE  58   2.852   3.226   0.523
  419    HE2  PHE  58           HE2      PHE  58  -0.670   1.452  -0.965
  420    HZ   PHE  58           HZ       PHE  58   1.025   3.195  -1.084
  421    H    LEU  59           H        LEU  59   0.941  -3.625   1.033
  422    HA   LEU  59           HA       LEU  59   2.541  -3.167  -1.356
  423   1HB   LEU  59          HB2       LEU  59   0.837  -5.389  -0.359
  424   2HB   LEU  59          HB1       LEU  59   0.836  -5.088  -2.086
  425    HG   LEU  59           HG       LEU  59   3.380  -5.581  -0.562
  426   1HD1  LEU  59          HD11      LEU  59   1.768  -7.472  -0.354
  427   2HD1  LEU  59          HD12      LEU  59   3.187  -7.884  -1.320
  428   3HD1  LEU  59          HD13      LEU  59   1.653  -7.496  -2.115
  429   1HD2  LEU  59          HD21      LEU  59   2.595  -5.738  -3.480
  430   2HD2  LEU  59          HD22      LEU  59   4.165  -6.148  -2.829
  431   3HD2  LEU  59          HD23      LEU  59   3.592  -4.486  -2.749
  432    H    THR  60           H        THR  60   1.579  -2.252  -3.109
  433    HA   THR  60           HA       THR  60  -1.217  -1.599  -2.672
  434    HB   THR  60           HB       THR  60   0.052   0.196  -2.017
  435    HG1  THR  60           HG1      THR  60  -1.789   0.641  -3.240
  436   1HG2  THR  60          HG21      THR  60   1.669   1.390  -3.382
  437   2HG2  THR  60          HG22      THR  60   1.501   0.177  -4.664
  438   3HG2  THR  60          HG23      THR  60   2.125  -0.275  -3.078
  439    H    LYS  61           H        LYS  61  -2.318  -0.874  -4.596
  440    HA   LYS  61           HA       LYS  61  -1.864  -2.873  -6.562
  441   1HB   LYS  61          HB2       LYS  61  -4.077  -2.530  -5.590
  442   2HB   LYS  61          HB1       LYS  61  -4.137  -0.910  -6.242
  443   1HG   LYS  61          HG2       LYS  61  -4.602  -1.634  -8.356
  444   2HG   LYS  61          HG1       LYS  61  -3.782  -3.172  -8.124
  445   1HD   LYS  61          HD2       LYS  61  -6.180  -3.525  -8.321
  446   2HD   LYS  61          HD1       LYS  61  -5.625  -3.946  -6.711
  447   1HE   LYS  61          HE2       LYS  61  -6.911  -1.293  -7.360
  448   2HE   LYS  61          HE1       LYS  61  -7.854  -2.705  -6.936
  449   1HZ   LYS  61          HZ1       LYS  61  -5.887  -1.293  -5.139
  450   2HZ   LYS  61          HZ2       LYS  61  -6.714  -2.694  -4.721
  451   3HZ   LYS  61          HZ3       LYS  61  -7.542  -1.290  -5.053
  452    H    ARG  62           H        ARG  62  -0.483   0.101  -6.442
  453    HA   ARG  62           HA       ARG  62   0.263  -0.226  -9.182
  454   1HB   ARG  62          HB2       ARG  62  -0.371   1.815 -10.177
  455   2HB   ARG  62          HB1       ARG  62  -1.797   1.301  -9.317
  456   1HG   ARG  62          HG2       ARG  62   0.146   3.374  -8.316
  457   2HG   ARG  62          HG1       ARG  62  -1.348   3.744  -9.170
  458   1HD   ARG  62          HD2       ARG  62  -1.036   2.402  -6.506
  459   2HD   ARG  62          HD1       ARG  62  -1.647   4.030  -6.831
  460    HE   ARG  62           HE       ARG  62  -3.339   2.510  -8.237
  461   1HH1  ARG  62          HH11      ARG  62  -2.104   2.107  -4.945
  462   2HH1  ARG  62          HH12      ARG  62  -3.505   1.340  -4.420
  463   1HH2  ARG  62          HH21      ARG  62  -5.331   1.504  -7.390
  464   2HH2  ARG  62          HH22      ARG  62  -5.325   1.061  -5.731
  465    H    TYR  63           H        TYR  63   2.043   1.156  -9.860
  466    HA   TYR  63           HA       TYR  63   4.028   1.102  -7.840
  467   1HB   TYR  63          HB2       TYR  63   4.107   2.098 -10.696
  468   2HB   TYR  63          HB1       TYR  63   5.513   2.017  -9.650
  469    HD1  TYR  63           HD1      TYR  63   6.708   0.016  -9.398
  470    HD2  TYR  63           HD2      TYR  63   2.893  -0.066 -11.274
  471    HE1  TYR  63           HE1      TYR  63   7.094  -2.310 -10.069
  472    HE2  TYR  63           HE2      TYR  63   3.274  -2.401 -11.947
  473    HH   TYR  63           HH       TYR  63   5.126  -3.850 -12.339
  474    H    ASP  64           H        ASP  64   2.122   3.568  -9.316
  475    HA   ASP  64           HA       ASP  64   3.442   5.913  -8.635
  476   1HB   ASP  64          HB2       ASP  64   0.472   5.369  -8.751
  477   2HB   ASP  64          HB1       ASP  64   1.108   6.950  -8.346
  478    H    ALA  65           H        ALA  65   1.458   3.946  -6.523
  479    HA   ALA  65           HA       ALA  65   1.107   5.907  -4.538
  480   1HB   ALA  65          HB1       ALA  65   0.425   4.032  -3.096
  481   2HB   ALA  65          HB2       ALA  65   0.961   2.911  -4.362
  482   3HB   ALA  65          HB3       ALA  65  -0.361   4.027  -4.667
  483    H    LEU  66           H        LEU  66   3.717   3.804  -5.210
  484    HA   LEU  66           HA       LEU  66   5.013   4.175  -2.644
  485   1HB   LEU  66          HB2       LEU  66   6.160   3.117  -5.184
  486   2HB   LEU  66          HB1       LEU  66   6.920   3.004  -3.611
  487    HG   LEU  66           HG       LEU  66   6.126   0.884  -3.967
  488   1HD1  LEU  66          HD11      LEU  66   4.284   0.497  -2.435
  489   2HD1  LEU  66          HD12      LEU  66   3.909   2.217  -2.470
  490   3HD1  LEU  66          HD13      LEU  66   5.446   1.664  -1.790
  491   1HD2  LEU  66          HD21      LEU  66   3.585   2.067  -5.052
  492   2HD2  LEU  66          HD22      LEU  66   3.907   0.338  -4.877
  493   3HD2  LEU  66          HD23      LEU  66   4.883   1.321  -5.974
  494    H    SER  67           H        SER  67   5.151   5.499  -5.834
  495    HA   SER  67           HA       SER  67   7.624   6.871  -5.554
  496   1HB   SER  67          HB2       SER  67   5.282   6.889  -7.317
  497   2HB   SER  67          HB1       SER  67   6.571   8.066  -7.611
  498    HG   SER  67           HG       SER  67   7.207   6.368  -8.786
  499    H    GLU  68           H        GLU  68   4.271   7.776  -5.545
  500    HA   GLU  68           HA       GLU  68   4.730  10.462  -4.785
  501   1HB   GLU  68          HB2       GLU  68   2.023   9.264  -4.387
  502   2HB   GLU  68          HB1       GLU  68   2.522  10.812  -5.042
  503   1HG   GLU  68          HG2       GLU  68   3.465   9.495  -7.022
  504   2HG   GLU  68          HG1       GLU  68   2.554   8.184  -6.389
  505    H    HIS  69           H        HIS  69   4.538   7.561  -3.208
  506    HA   HIS  69           HA       HIS  69   3.393   7.993  -0.766
  507   1HB   HIS  69          HB2       HIS  69   4.572   5.936  -1.665
  508   2HB   HIS  69          HB1       HIS  69   6.027   6.658  -0.928
  509    HD1  HIS  69           HD1      HIS  69   2.577   5.451   0.015
  510    HD2  HIS  69           HD2      HIS  69   6.301   6.175   1.583
  511    HE1  HIS  69           HE1      HIS  69   2.463   4.623   2.398
  512    H    ASN  70           H        ASN  70   6.897   8.611  -1.408
  513    HA   ASN  70           HA       ASN  70   7.273  10.016   1.074
  514   1HB   ASN  70          HB2       ASN  70   9.440  10.747   0.188
  515   2HB   ASN  70          HB1       ASN  70   9.191   9.016   0.070
  516   1HD2  ASN  70          HD21      ASN  70  10.912   9.217  -1.297
  517   2HD2  ASN  70          HD22      ASN  70  10.658   9.483  -3.007
  518    H    LEU  71           H        LEU  71   5.846  10.941  -1.736
  519    HA   LEU  71           HA       LEU  71   6.367  13.754  -1.497
  520   1HB   LEU  71          HB2       LEU  71   5.980  13.176  -3.696
  521   2HB   LEU  71          HB1       LEU  71   4.797  11.960  -3.299
  522    HG   LEU  71           HG       LEU  71   3.135  13.653  -2.954
  523   1HD1  LEU  71          HD11      LEU  71   4.582  15.554  -2.262
  524   2HD1  LEU  71          HD12      LEU  71   3.597  16.026  -3.648
  525   3HD1  LEU  71          HD13      LEU  71   5.296  15.603  -3.874
  526   1HD2  LEU  71          HD21      LEU  71   3.357  12.677  -5.140
  527   2HD2  LEU  71          HD22      LEU  71   4.561  13.877  -5.598
  528   3HD2  LEU  71          HD23      LEU  71   2.895  14.370  -5.303
  529    H    LYS  72           H        LYS  72   3.635  11.617  -0.880
  530    HA   LYS  72           HA       LYS  72   2.398  13.820   0.590
  531   1HB   LYS  72          HB2       LYS  72   0.373  12.029   0.274
  532   2HB   LYS  72          HB1       LYS  72   0.612  13.460  -0.742
  533   1HG   LYS  72          HG2       LYS  72   2.029  11.873  -2.173
  534   2HG   LYS  72          HG1       LYS  72   1.333  10.573  -1.260
  535   1HD   LYS  72          HD2       LYS  72  -0.188  12.585  -2.909
  536   2HD   LYS  72          HD1       LYS  72   0.089  10.884  -3.288
  537   1HE   LYS  72          HE2       LYS  72  -1.312  10.228  -1.334
  538   2HE   LYS  72          HE1       LYS  72  -1.518  11.918  -0.935
  539   1HZ   LYS  72          HZ1       LYS  72  -3.376  10.983  -2.027
  540   2HZ   LYS  72          HZ2       LYS  72  -2.480  10.594  -3.403
  541   3HZ   LYS  72          HZ3       LYS  72  -2.733  12.220  -2.970
  542    H    TYR  73           H        TYR  73   3.189  10.531   0.860
  543    HA   TYR  73           HA       TYR  73   1.965  10.200   3.488
  544   1HB   TYR  73          HB2       TYR  73   3.556   8.360   1.761
  545   2HB   TYR  73          HB1       TYR  73   2.881   7.878   3.320
  546    HD1  TYR  73           HD1      TYR  73   1.787   9.438   0.078
  547    HD2  TYR  73           HD2      TYR  73   0.899   6.753   3.244
  548    HE1  TYR  73           HE1      TYR  73  -0.197   8.765  -1.077
  549    HE2  TYR  73           HE2      TYR  73  -1.135   6.090   2.087
  550    HH   TYR  73           HH       TYR  73  -2.654   7.113   0.470
  551    H    HIS  74           H        HIS  74   5.290   9.898   2.160
  552    HA   HIS  74           HA       HIS  74   6.283  10.532   4.893
  553   1HB   HIS  74          HB2       HIS  74   7.635   8.907   2.719
  554   2HB   HIS  74          HB1       HIS  74   8.413   9.331   4.243
  555    HD1  HIS  74           HD1      HIS  74   5.975   8.439   6.133
  556    HD2  HIS  74           HD2      HIS  74   7.574   6.270   2.985
  557    HE1  HIS  74           HE1      HIS  74   5.231   6.065   6.494
  558    HA   PRO  75           HA       PRO  75   7.356  13.885   1.821
  559   1HB   PRO  75          HB2       PRO  75   6.546  16.003   3.251
  560   2HB   PRO  75          HB1       PRO  75   5.410  15.006   2.330
  561   1HG   PRO  75          HG2       PRO  75   6.075  14.853   5.263
  562   2HG   PRO  75          HG1       PRO  75   4.474  14.863   4.492
  563   1HD   PRO  75          HD2       PRO  75   5.679  12.573   5.286
  564   2HD   PRO  75          HD1       PRO  75   4.649  12.666   3.839
  565    H    GLY  76           H        GLY  76   8.998  15.219   1.646
  566   1HA   GLY  76          HA2       GLY  76  10.449  16.675   3.319
  567   2HA   GLY  76          HA1       GLY  76  11.038  15.061   3.692
  568    H    GLU  77           H        GLU  77  11.014  13.876   1.241
  569    HA   GLU  77           HA       GLU  77  12.505  15.390  -0.692
  570   1HB   GLU  77          HB2       GLU  77  14.519  13.948  -0.541
  571   2HB   GLU  77          HB1       GLU  77  14.321  14.974   0.871
  572   1HG   GLU  77          HG2       GLU  77  13.563  13.150   2.190
  573   2HG   GLU  77          HG1       GLU  77  13.428  12.113   0.770
  574    H    GLU  78           H        GLU  78  13.343  13.697  -2.391
  575    HA   GLU  78           HA       GLU  78  11.375  11.525  -2.485
  576   1HB   GLU  78          HB2       GLU  78  10.795  13.452  -3.981
  577   2HB   GLU  78          HB1       GLU  78  12.359  13.184  -4.754
  578   1HG   GLU  78          HG2       GLU  78  11.667  11.014  -5.493
  579   2HG   GLU  78          HG1       GLU  78  10.108  11.186  -4.680
  580    H    ASN  79           H        ASN  79  12.825   9.998  -1.856
  581    HA   ASN  79           HA       ASN  79  14.800   9.119  -3.799
  582   1HB   ASN  79          HB2       ASN  79  15.662   9.830  -0.972
  583   2HB   ASN  79          HB1       ASN  79  16.672   8.991  -2.146
  584   1HD2  ASN  79          HD21      ASN  79  15.269  11.920  -1.175
  585   2HD2  ASN  79          HD22      ASN  79  16.012  13.009  -2.302
  586    H    PHE  80           H        PHE  80  13.610   7.297  -3.938
  587    HA   PHE  80           HA       PHE  80  13.429   5.587  -1.556
  588   1HB   PHE  80          HB2       PHE  80  11.680   6.038  -3.857
  589   2HB   PHE  80          HB1       PHE  80  11.953   4.353  -3.484
  590    HD1  PHE  80           HD1      PHE  80  10.066   7.271  -2.664
  591    HD2  PHE  80           HD2      PHE  80  11.504   3.608  -1.108
  592    HE1  PHE  80           HE1      PHE  80   8.259   7.283  -0.968
  593    HE2  PHE  80           HE2      PHE  80   9.713   3.594   0.554
  594    HZ   PHE  80           HZ       PHE  80   8.080   5.435   0.628
  595    H    LYS  81           H        LYS  81  14.065   3.459  -1.700
  596    HA   LYS  81           HA       LYS  81  15.867   2.784  -3.936
  597   1HB   LYS  81          HB2       LYS  81  17.379   1.929  -2.390
  598   2HB   LYS  81          HB1       LYS  81  16.519   3.077  -1.348
  599   1HG   LYS  81          HG2       LYS  81  15.139   1.383  -0.448
  600   2HG   LYS  81          HG1       LYS  81  15.753   0.199  -1.591
  601   1HD   LYS  81          HD2       LYS  81  18.041   0.657  -0.550
  602   2HD   LYS  81          HD1       LYS  81  17.102   1.437   0.743
  603   1HE   LYS  81          HE2       LYS  81  15.789  -0.599   1.027
  604   2HE   LYS  81          HE1       LYS  81  16.723  -1.357  -0.257
  605   1HZ   LYS  81          HZ1       LYS  81  18.686  -1.275   1.114
  606   2HZ   LYS  81          HZ2       LYS  81  17.443  -1.985   2.022
  607   3HZ   LYS  81          HZ3       LYS  81  17.879  -0.389   2.305
  608    H    LEU  82           H        LEU  82  15.937   0.274  -4.224
  609    HA   LEU  82           HA       LEU  82  13.320  -0.837  -3.601
  610   1HB   LEU  82          HB2       LEU  82  13.258  -1.998  -5.763
  611   2HB   LEU  82          HB1       LEU  82  13.223  -0.264  -5.952
  612    HG   LEU  82           HG       LEU  82  15.786  -1.800  -6.269
  613   1HD1  LEU  82          HD11      LEU  82  13.703  -1.214  -8.394
  614   2HD1  LEU  82          HD12      LEU  82  14.119  -2.812  -7.778
  615   3HD1  LEU  82          HD13      LEU  82  15.306  -1.884  -8.693
  616   1HD2  LEU  82          HD21      LEU  82  15.940   0.640  -6.103
  617   2HD2  LEU  82          HD22      LEU  82  14.798   0.811  -7.437
  618   3HD2  LEU  82          HD23      LEU  82  16.382   0.090  -7.718
  619    H    THR  83           H        THR  83  13.336  -2.802  -2.744
  620    HA   THR  83           HA       THR  83  15.671  -4.457  -3.055
  621    HB   THR  83           HB       THR  83  16.173  -3.292  -1.018
  622    HG1  THR  83           HG1      THR  83  16.072  -5.794  -1.054
  623   1HG2  THR  83          HG21      THR  83  13.426  -3.998   0.015
  624   2HG2  THR  83          HG22      THR  83  13.932  -2.399  -0.512
  625   3HG2  THR  83          HG23      THR  83  14.674  -3.132   0.918
  626    H    MET  84           H        MET  84  14.782  -6.477  -3.734
  627    HA   MET  84           HA       MET  84  11.927  -6.838  -3.092
  628   1HB   MET  84          HB2       MET  84  12.677  -7.163  -5.445
  629   2HB   MET  84          HB1       MET  84  13.756  -8.430  -4.861
  630   1HG   MET  84          HG2       MET  84  11.836  -9.753  -4.147
  631   2HG   MET  84          HG1       MET  84  10.748  -8.494  -4.719
  632   1HE   MET  84          HE1       MET  84  13.322 -11.279  -5.701
  633   2HE   MET  84          HE2       MET  84  14.084  -9.862  -6.431
  634   3HE   MET  84          HE3       MET  84  13.402 -11.121  -7.452
  635    H    VAL  85           H        VAL  85  11.774  -7.569  -1.153
  636    HA   VAL  85           HA       VAL  85  12.631 -10.258  -0.687
  637    HB   VAL  85           HB       VAL  85  13.182  -9.452   1.799
  638   1HG1  VAL  85          HG11      VAL  85  15.091  -9.095  -0.509
  639   2HG1  VAL  85          HG12      VAL  85  14.798 -10.599   0.369
  640   3HG1  VAL  85          HG13      VAL  85  15.574  -9.232   1.179
  641   1HG2  VAL  85          HG21      VAL  85  13.893  -7.011   0.156
  642   2HG2  VAL  85          HG22      VAL  85  14.341  -7.268   1.843
  643   3HG2  VAL  85          HG23      VAL  85  12.640  -7.070   1.398
  644    H    LYS  86           H        LYS  86  10.548 -11.155  -0.388
  645    HA   LYS  86           HA       LYS  86   9.075  -9.763   1.666
  646   1HB   LYS  86          HB2       LYS  86   8.219  -9.089  -0.656
  647   2HB   LYS  86          HB1       LYS  86   7.551 -10.728  -0.730
  648   1HG   LYS  86          HG2       LYS  86   5.864  -9.254  -0.083
  649   2HG   LYS  86          HG1       LYS  86   6.282 -10.308   1.254
  650   1HD   LYS  86          HD2       LYS  86   7.405  -8.661   2.468
  651   2HD   LYS  86          HD1       LYS  86   7.667  -7.657   1.052
  652   1HE   LYS  86          HE2       LYS  86   5.454  -6.783   1.143
  653   2HE   LYS  86          HE1       LYS  86   4.901  -8.059   2.237
  654   1HZ   LYS  86          HZ1       LYS  86   5.252  -5.981   3.307
  655   2HZ   LYS  86          HZ2       LYS  86   6.912  -5.976   2.793
  656   3HZ   LYS  86          HZ3       LYS  86   6.349  -7.139   3.879
  657    H    ARG  87           H        ARG  87   8.764 -11.075   3.179
  658    HA   ARG  87           HA       ARG  87   8.860 -13.902   2.529
  659   1HB   ARG  87          HB2       ARG  87   9.656 -12.454   5.074
  660   2HB   ARG  87          HB1       ARG  87   9.772 -14.184   4.815
  661   1HG   ARG  87          HG2       ARG  87  11.985 -13.474   4.422
  662   2HG   ARG  87          HG1       ARG  87  11.267 -13.559   2.810
  663   1HD   ARG  87          HD2       ARG  87  12.591 -11.530   3.019
  664   2HD   ARG  87          HD1       ARG  87  10.887 -11.152   2.806
  665    HE   ARG  87           HE       ARG  87  11.848 -11.253   5.536
  666   1HH1  ARG  87          HH11      ARG  87  11.024  -9.065   2.787
  667   2HH1  ARG  87          HH12      ARG  87  11.036  -7.687   3.707
  668   1HH2  ARG  87          HH21      ARG  87  11.867  -9.326   6.777
  669   2HH2  ARG  87          HH22      ARG  87  11.564  -7.808   6.065
  670    H    ASN  88           H        ASN  88   7.422 -15.303   3.593
  671    HA   ASN  88           HA       ASN  88   5.451 -16.035   4.435
  672   1HB   ASN  88          HB2       ASN  88   5.217 -13.319   5.782
  673   2HB   ASN  88          HB1       ASN  88   4.130 -14.669   6.063
  674   1HD2  ASN  88          HD21      ASN  88   5.758 -13.242   7.924
  675   2HD2  ASN  88          HD22      ASN  88   6.834 -14.366   8.661
  676    H    ASN  89           H        ASN  89   5.817 -14.144   2.108
  677    HA   ASN  89           HA       ASN  89   3.027 -14.033   1.257
  678   1HB   ASN  89          HB2       ASN  89   4.896 -11.632   1.095
  679   2HB   ASN  89          HB1       ASN  89   3.281 -11.707   0.431
  680   1HD2  ASN  89          HD21      ASN  89   5.187 -11.281   3.265
  681   2HD2  ASN  89          HD22      ASN  89   3.950 -10.749   4.316
  682    H    GLN  90           H        GLN  90   3.866 -12.475  -1.094
  683    HA   GLN  90           HA       GLN  90   5.393 -14.528  -2.495
  684   1HB   GLN  90          HB2       GLN  90   4.760 -13.357  -4.496
  685   2HB   GLN  90          HB1       GLN  90   3.287 -13.676  -3.541
  686   1HG   GLN  90          HG2       GLN  90   4.750 -11.103  -3.590
  687   2HG   GLN  90          HG1       GLN  90   3.475 -11.469  -4.764
  688   1HE2  GLN  90          HE21      GLN  90   4.274 -10.579  -1.547
  689   2HE2  GLN  90          HE22      GLN  90   2.644 -10.348  -0.982
  690    H    THR  91           H        THR  91   7.060 -13.554  -4.050
  691    HA   THR  91           HA       THR  91   8.448 -11.575  -2.511
  692    HB   THR  91           HB       THR  91  10.310 -12.194  -4.271
  693    HG1  THR  91           HG1      THR  91   9.903 -13.918  -5.444
  694   1HG2  THR  91          HG21      THR  91  11.023 -14.059  -2.790
  695   2HG2  THR  91          HG22      THR  91   9.407 -14.146  -2.109
  696   3HG2  THR  91          HG23      THR  91  10.392 -12.738  -1.814
  697    H    ILE  92           H        ILE  92   8.176  -9.718  -2.883
  698    HA   ILE  92           HA       ILE  92   7.693  -8.551  -5.448
  699    HB   ILE  92           HB       ILE  92   6.082  -6.963  -4.212
  700   1HG1  ILE  92          HG12      ILE  92   4.759  -8.379  -2.444
  701   2HG1  ILE  92          HG11      ILE  92   6.302  -9.176  -2.292
  702   1HG2  ILE  92          HG21      ILE  92   4.146  -8.417  -4.591
  703   2HG2  ILE  92          HG22      ILE  92   5.267  -9.766  -4.860
  704   3HG2  ILE  92          HG23      ILE  92   5.282  -8.381  -5.928
  705   1HD1  ILE  92          HD11      ILE  92   7.454  -7.182  -1.747
  706   2HD1  ILE  92          HD12      ILE  92   6.063  -7.323  -0.684
  707   3HD1  ILE  92          HD13      ILE  92   6.035  -6.204  -2.042
  708    H    PHE  93           H        PHE  93   8.061  -6.139  -5.365
  709    HA   PHE  93           HA       PHE  93  10.716  -5.932  -4.202
  710   1HB   PHE  93          HB2       PHE  93   9.148  -4.130  -6.022
  711   2HB   PHE  93          HB1       PHE  93  10.823  -3.889  -5.605
  712    HD1  PHE  93           HD1      PHE  93   8.424  -5.765  -7.598
  713    HD2  PHE  93           HD2      PHE  93  12.516  -5.289  -6.583
  714    HE1  PHE  93           HE1      PHE  93   9.049  -7.039  -9.604
  715    HE2  PHE  93           HE2      PHE  93  13.167  -6.574  -8.599
  716    HZ   PHE  93           HZ       PHE  93  11.417  -7.440 -10.110
  717    H    GLU  94           H        GLU  94  11.003  -4.860  -2.353
  718    HA   GLU  94           HA       GLU  94   8.895  -3.181  -1.352
  719   1HB   GLU  94          HB2       GLU  94  11.410  -4.104   0.100
  720   2HB   GLU  94          HB1       GLU  94   9.976  -3.364   0.786
  721   1HG   GLU  94          HG2       GLU  94   8.795  -5.436  -0.179
  722   2HG   GLU  94          HG1       GLU  94  10.395  -6.175  -0.066
  723    H    GLN  95           H        GLN  95   9.250  -1.100  -0.951
  724    HA   GLN  95           HA       GLN  95  11.716   0.005  -2.110
  725   1HB   GLN  95          HB2       GLN  95   9.468   0.236  -3.385
  726   2HB   GLN  95          HB1       GLN  95   9.027   1.377  -2.122
  727   1HG   GLN  95          HG2       GLN  95  10.859   2.789  -2.683
  728   2HG   GLN  95          HG1       GLN  95  11.477   1.597  -3.822
  729   1HE2  GLN  95          HE21      GLN  95   9.141   4.087  -3.237
  730   2HE2  GLN  95          HE22      GLN  95   8.597   4.217  -4.868
  731    H    THR  96           H        THR  96  12.939   0.857  -0.500
  732    HA   THR  96           HA       THR  96  11.604   2.039   1.850
  733    HB   THR  96           HB       THR  96  14.410   1.654   2.252
  734    HG1  THR  96           HG1      THR  96  14.106  -0.774   2.232
  735   1HG2  THR  96          HG21      THR  96  12.770   1.794   4.049
  736   2HG2  THR  96          HG22      THR  96  13.590   0.226   4.127
  737   3HG2  THR  96          HG23      THR  96  11.975   0.342   3.458
  738    H    ILE  97           H        ILE  97  12.777   3.830   2.819
  739    HA   ILE  97           HA       ILE  97  13.934   5.599   0.759
  740    HB   ILE  97           HB       ILE  97  12.936   6.447   3.502
  741   1HG1  ILE  97          HG12      ILE  97  11.290   6.593   1.023
  742   2HG1  ILE  97          HG11      ILE  97  11.265   5.101   1.914
  743   1HG2  ILE  97          HG21      ILE  97  14.346   7.943   1.998
  744   2HG2  ILE  97          HG22      ILE  97  12.777   8.583   2.403
  745   3HG2  ILE  97          HG23      ILE  97  13.050   7.849   0.804
  746   1HD1  ILE  97          HD11      ILE  97   9.442   6.177   2.656
  747   2HD1  ILE  97          HD12      ILE  97  10.133   7.764   2.581
  748   3HD1  ILE  97          HD13      ILE  97  10.577   6.648   3.912
  749    H    ASN  98           H        ASN  98  15.723   6.854   1.356
  750    HA   ASN  98           HA       ASN  98  17.518   5.417   3.115
  751   1HB   ASN  98          HB2       ASN  98  19.230   6.951   1.984
  752   2HB   ASN  98          HB1       ASN  98  18.465   5.728   0.969
  753   1HD2  ASN  98          HD21      ASN  98  16.965   8.813   1.965
  754   2HD2  ASN  98          HD22      ASN  98  16.926   9.453   0.384
  755    H    ASP  99           H        ASP  99  15.289   7.566   3.744
  756    HA   ASP  99           HA       ASP  99  16.868   8.976   5.738
  757   1HB   ASP  99          HB2       ASP  99  17.055  10.130   3.463
  758   2HB   ASP  99          HB1       ASP  99  15.431  10.679   3.797
  759    H    LEU 100           H        LEU 100  13.731   9.053   3.960
  760    HA   LEU 100           HA       LEU 100  12.316  10.354   6.075
  761   1HB   LEU 100          HB2       LEU 100  11.131   8.912   3.646
  762   2HB   LEU 100          HB1       LEU 100  10.410  10.106   4.679
  763    HG   LEU 100           HG       LEU 100  12.852  10.997   3.271
  764   1HD1  LEU 100          HD11      LEU 100  11.739   9.778   1.462
  765   2HD1  LEU 100          HD12      LEU 100  11.445  11.506   1.281
  766   3HD1  LEU 100          HD13      LEU 100  10.206  10.465   1.979
  767   1HD2  LEU 100          HD21      LEU 100  10.126  12.157   3.636
  768   2HD2  LEU 100          HD22      LEU 100  11.552  12.956   3.023
  769   3HD2  LEU 100          HD23      LEU 100  11.496  12.450   4.737
  770    H    THR 101           H        THR 101  13.540   7.479   5.937
  771    HA   THR 101           HA       THR 101  11.694   5.567   6.678
  772    HB   THR 101           HB       THR 101  14.628   5.873   7.282
  773    HG1  THR 101           HG1      THR 101  13.325   4.742   5.065
  774   1HG2  THR 101          HG21      THR 101  14.703   3.430   7.106
  775   2HG2  THR 101          HG22      THR 101  12.979   3.384   6.789
  776   3HG2  THR 101          HG23      THR 101  13.570   3.894   8.380
  777    H    PHE 102           H        PHE 102  13.264   8.171   8.313
  778    HA   PHE 102           HA       PHE 102  12.710   7.021  10.956
  779   1HB   PHE 102          HB2       PHE 102  14.661   9.201  10.193
  780   2HB   PHE 102          HB1       PHE 102  14.429   8.551  11.811
  781    HD1  PHE 102           HD1      PHE 102  15.117   6.238  12.325
  782    HD2  PHE 102           HD2      PHE 102  15.952   8.030   8.561
  783    HE1  PHE 102           HE1      PHE 102  16.757   4.470  11.851
  784    HE2  PHE 102           HE2      PHE 102  17.598   6.270   8.080
  785    HZ   PHE 102           HZ       PHE 102  17.998   4.482   9.726
  Start of MODEL   18
    1    HA   MET   1           HA       MET   1  14.111   7.721 -13.480
    2   1HB   MET   1          HB2       MET   1  14.722   8.743 -10.711
    3   2HB   MET   1          HB1       MET   1  13.176   8.012 -11.107
    4   1HG   MET   1          HG2       MET   1  14.650   6.418 -10.041
    5   2HG   MET   1          HG1       MET   1  14.303   5.935 -11.696
    6   1HE   MET   1          HE1       MET   1  16.623   4.695  -9.922
    7   2HE   MET   1          HE2       MET   1  17.939   4.619 -11.094
    8   3HE   MET   1          HE3       MET   1  16.300   4.188 -11.580
    9    H    ALA   2           H        ALA   2  11.954   8.329 -13.362
   10    HA   ALA   2           HA       ALA   2  10.220   9.574 -13.822
   11   1HB   ALA   2          HB1       ALA   2   9.569  11.243 -12.261
   12   2HB   ALA   2          HB2       ALA   2  11.237  11.519 -11.780
   13   3HB   ALA   2          HB3       ALA   2  10.452   9.987 -11.386
   14    H    HIS   3           H        HIS   3  10.953   9.958 -15.933
   15    HA   HIS   3           HA       HIS   3  11.547  12.761 -16.505
   16   1HB   HIS   3          HB2       HIS   3  11.204  10.344 -18.311
   17   2HB   HIS   3          HB1       HIS   3  11.377  11.982 -18.937
   18    HD1  HIS   3           HD1      HIS   3  13.736  12.695 -19.387
   19    HD2  HIS   3           HD2      HIS   3  13.523   9.547 -16.697
   20    HE1  HIS   3           HE1      HIS   3  16.099  12.061 -18.888
   21    H    HIS   4           H        HIS   4   9.091  10.499 -16.237
   22    HA   HIS   4           HA       HIS   4   7.076  12.475 -16.965
   23   1HB   HIS   4          HB2       HIS   4   6.842   9.451 -16.696
   24   2HB   HIS   4          HB1       HIS   4   5.529  10.542 -17.109
   25    HD1  HIS   4           HD1      HIS   4   8.326   8.608 -18.631
   26    HD2  HIS   4           HD2      HIS   4   5.733  11.675 -19.725
   27    HE1  HIS   4           HE1      HIS   4   8.450   8.769 -21.121
   28    H    HIS   5           H        HIS   5   6.094  13.301 -15.213
   29    HA   HIS   5           HA       HIS   5   6.870  12.259 -12.629
   30   1HB   HIS   5          HB2       HIS   5   6.917  14.711 -13.107
   31   2HB   HIS   5          HB1       HIS   5   5.184  14.681 -13.353
   32    HD1  HIS   5           HD1      HIS   5   7.656  13.976 -10.467
   33    HD2  HIS   5           HD2      HIS   5   3.791  15.337 -11.181
   34    HE1  HIS   5           HE1      HIS   5   6.752  14.681  -8.254
   35    H    HIS   6           H        HIS   6   4.305  12.169 -14.811
   36    HA   HIS   6           HA       HIS   6   2.454  10.959 -15.004
   37   1HB   HIS   6          HB2       HIS   6   3.462   9.516 -12.543
   38   2HB   HIS   6          HB1       HIS   6   2.027   9.024 -13.431
   39    HD1  HIS   6           HD1      HIS   6   2.519   8.233 -16.020
   40    HD2  HIS   6           HD2      HIS   6   5.806   8.548 -13.494
   41    HE1  HIS   6           HE1      HIS   6   4.371   6.962 -17.127
   42    H    HIS   7           H        HIS   7   2.526  13.418 -13.403
   43    HA   HIS   7           HA       HIS   7   0.226  12.955 -11.707
   44   1HB   HIS   7          HB2       HIS   7   1.986  14.541 -10.910
   45   2HB   HIS   7          HB1       HIS   7   1.568  15.635 -12.234
   46    HD1  HIS   7           HD1      HIS   7   0.075  17.512 -11.346
   47    HD2  HIS   7           HD2      HIS   7  -0.551  13.903  -9.387
   48    HE1  HIS   7           HE1      HIS   7  -1.689  17.952  -9.614
   49    H    HIS   8           H        HIS   8  -1.144  12.292 -13.176
   50    HA   HIS   8           HA       HIS   8  -1.831  13.743 -15.523
   51   1HB   HIS   8          HB2       HIS   8  -1.977  11.277 -15.371
   52   2HB   HIS   8          HB1       HIS   8  -3.220  11.436 -14.145
   53    HD1  HIS   8           HD1      HIS   8  -2.740  12.420 -17.827
   54    HD2  HIS   8           HD2      HIS   8  -5.695  11.323 -15.125
   55    HE1  HIS   8           HE1      HIS   8  -4.862  12.177 -19.159
   56    H    ASN   9           H        ASN   9  -3.268  13.266 -12.360
   57    HA   ASN   9           HA       ASN   9  -4.457  15.763 -12.076
   58   1HB   ASN   9          HB2       ASN   9  -6.794  15.551 -12.597
   59   2HB   ASN   9          HB1       ASN   9  -5.944  14.972 -14.017
   60   1HD2  ASN   9          HD21      ASN   9  -8.145  14.190 -11.495
   61   2HD2  ASN   9          HD22      ASN   9  -8.499  12.591 -11.998
   62    H    GLN  10           H        GLN  10  -4.259  12.443 -11.335
   63    HA   GLN  10           HA       GLN  10  -4.302  11.281  -9.489
   64   1HB   GLN  10          HB2       GLN  10  -4.750  13.907  -8.119
   65   2HB   GLN  10          HB1       GLN  10  -4.902  12.397  -7.229
   66   1HG   GLN  10          HG2       GLN  10  -2.488  13.291  -8.764
   67   2HG   GLN  10          HG1       GLN  10  -2.683  13.361  -7.008
   68   1HE2  GLN  10          HE21      GLN  10  -2.690  11.468  -5.862
   69   2HE2  GLN  10          HE22      GLN  10  -2.005  10.003  -6.457
   70    H    GLN  11           H        GLN  11  -5.614   9.837  -9.568
   71    HA   GLN  11           HA       GLN  11  -8.457  10.395  -9.493
   72   1HB   GLN  11          HB2       GLN  11  -6.974   7.805  -9.951
   73   2HB   GLN  11          HB1       GLN  11  -8.692   8.084 -10.181
   74   1HG   GLN  11          HG2       GLN  11  -8.225   9.624 -11.990
   75   2HG   GLN  11          HG1       GLN  11  -6.495   9.414 -11.740
   76   1HE2  GLN  11          HE21      GLN  11  -8.840   6.823 -11.519
   77   2HE2  GLN  11          HE22      GLN  11  -8.278   5.975 -12.896
   78    H    ASN  12           H        ASN  12  -9.586   9.905  -7.733
   79    HA   ASN  12           HA       ASN  12  -8.207   9.683  -5.285
   80   1HB   ASN  12          HB2       ASN  12 -11.144   9.535  -5.884
   81   2HB   ASN  12          HB1       ASN  12 -10.467   9.599  -4.258
   82   1HD2  ASN  12          HD21      ASN  12  -9.503  11.468  -3.558
   83   2HD2  ASN  12          HD22      ASN  12  -9.762  12.988  -4.338
   84    H    LYS  13           H        LYS  13  -9.209   7.246  -7.352
   85    HA   LYS  13           HA       LYS  13  -9.606   5.227  -5.362
   86   1HB   LYS  13          HB2       LYS  13 -10.469   5.102  -7.695
   87   2HB   LYS  13          HB1       LYS  13  -8.819   4.895  -8.263
   88   1HG   LYS  13          HG2       LYS  13  -8.689   2.839  -6.833
   89   2HG   LYS  13          HG1       LYS  13 -10.408   3.024  -6.520
   90   1HD   LYS  13          HD2       LYS  13  -9.163   2.668  -9.256
   91   2HD   LYS  13          HD1       LYS  13  -9.869   1.380  -8.308
   92   1HE   LYS  13          HE2       LYS  13 -11.454   2.037  -9.984
   93   2HE   LYS  13          HE1       LYS  13 -12.077   2.538  -8.423
   94   1HZ   LYS  13          HZ1       LYS  13 -10.729   4.362 -10.387
   95   2HZ   LYS  13          HZ2       LYS  13 -11.556   4.830  -8.971
   96   3HZ   LYS  13          HZ3       LYS  13 -12.379   4.161 -10.242
   97    H    LYS  14           H        LYS  14  -6.879   6.711  -6.959
   98    HA   LYS  14           HA       LYS  14  -5.284   4.494  -6.086
   99   1HB   LYS  14          HB2       LYS  14  -3.505   5.216  -7.676
  100   2HB   LYS  14          HB1       LYS  14  -4.995   4.698  -8.423
  101   1HG   LYS  14          HG2       LYS  14  -4.461   6.519  -9.704
  102   2HG   LYS  14          HG1       LYS  14  -5.494   7.261  -8.490
  103   1HD   LYS  14          HD2       LYS  14  -3.581   8.706  -8.679
  104   2HD   LYS  14          HD1       LYS  14  -3.440   7.727  -7.197
  105   1HE   LYS  14          HE2       LYS  14  -1.747   6.449  -7.963
  106   2HE   LYS  14          HE1       LYS  14  -2.103   6.744  -9.681
  107   1HZ   LYS  14          HZ1       LYS  14  -0.159   7.955  -9.131
  108   2HZ   LYS  14          HZ2       LYS  14  -0.800   8.502  -7.683
  109   3HZ   LYS  14          HZ3       LYS  14  -1.389   9.107  -9.131
  110    H    VAL  15           H        VAL  15  -5.497   5.158  -4.050
  111    HA   VAL  15           HA       VAL  15  -4.470   5.607  -2.182
  112    HB   VAL  15           HB       VAL  15  -2.372   5.215  -3.951
  113   1HG1  VAL  15          HG11      VAL  15  -1.631   7.484  -4.001
  114   2HG1  VAL  15          HG12      VAL  15  -0.511   6.530  -2.995
  115   3HG1  VAL  15          HG13      VAL  15  -1.705   7.583  -2.237
  116   1HG2  VAL  15          HG21      VAL  15  -2.509   5.450  -1.026
  117   2HG2  VAL  15          HG22      VAL  15  -1.179   4.615  -1.860
  118   3HG2  VAL  15          HG23      VAL  15  -2.859   3.999  -1.956
  119    H    GLU  16           H        GLU  16  -5.319   6.993  -0.966
  120    HA   GLU  16           HA       GLU  16  -5.149   9.771  -1.680
  121   1HB   GLU  16          HB2       GLU  16  -6.773   8.333   0.399
  122   2HB   GLU  16          HB1       GLU  16  -6.878  10.065   0.069
  123   1HG   GLU  16          HG2       GLU  16  -7.168   8.056  -2.043
  124   2HG   GLU  16          HG1       GLU  16  -8.571   8.465  -1.037
  125    H    GLY  17           H        GLY  17  -5.239   8.402   1.573
  126   1HA   GLY  17          HA2       GLY  17  -2.589   9.553   1.968
  127   2HA   GLY  17          HA1       GLY  17  -3.890  10.023   3.069
  128    H    GLY  18           H        GLY  18  -4.620   6.979   2.418
  129   1HA   GLY  18          HA2       GLY  18  -3.038   6.104   4.681
  130   2HA   GLY  18          HA1       GLY  18  -4.603   5.423   4.243
  131    H    TYR  19           H        TYR  19  -3.688   3.356   4.369
  132    HA   TYR  19           HA       TYR  19  -1.595   2.746   2.410
  133   1HB   TYR  19          HB2       TYR  19  -2.568   1.036   4.690
  134   2HB   TYR  19          HB1       TYR  19  -1.059   0.866   3.786
  135    HD1  TYR  19           HD1      TYR  19  -2.228   1.714   6.883
  136    HD2  TYR  19           HD2      TYR  19   0.279   3.339   3.841
  137    HE1  TYR  19           HE1      TYR  19  -1.176   3.157   8.535
  138    HE2  TYR  19           HE2      TYR  19   1.357   4.791   5.514
  139    HH   TYR  19           HH       TYR  19   0.750   5.797   7.718
  140    H    GLU  20           H        GLU  20  -2.341   2.089   0.596
  141    HA   GLU  20           HA       GLU  20  -4.881   0.693   0.434
  142   1HB   GLU  20          HB2       GLU  20  -4.533   2.444  -1.226
  143   2HB   GLU  20          HB1       GLU  20  -2.995   1.719  -1.701
  144   1HG   GLU  20          HG2       GLU  20  -4.276  -0.348  -2.304
  145   2HG   GLU  20          HG1       GLU  20  -5.744   0.584  -2.071
  146    H    CYS  21           H        CYS  21  -4.805  -1.410   0.618
  147    HA   CYS  21           HA       CYS  21  -2.473  -2.999   0.368
  148   1HB   CYS  21          HB2       CYS  21  -5.318  -3.917   0.098
  149   2HB   CYS  21          HB1       CYS  21  -3.923  -4.900   0.555
  150    H    LYS  22           H        LYS  22  -1.863  -4.373  -1.277
  151    HA   LYS  22           HA       LYS  22  -2.675  -3.870  -3.944
  152   1HB   LYS  22          HB2       LYS  22  -0.382  -4.571  -3.467
  153   2HB   LYS  22          HB1       LYS  22  -0.946  -6.045  -2.709
  154   1HG   LYS  22          HG2       LYS  22  -1.506  -5.558  -5.618
  155   2HG   LYS  22          HG1       LYS  22   0.082  -6.120  -5.106
  156   1HD   LYS  22          HD2       LYS  22  -0.843  -8.078  -4.134
  157   2HD   LYS  22          HD1       LYS  22  -2.490  -7.494  -4.341
  158   1HE   LYS  22          HE2       LYS  22  -2.033  -9.161  -6.040
  159   2HE   LYS  22          HE1       LYS  22  -2.169  -7.587  -6.808
  160   1HZ   LYS  22          HZ1       LYS  22  -0.344  -8.767  -7.721
  161   2HZ   LYS  22          HZ2       LYS  22   0.295  -9.115  -6.234
  162   3HZ   LYS  22          HZ3       LYS  22   0.327  -7.513  -6.804
  163    H    TYR  23           H        TYR  23  -3.741  -5.996  -1.441
  164    HA   TYR  23           HA       TYR  23  -4.981  -7.774  -3.362
  165   1HB   TYR  23          HB2       TYR  23  -5.281  -8.752  -0.704
  166   2HB   TYR  23          HB1       TYR  23  -4.355  -9.436  -2.026
  167    HD1  TYR  23           HD1      TYR  23  -1.916  -8.844  -2.250
  168    HD2  TYR  23           HD2      TYR  23  -4.203  -7.630   1.130
  169    HE1  TYR  23           HE1      TYR  23   0.147  -8.441  -0.970
  170    HE2  TYR  23           HE2      TYR  23  -2.204  -7.240   2.377
  171    HH   TYR  23           HH       TYR  23   0.080  -7.945   2.412
  172    H    CYS  24           H        CYS  24  -5.899  -5.074  -1.872
  173    HA   CYS  24           HA       CYS  24  -8.615  -5.786  -2.231
  174   1HB   CYS  24          HB2       CYS  24  -9.457  -5.315   0.013
  175   2HB   CYS  24          HB1       CYS  24  -8.185  -6.532   0.101
  176    H    THR  25           H        THR  25  -9.975  -3.861  -2.247
  177    HA   THR  25           HA       THR  25  -8.393  -1.543  -2.943
  178    HB   THR  25           HB       THR  25 -11.382  -2.047  -3.299
  179    HG1  THR  25           HG1      THR  25 -10.791  -3.201  -4.997
  180   1HG2  THR  25          HG21      THR  25 -10.721   0.352  -3.475
  181   2HG2  THR  25          HG22      THR  25 -11.217  -0.297  -5.036
  182   3HG2  THR  25          HG23      THR  25  -9.506  -0.085  -4.678
  183    H    PHE  26           H        PHE  26  -9.436  -2.718  -0.183
  184    HA   PHE  26           HA       PHE  26 -10.560  -0.306   0.923
  185   1HB   PHE  26          HB2       PHE  26 -11.302  -2.566   1.724
  186   2HB   PHE  26          HB1       PHE  26  -9.686  -2.824   2.373
  187    HD1  PHE  26           HD1      PHE  26 -12.854  -1.064   2.793
  188    HD2  PHE  26           HD2      PHE  26  -8.928  -1.593   4.353
  189    HE1  PHE  26           HE1      PHE  26 -13.532   0.045   4.883
  190    HE2  PHE  26           HE2      PHE  26  -9.603  -0.485   6.436
  191    HZ   PHE  26           HZ       PHE  26 -11.906   0.336   6.705
  192    H    GLN  27           H        GLN  27  -9.324   1.293   1.365
  193    HA   GLN  27           HA       GLN  27  -6.566   0.897   2.242
  194   1HB   GLN  27          HB2       GLN  27  -6.359   2.252   0.361
  195   2HB   GLN  27          HB1       GLN  27  -7.927   3.021   0.632
  196   1HG   GLN  27          HG2       GLN  27  -6.994   4.391   2.373
  197   2HG   GLN  27          HG1       GLN  27  -5.490   3.502   2.312
  198   1HE2  GLN  27          HE21      GLN  27  -4.063   4.035   0.946
  199   2HE2  GLN  27          HE22      GLN  27  -4.031   5.394  -0.110
  200    H    THR  28           H        THR  28  -5.921   1.796   4.093
  201    HA   THR  28           HA       THR  28  -7.646   3.632   5.455
  202    HB   THR  28           HB       THR  28  -8.428   1.496   6.396
  203    HG1  THR  28           HG1      THR  28  -8.514   2.929   7.951
  204   1HG2  THR  28          HG21      THR  28  -5.568   1.068   7.278
  205   2HG2  THR  28          HG22      THR  28  -6.372   0.158   6.003
  206   3HG2  THR  28          HG23      THR  28  -6.928   0.032   7.672
  207    HA   PRO  29           HA       PRO  29  -3.574   5.260   6.302
  208   1HB   PRO  29          HB2       PRO  29  -4.348   7.333   7.841
  209   2HB   PRO  29          HB1       PRO  29  -4.562   7.319   6.085
  210   1HG   PRO  29          HG2       PRO  29  -6.556   6.670   8.226
  211   2HG   PRO  29          HG1       PRO  29  -6.752   7.697   6.794
  212   1HD   PRO  29          HD2       PRO  29  -7.642   5.149   6.847
  213   2HD   PRO  29          HD1       PRO  29  -6.963   5.866   5.363
  214    H    ASP  30           H        ASP  30  -5.541   3.650   8.405
  215    HA   ASP  30           HA       ASP  30  -3.921   4.179  10.781
  216   1HB   ASP  30          HB2       ASP  30  -6.591   3.556  10.511
  217   2HB   ASP  30          HB1       ASP  30  -5.834   2.025  10.621
  218    H    LEU  31           H        LEU  31  -2.129   2.953  10.985
  219    HA   LEU  31           HA       LEU  31  -1.571   0.781   9.364
  220   1HB   LEU  31          HB2       LEU  31  -0.103   2.345  10.869
  221   2HB   LEU  31          HB1       LEU  31  -0.328   1.094  12.070
  222    HG   LEU  31           HG       LEU  31   1.792   0.718  11.013
  223   1HD1  LEU  31          HD11      LEU  31   1.516  -1.491   9.970
  224   2HD1  LEU  31          HD12      LEU  31  -0.229  -1.152   9.881
  225   3HD1  LEU  31          HD13      LEU  31   0.546  -1.310  11.449
  226   1HD2  LEU  31          HD21      LEU  31   0.311   0.805   8.420
  227   2HD2  LEU  31          HD22      LEU  31   2.043   0.469   8.600
  228   3HD2  LEU  31          HD23      LEU  31   1.374   2.052   9.050
  229    H    ASN  32           H        ASN  32  -3.035   1.014  12.629
  230    HA   ASN  32           HA       ASN  32  -2.808  -1.700  13.268
  231   1HB   ASN  32          HB2       ASN  32  -3.349   0.109  14.898
  232   2HB   ASN  32          HB1       ASN  32  -4.892   0.270  14.031
  233   1HD2  ASN  32          HD21      ASN  32  -6.514  -1.171  14.342
  234   2HD2  ASN  32          HD22      ASN  32  -6.419  -2.388  15.553
  235    H    MET  33           H        MET  33  -5.284   0.292  11.814
  236    HA   MET  33           HA       MET  33  -7.146  -1.866  11.534
  237   1HB   MET  33          HB2       MET  33  -7.133   0.694   9.925
  238   2HB   MET  33          HB1       MET  33  -8.468  -0.422  10.107
  239   1HG   MET  33          HG2       MET  33  -7.208   1.194  12.259
  240   2HG   MET  33          HG1       MET  33  -8.762   1.538  11.496
  241   1HE   MET  33          HE1       MET  33  -9.982  -1.451  11.269
  242   2HE   MET  33          HE2       MET  33 -10.917  -0.054  11.806
  243   3HE   MET  33          HE3       MET  33 -10.913  -1.532  12.763
  244    H    PHE  34           H        PHE  34  -4.699  -0.436   9.518
  245    HA   PHE  34           HA       PHE  34  -5.233  -1.877   7.181
  246   1HB   PHE  34          HB2       PHE  34  -3.672  -0.050   7.113
  247   2HB   PHE  34          HB1       PHE  34  -2.637  -0.805   8.298
  248    HD1  PHE  34           HD1      PHE  34  -0.936  -2.256   7.655
  249    HD2  PHE  34           HD2      PHE  34  -3.889  -1.154   4.780
  250    HE1  PHE  34           HE1      PHE  34   0.399  -3.317   5.851
  251    HE2  PHE  34           HE2      PHE  34  -2.567  -2.198   3.012
  252    HZ   PHE  34           HZ       PHE  34  -0.428  -3.281   3.538
  253    H    THR  35           H        THR  35  -2.972  -2.686   9.787
  254    HA   THR  35           HA       THR  35  -2.415  -5.203   8.573
  255    HB   THR  35           HB       THR  35  -0.638  -4.105   9.862
  256    HG1  THR  35           HG1      THR  35   0.183  -5.900  10.623
  257   1HG2  THR  35          HG21      THR  35  -0.696  -4.079  12.330
  258   2HG2  THR  35          HG22      THR  35  -2.390  -4.603  12.269
  259   3HG2  THR  35          HG23      THR  35  -1.911  -3.048  11.578
  260    H    PHE  36           H        PHE  36  -4.690  -4.117  10.916
  261    HA   PHE  36           HA       PHE  36  -5.434  -6.626  11.950
  262   1HB   PHE  36          HB2       PHE  36  -6.177  -4.727  13.179
  263   2HB   PHE  36          HB1       PHE  36  -6.848  -3.957  11.774
  264    HD1  PHE  36           HD1      PHE  36  -9.111  -3.788  11.911
  265    HD2  PHE  36           HD2      PHE  36  -7.281  -7.335  13.345
  266    HE1  PHE  36           HE1      PHE  36 -11.336  -4.700  12.471
  267    HE2  PHE  36           HE2      PHE  36  -9.489  -8.258  13.930
  268    HZ   PHE  36           HZ       PHE  36 -11.522  -6.938  13.487
  269    H    HIS  37           H        HIS  37  -6.747  -4.666   9.277
  270    HA   HIS  37           HA       HIS  37  -8.495  -6.768   8.635
  271   1HB   HIS  37          HB2       HIS  37  -9.448  -5.456   6.936
  272   2HB   HIS  37          HB1       HIS  37  -8.804  -4.281   8.069
  273    HD1  HIS  37           HD1      HIS  37  -7.229  -2.570   7.136
  274    HD2  HIS  37           HD2      HIS  37  -8.013  -5.688   4.523
  275    HE1  HIS  37           HE1      HIS  37  -6.269  -1.850   4.900
  276    H    VAL  38           H        VAL  38  -5.274  -6.076   7.830
  277    HA   VAL  38           HA       VAL  38  -4.960  -7.846   5.657
  278    HB   VAL  38           HB       VAL  38  -3.005  -7.145   7.867
  279   1HG1  VAL  38          HG11      VAL  38  -1.242  -8.180   6.469
  280   2HG1  VAL  38          HG12      VAL  38  -2.490  -8.696   5.325
  281   3HG1  VAL  38          HG13      VAL  38  -2.469  -9.355   6.967
  282   1HG2  VAL  38          HG21      VAL  38  -2.919  -6.386   4.955
  283   2HG2  VAL  38          HG22      VAL  38  -1.860  -5.784   6.233
  284   3HG2  VAL  38          HG23      VAL  38  -3.576  -5.351   6.220
  285    H    ASP  39           H        ASP  39  -4.454  -8.388   9.110
  286    HA   ASP  39           HA       ASP  39  -4.012 -11.156   8.890
  287   1HB   ASP  39          HB2       ASP  39  -3.337  -9.782  10.856
  288   2HB   ASP  39          HB1       ASP  39  -5.028  -9.621  11.293
  289    H    SER  40           H        SER  40  -6.861  -9.325   8.971
  290    HA   SER  40           HA       SER  40  -8.563 -11.539   9.661
  291   1HB   SER  40          HB2       SER  40  -9.054  -9.224  10.423
  292   2HB   SER  40          HB1       SER  40  -9.239  -8.739   8.753
  293    HG   SER  40           HG       SER  40 -11.051  -9.972   8.539
  294    H    GLU  41           H        GLU  41  -7.849  -9.645   6.735
  295    HA   GLU  41           HA       GLU  41  -9.752 -11.425   5.335
  296   1HB   GLU  41          HB2       GLU  41  -8.816  -8.713   4.429
  297   2HB   GLU  41          HB1       GLU  41 -10.036  -9.708   3.649
  298   1HG   GLU  41          HG2       GLU  41 -10.176  -8.435   6.355
  299   2HG   GLU  41          HG1       GLU  41 -11.116  -7.982   4.929
  300    H    HIS  42           H        HIS  42  -6.412 -10.218   5.105
  301    HA   HIS  42           HA       HIS  42  -5.939 -12.223   3.144
  302   1HB   HIS  42          HB2       HIS  42  -4.352 -10.393   2.214
  303   2HB   HIS  42          HB1       HIS  42  -5.970 -10.518   1.535
  304    HD1  HIS  42           HD1      HIS  42  -3.874  -8.491   3.933
  305    HD2  HIS  42           HD2      HIS  42  -7.357  -8.066   1.733
  306    HE1  HIS  42           HE1      HIS  42  -4.509  -6.003   4.043
  307    HA   PRO  43           HA       PRO  43  -3.006 -11.851   6.831
  308   1HB   PRO  43          HB2       PRO  43  -3.117 -14.482   7.542
  309   2HB   PRO  43          HB1       PRO  43  -4.256 -13.271   8.141
  310   1HG   PRO  43          HG2       PRO  43  -4.587 -15.220   5.882
  311   2HG   PRO  43          HG1       PRO  43  -5.728 -14.810   7.176
  312   1HD   PRO  43          HD2       PRO  43  -5.983 -13.745   4.730
  313   2HD   PRO  43          HD1       PRO  43  -6.322 -12.815   6.208
  314    H    ASN  44           H        ASN  44  -3.288 -14.279   4.364
  315    HA   ASN  44           HA       ASN  44  -0.463 -14.065   3.905
  316   1HB   ASN  44          HB2       ASN  44  -0.222 -16.472   3.487
  317   2HB   ASN  44          HB1       ASN  44  -0.727 -16.178   5.138
  318   1HD2  ASN  44          HD21      ASN  44  -2.722 -16.806   5.759
  319   2HD2  ASN  44          HD22      ASN  44  -3.716 -17.913   4.879
  320    H    VAL  45           H        VAL  45   0.033 -14.165   1.726
  321    HA   VAL  45           HA       VAL  45  -1.948 -14.639  -0.210
  322    HB   VAL  45           HB       VAL  45  -2.839 -12.546   0.588
  323   1HG1  VAL  45          HG11      VAL  45  -0.996 -11.688   1.804
  324   2HG1  VAL  45          HG12      VAL  45  -1.613 -10.471   0.709
  325   3HG1  VAL  45          HG13      VAL  45  -0.108 -11.329   0.317
  326   1HG2  VAL  45          HG21      VAL  45  -2.921 -12.762  -1.802
  327   2HG2  VAL  45          HG22      VAL  45  -1.314 -12.038  -1.966
  328   3HG2  VAL  45          HG23      VAL  45  -2.669 -11.074  -1.363
  329    H    VAL  46           H        VAL  46  -0.986 -14.663  -2.282
  330    HA   VAL  46           HA       VAL  46   1.928 -14.444  -2.233
  331    HB   VAL  46           HB       VAL  46   1.174 -16.662  -1.466
  332   1HG1  VAL  46          HG11      VAL  46  -0.010 -16.995  -4.191
  333   2HG1  VAL  46          HG12      VAL  46  -0.864 -16.921  -2.648
  334   3HG1  VAL  46          HG13      VAL  46   0.201 -18.283  -3.003
  335   1HG2  VAL  46          HG21      VAL  46   2.633 -16.768  -4.097
  336   2HG2  VAL  46          HG22      VAL  46   2.603 -18.059  -2.897
  337   3HG2  VAL  46          HG23      VAL  46   3.359 -16.512  -2.513
  338    H    LEU  47           H        LEU  47  -0.063 -12.851  -3.667
  339    HA   LEU  47           HA       LEU  47  -0.105 -13.980  -6.353
  340   1HB   LEU  47          HB2       LEU  47  -1.837 -11.859  -5.132
  341   2HB   LEU  47          HB1       LEU  47  -1.779 -12.108  -6.859
  342    HG   LEU  47           HG       LEU  47  -3.715 -13.194  -6.052
  343   1HD1  LEU  47          HD11      LEU  47  -3.400 -15.510  -6.671
  344   2HD1  LEU  47          HD12      LEU  47  -1.657 -15.313  -6.557
  345   3HD1  LEU  47          HD13      LEU  47  -2.567 -14.413  -7.774
  346   1HD2  LEU  47          HD21      LEU  47  -3.200 -13.386  -3.704
  347   2HD2  LEU  47          HD22      LEU  47  -1.982 -14.619  -4.038
  348   3HD2  LEU  47          HD23      LEU  47  -3.690 -14.962  -4.329
  349    H    ASN  48           H        ASN  48   1.639 -13.602  -7.343
  350    HA   ASN  48           HA       ASN  48   3.214 -12.686  -8.610
  351   1HB   ASN  48          HB2       ASN  48   2.511 -11.137 -10.310
  352   2HB   ASN  48          HB1       ASN  48   1.171 -12.196  -9.944
  353   1HD2  ASN  48          HD21      ASN  48   2.303  -8.980 -10.069
  354   2HD2  ASN  48          HD22      ASN  48   0.852  -8.200  -9.619
  355    H    SER  49           H        SER  49   4.098 -10.213  -9.447
  356    HA   SER  49           HA       SER  49   5.305  -9.350  -6.974
  357   1HB   SER  49          HB2       SER  49   6.086  -8.807  -9.847
  358   2HB   SER  49          HB1       SER  49   7.033  -8.382  -8.417
  359    HG   SER  49           HG       SER  49   6.963 -10.671  -7.892
  360    H    SER  50           H        SER  50   5.450  -7.079  -6.387
  361    HA   SER  50           HA       SER  50   3.828  -5.078  -7.551
  362   1HB   SER  50          HB2       SER  50   3.096  -6.501  -4.987
  363   2HB   SER  50          HB1       SER  50   2.386  -5.001  -5.568
  364    HG   SER  50           HG       SER  50   2.280  -6.791  -7.508
  365    H    TYR  51           H        TYR  51   3.850  -3.260  -5.704
  366    HA   TYR  51           HA       TYR  51   6.577  -3.264  -4.618
  367   1HB   TYR  51          HB2       TYR  51   4.818  -1.153  -5.731
  368   2HB   TYR  51          HB1       TYR  51   6.087  -0.728  -4.592
  369    HD1  TYR  51           HD1      TYR  51   7.253   0.671  -6.018
  370    HD2  TYR  51           HD2      TYR  51   6.436  -3.306  -7.253
  371    HE1  TYR  51           HE1      TYR  51   8.779   0.958  -7.925
  372    HE2  TYR  51           HE2      TYR  51   7.955  -3.038  -9.168
  373    HH   TYR  51           HH       TYR  51  10.072  -0.361  -9.436
  374    H    VAL  52           H        VAL  52   6.894  -2.696  -2.539
  375    HA   VAL  52           HA       VAL  52   4.576  -1.983  -0.880
  376    HB   VAL  52           HB       VAL  52   5.112  -4.399  -0.578
  377   1HG1  VAL  52          HG11      VAL  52   7.437  -4.306  -1.126
  378   2HG1  VAL  52          HG12      VAL  52   7.112  -5.133   0.385
  379   3HG1  VAL  52          HG13      VAL  52   7.760  -3.486   0.411
  380   1HG2  VAL  52          HG21      VAL  52   5.873  -2.775   1.825
  381   2HG2  VAL  52          HG22      VAL  52   5.424  -4.482   1.830
  382   3HG2  VAL  52          HG23      VAL  52   4.243  -3.263   1.355
  383    H    CYS  53           H        CYS  53   5.003  -0.415   0.592
  384    HA   CYS  53           HA       CYS  53   7.620   0.911   0.542
  385   1HB   CYS  53          HB2       CYS  53   5.664   2.316   0.647
  386   2HB   CYS  53          HB1       CYS  53   5.032   1.450   2.031
  387    H    VAL  54           H        VAL  54   9.076  -0.401   1.537
  388    HA   VAL  54           HA       VAL  54   8.622  -2.235   3.553
  389    HB   VAL  54           HB       VAL  54  11.172  -0.955   3.943
  390   1HG1  VAL  54          HG11      VAL  54  10.389  -3.520   2.753
  391   2HG1  VAL  54          HG12      VAL  54  10.676  -3.233   4.495
  392   3HG1  VAL  54          HG13      VAL  54  12.007  -3.101   3.307
  393   1HG2  VAL  54          HG21      VAL  54  12.056  -1.552   1.671
  394   2HG2  VAL  54          HG22      VAL  54  11.091  -0.096   1.814
  395   3HG2  VAL  54          HG23      VAL  54  10.372  -1.527   1.120
  396    H    GLU  55           H        GLU  55   9.138   1.154   3.694
  397    HA   GLU  55           HA       GLU  55   9.823   1.510   6.350
  398   1HB   GLU  55          HB2       GLU  55   8.126   3.406   4.728
  399   2HB   GLU  55          HB1       GLU  55   9.217   3.815   6.040
  400   1HG   GLU  55          HG2       GLU  55  10.073   2.701   3.374
  401   2HG   GLU  55          HG1       GLU  55  10.070   4.404   3.800
  402    H    CYS  56           H        CYS  56   6.792   1.353   4.704
  403    HA   CYS  56           HA       CYS  56   5.256   1.591   7.252
  404   1HB   CYS  56          HB2       CYS  56   4.145   1.526   4.465
  405   2HB   CYS  56          HB1       CYS  56   3.338   2.085   5.924
  406    H    ASN  57           H        ASN  57   6.400  -0.709   5.126
  407    HA   ASN  57           HA       ASN  57   5.910  -2.778   4.434
  408   1HB   ASN  57          HB2       ASN  57   5.080  -2.683   7.265
  409   2HB   ASN  57          HB1       ASN  57   4.856  -4.216   6.385
  410   1HD2  ASN  57          HD21      ASN  57   7.247  -4.064   4.824
  411   2HD2  ASN  57          HD22      ASN  57   8.550  -4.246   5.925
  412    H    PHE  58           H        PHE  58   4.327  -1.347   3.099
  413    HA   PHE  58           HA       PHE  58   1.704  -2.626   3.283
  414   1HB   PHE  58          HB2       PHE  58   0.477  -0.707   3.421
  415   2HB   PHE  58          HB1       PHE  58   1.960   0.021   4.006
  416    HD1  PHE  58           HD1      PHE  58  -0.349  -0.285   1.211
  417    HD2  PHE  58           HD2      PHE  58   3.176   1.598   2.582
  418    HE1  PHE  58           HE1      PHE  58  -0.550   1.395  -0.614
  419    HE2  PHE  58           HE2      PHE  58   3.008   3.275   0.713
  420    HZ   PHE  58           HZ       PHE  58   1.134   3.161  -0.856
  421    H    LEU  59           H        LEU  59   1.089  -3.506   1.520
  422    HA   LEU  59           HA       LEU  59   2.698  -3.165  -0.874
  423   1HB   LEU  59          HB2       LEU  59   1.149  -5.336   0.318
  424   2HB   LEU  59          HB1       LEU  59   0.877  -5.171  -1.400
  425    HG   LEU  59           HG       LEU  59   3.596  -5.504  -0.150
  426   1HD1  LEU  59          HD11      LEU  59   3.443  -7.806  -0.884
  427   2HD1  LEU  59          HD12      LEU  59   1.879  -7.482  -1.624
  428   3HD1  LEU  59          HD13      LEU  59   2.036  -7.456   0.132
  429   1HD2  LEU  59          HD21      LEU  59   4.216  -6.055  -2.491
  430   2HD2  LEU  59          HD22      LEU  59   3.676  -4.399  -2.307
  431   3HD2  LEU  59          HD23      LEU  59   2.598  -5.599  -3.006
  432    H    THR  60           H        THR  60   1.802  -2.270  -2.663
  433    HA   THR  60           HA       THR  60  -1.065  -1.855  -2.647
  434    HB   THR  60           HB       THR  60  -0.285   0.281  -2.127
  435    HG1  THR  60           HG1      THR  60  -1.598   0.981  -3.665
  436   1HG2  THR  60          HG21      THR  60   1.845   0.053  -4.266
  437   2HG2  THR  60          HG22      THR  60   2.101  -0.114  -2.536
  438   3HG2  THR  60          HG23      THR  60   1.614   1.429  -3.188
  439    H    LYS  61           H        LYS  61  -1.822  -1.248  -4.874
  440    HA   LYS  61           HA       LYS  61  -1.259  -3.537  -6.578
  441   1HB   LYS  61          HB2       LYS  61  -3.046  -1.189  -7.166
  442   2HB   LYS  61          HB1       LYS  61  -3.127  -2.794  -7.854
  443   1HG   LYS  61          HG2       LYS  61  -3.908  -3.689  -5.755
  444   2HG   LYS  61          HG1       LYS  61  -3.721  -2.107  -4.988
  445   1HD   LYS  61          HD2       LYS  61  -5.336  -1.177  -6.625
  446   2HD   LYS  61          HD1       LYS  61  -5.579  -2.805  -7.258
  447   1HE   LYS  61          HE2       LYS  61  -7.350  -2.208  -5.692
  448   2HE   LYS  61          HE1       LYS  61  -6.375  -3.528  -5.048
  449   1HZ   LYS  61          HZ1       LYS  61  -6.824  -1.882  -3.375
  450   2HZ   LYS  61          HZ2       LYS  61  -6.077  -0.666  -4.301
  451   3HZ   LYS  61          HZ3       LYS  61  -5.187  -1.959  -3.688
  452    H    ARG  62           H        ARG  62  -0.154  -0.363  -6.277
  453    HA   ARG  62           HA       ARG  62   0.500  -0.197  -9.126
  454   1HB   ARG  62          HB2       ARG  62  -0.145   2.133  -9.090
  455   2HB   ARG  62          HB1       ARG  62  -1.505   1.118  -8.611
  456   1HG   ARG  62          HG2       ARG  62  -0.738   1.633  -6.196
  457   2HG   ARG  62          HG1       ARG  62   0.184   2.939  -6.939
  458   1HD   ARG  62          HD2       ARG  62  -1.811   3.942  -6.311
  459   2HD   ARG  62          HD1       ARG  62  -2.029   3.615  -8.025
  460    HE   ARG  62           HE       ARG  62  -3.228   2.125  -5.783
  461   1HH1  ARG  62          HH11      ARG  62  -3.208   2.692  -9.329
  462   2HH1  ARG  62          HH12      ARG  62  -4.791   2.091  -9.524
  463   1HH2  ARG  62          HH21      ARG  62  -5.369   1.376  -6.111
  464   2HH2  ARG  62          HH22      ARG  62  -6.035   1.329  -7.693
  465    H    TYR  63           H        TYR  63   2.420   1.061  -9.561
  466    HA   TYR  63           HA       TYR  63   4.238   1.050  -7.323
  467   1HB   TYR  63          HB2       TYR  63   6.027   1.595  -8.873
  468   2HB   TYR  63          HB1       TYR  63   5.024   0.359  -9.601
  469    HD1  TYR  63           HD1      TYR  63   6.255   3.779  -9.849
  470    HD2  TYR  63           HD2      TYR  63   3.591   0.933 -11.543
  471    HE1  TYR  63           HE1      TYR  63   6.092   5.153 -11.878
  472    HE2  TYR  63           HE2      TYR  63   3.417   2.303 -13.578
  473    HH   TYR  63           HH       TYR  63   5.551   4.857 -14.224
  474    H    ASP  64           H        ASP  64   2.196   3.201  -8.854
  475    HA   ASP  64           HA       ASP  64   3.306   5.745  -8.531
  476   1HB   ASP  64          HB2       ASP  64   0.407   5.010  -8.165
  477   2HB   ASP  64          HB1       ASP  64   1.046   6.600  -8.534
  478    H    ALA  65           H        ALA  65   1.500   3.822  -6.259
  479    HA   ALA  65           HA       ALA  65   1.002   5.876  -4.463
  480   1HB   ALA  65          HB1       ALA  65  -0.320   3.924  -4.435
  481   2HB   ALA  65          HB2       ALA  65   0.519   3.955  -2.869
  482   3HB   ALA  65          HB3       ALA  65   1.080   2.913  -4.183
  483    H    LEU  66           H        LEU  66   3.725   3.843  -4.991
  484    HA   LEU  66           HA       LEU  66   5.038   4.407  -2.480
  485   1HB   LEU  66          HB2       LEU  66   6.228   3.168  -4.943
  486   2HB   LEU  66          HB1       LEU  66   6.957   3.226  -3.360
  487    HG   LEU  66           HG       LEU  66   6.223   1.080  -3.626
  488   1HD1  LEU  66          HD11      LEU  66   4.047   2.468  -2.100
  489   2HD1  LEU  66          HD12      LEU  66   5.616   1.970  -1.453
  490   3HD1  LEU  66          HD13      LEU  66   4.445   0.753  -1.979
  491   1HD2  LEU  66          HD21      LEU  66   3.983   0.455  -4.378
  492   2HD2  LEU  66          HD22      LEU  66   4.899   1.409  -5.560
  493   3HD2  LEU  66          HD23      LEU  66   3.626   2.171  -4.624
  494    H    SER  67           H        SER  67   5.004   5.597  -5.708
  495    HA   SER  67           HA       SER  67   7.519   7.058  -5.581
  496   1HB   SER  67          HB2       SER  67   6.148   6.090  -7.633
  497   2HB   SER  67          HB1       SER  67   5.298   7.605  -7.508
  498    HG   SER  67           HG       SER  67   7.700   8.432  -7.431
  499    H    GLU  68           H        GLU  68   4.116   7.694  -5.319
  500    HA   GLU  68           HA       GLU  68   4.513  10.482  -4.734
  501   1HB   GLU  68          HB2       GLU  68   1.986   9.136  -3.913
  502   2HB   GLU  68          HB1       GLU  68   2.256  10.731  -4.532
  503   1HG   GLU  68          HG2       GLU  68   2.963   9.515  -6.709
  504   2HG   GLU  68          HG1       GLU  68   2.112   8.198  -6.005
  505    H    HIS  69           H        HIS  69   4.592   7.641  -3.070
  506    HA   HIS  69           HA       HIS  69   3.596   8.140  -0.554
  507   1HB   HIS  69          HB2       HIS  69   4.643   6.020  -1.480
  508   2HB   HIS  69          HB1       HIS  69   6.174   6.711  -0.883
  509    HD1  HIS  69           HD1      HIS  69   2.839   5.451   0.314
  510    HD2  HIS  69           HD2      HIS  69   6.600   6.412   1.678
  511    HE1  HIS  69           HE1      HIS  69   2.896   4.663   2.711
  512    H    ASN  70           H        ASN  70   7.046   8.690  -1.429
  513    HA   ASN  70           HA       ASN  70   7.566  10.187   0.954
  514   1HB   ASN  70          HB2       ASN  70   9.728  10.711  -0.150
  515   2HB   ASN  70          HB1       ASN  70   9.380   8.995  -0.020
  516   1HD2  ASN  70          HD21      ASN  70  11.190  10.078  -1.629
  517   2HD2  ASN  70          HD22      ASN  70  10.749   9.777  -3.306
  518    H    LEU  71           H        LEU  71   6.047  10.976  -1.806
  519    HA   LEU  71           HA       LEU  71   6.653  13.790  -1.759
  520   1HB   LEU  71          HB2       LEU  71   6.123  13.145  -3.901
  521   2HB   LEU  71          HB1       LEU  71   4.978  11.943  -3.372
  522    HG   LEU  71           HG       LEU  71   3.322  13.637  -2.997
  523   1HD1  LEU  71          HD11      LEU  71   4.781  15.586  -2.513
  524   2HD1  LEU  71          HD12      LEU  71   3.697  15.969  -3.854
  525   3HD1  LEU  71          HD13      LEU  71   5.383  15.559  -4.170
  526   1HD2  LEU  71          HD21      LEU  71   2.914  14.223  -5.350
  527   2HD2  LEU  71          HD22      LEU  71   3.393  12.539  -5.124
  528   3HD2  LEU  71          HD23      LEU  71   4.558  13.715  -5.737
  529    H    LYS  72           H        LYS  72   3.894  11.742  -0.903
  530    HA   LYS  72           HA       LYS  72   2.762  14.006   0.551
  531   1HB   LYS  72          HB2       LYS  72   0.663  12.297   0.341
  532   2HB   LYS  72          HB1       LYS  72   0.942  13.662  -0.761
  533   1HG   LYS  72          HG2       LYS  72   2.256  11.954  -2.116
  534   2HG   LYS  72          HG1       LYS  72   1.548  10.715  -1.127
  535   1HD   LYS  72          HD2       LYS  72   0.116  12.686  -2.893
  536   2HD   LYS  72          HD1       LYS  72   0.268  10.951  -3.163
  537   1HE   LYS  72          HE2       LYS  72  -1.072  10.627  -1.048
  538   2HE   LYS  72          HE1       LYS  72  -1.300  12.367  -1.017
  539   1HZ   LYS  72          HZ1       LYS  72  -2.255  10.530  -3.158
  540   2HZ   LYS  72          HZ2       LYS  72  -2.401  12.205  -3.198
  541   3HZ   LYS  72          HZ3       LYS  72  -3.177  11.322  -1.998
  542    H    TYR  73           H        TYR  73   3.394  10.647   0.884
  543    HA   TYR  73           HA       TYR  73   2.248  10.468   3.532
  544   1HB   TYR  73          HB2       TYR  73   3.791   8.554   1.834
  545   2HB   TYR  73          HB1       TYR  73   3.204   8.116   3.444
  546    HD1  TYR  73           HD1      TYR  73   1.868   9.679   0.331
  547    HD2  TYR  73           HD2      TYR  73   1.297   6.823   3.403
  548    HE1  TYR  73           HE1      TYR  73  -0.202   8.982  -0.729
  549    HE2  TYR  73           HE2      TYR  73  -0.822   6.120   2.325
  550    HH   TYR  73           HH       TYR  73  -2.377   6.893   0.953
  551    H    HIS  74           H        HIS  74   5.546  10.059   2.156
  552    HA   HIS  74           HA       HIS  74   6.641  10.823   4.813
  553   1HB   HIS  74          HB2       HIS  74   7.885   9.074   2.671
  554   2HB   HIS  74          HB1       HIS  74   8.741   9.579   4.119
  555    HD1  HIS  74           HD1      HIS  74   6.351   8.760   6.159
  556    HD2  HIS  74           HD2      HIS  74   7.930   6.462   3.084
  557    HE1  HIS  74           HE1      HIS  74   5.732   6.381   6.688
  558    HA   PRO  75           HA       PRO  75   7.745  13.960   1.591
  559   1HB   PRO  75          HB2       PRO  75   6.913  16.165   2.851
  560   2HB   PRO  75          HB1       PRO  75   5.789  15.112   1.973
  561   1HG   PRO  75          HG2       PRO  75   6.396  15.165   4.912
  562   2HG   PRO  75          HG1       PRO  75   4.804  15.115   4.118
  563   1HD   PRO  75          HD2       PRO  75   6.028  12.899   5.105
  564   2HD   PRO  75          HD1       PRO  75   4.991  12.887   3.667
  565    H    GLY  76           H        GLY  76   9.517  15.104   1.410
  566   1HA   GLY  76          HA2       GLY  76  10.839  16.694   3.089
  567   2HA   GLY  76          HA1       GLY  76  11.400  15.106   3.590
  568    H    GLU  77           H        GLU  77  11.384  13.887   1.029
  569    HA   GLU  77           HA       GLU  77  13.009  15.355  -0.795
  570   1HB   GLU  77          HB2       GLU  77  15.009  13.903  -0.543
  571   2HB   GLU  77          HB1       GLU  77  14.736  14.909   0.869
  572   1HG   GLU  77          HG2       GLU  77  15.110  12.995   2.004
  573   2HG   GLU  77          HG1       GLU  77  13.435  12.653   1.554
  574    H    GLU  78           H        GLU  78  13.843  13.633  -2.479
  575    HA   GLU  78           HA       GLU  78  11.780  11.559  -2.579
  576   1HB   GLU  78          HB2       GLU  78  11.184  13.476  -4.088
  577   2HB   GLU  78          HB1       GLU  78  12.702  13.126  -4.933
  578   1HG   GLU  78          HG2       GLU  78  11.884  10.851  -5.383
  579   2HG   GLU  78          HG1       GLU  78  10.337  11.277  -4.661
  580    H    ASN  79           H        ASN  79  13.321  10.068  -1.926
  581    HA   ASN  79           HA       ASN  79  15.011   9.076  -4.077
  582   1HB   ASN  79          HB2       ASN  79  15.947   9.744  -1.308
  583   2HB   ASN  79          HB1       ASN  79  16.929   8.820  -2.464
  584   1HD2  ASN  79          HD21      ASN  79  15.682  11.808  -1.530
  585   2HD2  ASN  79          HD22      ASN  79  16.463  12.884  -2.629
  586    H    PHE  80           H        PHE  80  13.642   7.367  -4.139
  587    HA   PHE  80           HA       PHE  80  13.514   5.666  -1.774
  588   1HB   PHE  80          HB2       PHE  80  11.706   6.215  -3.997
  589   2HB   PHE  80          HB1       PHE  80  11.960   4.500  -3.731
  590    HD1  PHE  80           HD1      PHE  80  11.615   3.661  -1.320
  591    HD2  PHE  80           HD2      PHE  80  10.120   7.360  -2.734
  592    HE1  PHE  80           HE1      PHE  80   9.871   3.593   0.387
  593    HE2  PHE  80           HE2      PHE  80   8.378   7.318  -0.965
  594    HZ   PHE  80           HZ       PHE  80   8.240   5.423   0.563
  595    H    LYS  81           H        LYS  81  14.187   3.571  -1.920
  596    HA   LYS  81           HA       LYS  81  15.955   2.962  -4.188
  597   1HB   LYS  81          HB2       LYS  81  17.468   2.062  -2.669
  598   2HB   LYS  81          HB1       LYS  81  16.628   3.179  -1.596
  599   1HG   LYS  81          HG2       LYS  81  15.252   1.450  -0.733
  600   2HG   LYS  81          HG1       LYS  81  15.883   0.298  -1.901
  601   1HD   LYS  81          HD2       LYS  81  18.170   0.815  -0.846
  602   2HD   LYS  81          HD1       LYS  81  17.213   1.499   0.475
  603   1HE   LYS  81          HE2       LYS  81  15.983  -0.607   0.668
  604   2HE   LYS  81          HE1       LYS  81  16.960  -1.267  -0.639
  605   1HZ   LYS  81          HZ1       LYS  81  17.802  -1.974   1.557
  606   2HZ   LYS  81          HZ2       LYS  81  17.986  -0.364   2.001
  607   3HZ   LYS  81          HZ3       LYS  81  18.932  -0.991   0.766
  608    H    LEU  82           H        LEU  82  16.033   0.468  -4.533
  609    HA   LEU  82           HA       LEU  82  13.397  -0.627  -3.999
  610   1HB   LEU  82          HB2       LEU  82  13.377  -1.711  -6.220
  611   2HB   LEU  82          HB1       LEU  82  13.314   0.031  -6.323
  612    HG   LEU  82           HG       LEU  82  15.908  -1.450  -6.711
  613   1HD1  LEU  82          HD11      LEU  82  15.442  -1.415  -9.133
  614   2HD1  LEU  82          HD12      LEU  82  13.831  -0.776  -8.810
  615   3HD1  LEU  82          HD13      LEU  82  14.258  -2.402  -8.277
  616   1HD2  LEU  82          HD21      LEU  82  16.488   0.521  -8.038
  617   2HD2  LEU  82          HD22      LEU  82  16.000   0.998  -6.411
  618   3HD2  LEU  82          HD23      LEU  82  14.884   1.196  -7.761
  619    H    THR  83           H        THR  83  13.441  -2.582  -3.103
  620    HA   THR  83           HA       THR  83  15.761  -4.213  -3.558
  621    HB   THR  83           HB       THR  83  16.273  -3.038  -1.487
  622    HG1  THR  83           HG1      THR  83  16.887  -5.142  -1.486
  623   1HG2  THR  83          HG21      THR  83  13.668  -4.063  -0.372
  624   2HG2  THR  83          HG22      THR  83  13.973  -2.393  -0.847
  625   3HG2  THR  83          HG23      THR  83  14.857  -3.096   0.509
  626    H    MET  84           H        MET  84  14.915  -6.219  -4.223
  627    HA   MET  84           HA       MET  84  12.062  -6.539  -3.556
  628   1HB   MET  84          HB2       MET  84  12.850  -6.708  -5.939
  629   2HB   MET  84          HB1       MET  84  13.805  -8.095  -5.437
  630   1HG   MET  84          HG2       MET  84  11.768  -9.313  -4.883
  631   2HG   MET  84          HG1       MET  84  10.799  -7.918  -5.376
  632   1HE   MET  84          HE1       MET  84  10.218 -10.744  -6.640
  633   2HE   MET  84          HE2       MET  84  10.121 -10.365  -8.358
  634   3HE   MET  84          HE3       MET  84   9.388  -9.281  -7.174
  635    H    VAL  85           H        VAL  85  11.979  -7.369  -1.607
  636    HA   VAL  85           HA       VAL  85  12.858 -10.054  -1.324
  637    HB   VAL  85           HB       VAL  85  13.549  -9.405   1.171
  638   1HG1  VAL  85          HG11      VAL  85  15.059 -10.500  -0.402
  639   2HG1  VAL  85          HG12      VAL  85  15.919  -9.216   0.457
  640   3HG1  VAL  85          HG13      VAL  85  15.353  -8.956  -1.197
  641   1HG2  VAL  85          HG21      VAL  85  14.746  -7.250   1.296
  642   2HG2  VAL  85          HG22      VAL  85  13.029  -7.007   0.943
  643   3HG2  VAL  85          HG23      VAL  85  14.223  -6.878  -0.349
  644    H    LYS  86           H        LYS  86  10.820 -10.932  -0.940
  645    HA   LYS  86           HA       LYS  86   9.562  -9.738   1.367
  646   1HB   LYS  86          HB2       LYS  86   8.447  -8.910  -0.784
  647   2HB   LYS  86          HB1       LYS  86   7.816 -10.554  -0.910
  648   1HG   LYS  86          HG2       LYS  86   6.156  -9.277   0.007
  649   2HG   LYS  86          HG1       LYS  86   6.781 -10.257   1.336
  650   1HD   LYS  86          HD2       LYS  86   8.032  -8.390   2.217
  651   2HD   LYS  86          HD1       LYS  86   7.745  -7.421   0.796
  652   1HE   LYS  86          HE2       LYS  86   6.192  -6.491   2.322
  653   2HE   LYS  86          HE1       LYS  86   5.276  -7.649   1.403
  654   1HZ   LYS  86          HZ1       LYS  86   4.850  -7.830   3.793
  655   2HZ   LYS  86          HZ2       LYS  86   6.432  -8.231   4.076
  656   3HZ   LYS  86          HZ3       LYS  86   5.449  -9.283   3.201
  657    H    ARG  87           H        ARG  87   9.013 -11.178   2.745
  658    HA   ARG  87           HA       ARG  87   9.346 -13.916   1.840
  659   1HB   ARG  87          HB2       ARG  87  10.227 -12.660   4.456
  660   2HB   ARG  87          HB1       ARG  87  10.437 -14.349   4.011
  661   1HG   ARG  87          HG2       ARG  87  12.571 -13.413   3.577
  662   2HG   ARG  87          HG1       ARG  87  11.770 -13.445   2.004
  663   1HD   ARG  87          HD2       ARG  87  12.928 -11.335   2.233
  664   2HD   ARG  87          HD1       ARG  87  11.194 -11.072   2.238
  665    HE   ARG  87           HE       ARG  87  12.334 -11.286   4.866
  666   1HH1  ARG  87          HH11      ARG  87  11.465  -8.903   2.291
  667   2HH1  ARG  87          HH12      ARG  87  11.594  -7.569   3.243
  668   1HH2  ARG  87          HH21      ARG  87  12.512  -9.375   6.231
  669   2HH2  ARG  87          HH22      ARG  87  12.224  -7.833   5.565
  670    H    ASN  88           H        ASN  88   8.002 -15.451   2.748
  671    HA   ASN  88           HA       ASN  88   6.219 -16.385   3.769
  672   1HB   ASN  88          HB2       ASN  88   6.286 -13.902   5.491
  673   2HB   ASN  88          HB1       ASN  88   5.119 -15.197   5.729
  674   1HD2  ASN  88          HD21      ASN  88   7.364 -14.156   7.386
  675   2HD2  ASN  88          HD22      ASN  88   8.315 -15.537   7.760
  676    H    ASN  89           H        ASN  89   6.079 -14.202   1.635
  677    HA   ASN  89           HA       ASN  89   3.150 -14.095   1.561
  678   1HB   ASN  89          HB2       ASN  89   5.000 -11.738   1.031
  679   2HB   ASN  89          HB1       ASN  89   3.299 -11.762   0.604
  680   1HD2  ASN  89          HD21      ASN  89   5.643 -11.472   3.159
  681   2HD2  ASN  89          HD22      ASN  89   4.533 -10.990   4.382
  682    H    GLN  90           H        GLN  90   5.224 -12.372  -0.611
  683    HA   GLN  90           HA       GLN  90   5.603 -14.441  -2.489
  684   1HB   GLN  90          HB2       GLN  90   4.603 -13.217  -4.335
  685   2HB   GLN  90          HB1       GLN  90   3.338 -13.648  -3.169
  686   1HG   GLN  90          HG2       GLN  90   4.597 -10.990  -3.249
  687   2HG   GLN  90          HG1       GLN  90   3.304 -11.394  -4.378
  688   1HE2  GLN  90          HE21      GLN  90   4.121 -10.437  -1.227
  689   2HE2  GLN  90          HE22      GLN  90   2.503 -10.423  -0.585
  690    H    THR  91           H        THR  91   6.950 -13.285  -4.336
  691    HA   THR  91           HA       THR  91   8.525 -11.441  -2.830
  692    HB   THR  91           HB       THR  91  10.191 -11.832  -4.768
  693    HG1  THR  91           HG1      THR  91   9.851 -13.652  -5.947
  694   1HG2  THR  91          HG21      THR  91   9.505 -14.082  -2.840
  695   2HG2  THR  91          HG22      THR  91  10.487 -12.697  -2.434
  696   3HG2  THR  91          HG23      THR  91  11.060 -13.856  -3.628
  697    H    ILE  92           H        ILE  92   8.258  -9.565  -3.005
  698    HA   ILE  92           HA       ILE  92   7.421  -8.257  -5.395
  699    HB   ILE  92           HB       ILE  92   5.920  -6.822  -3.926
  700   1HG1  ILE  92          HG12      ILE  92   4.935  -8.352  -2.021
  701   2HG1  ILE  92          HG11      ILE  92   6.555  -8.978  -2.086
  702   1HG2  ILE  92          HG21      ILE  92   4.046  -8.503  -3.870
  703   2HG2  ILE  92          HG22      ILE  92   5.216  -9.659  -4.558
  704   3HG2  ILE  92          HG23      ILE  92   4.797  -8.181  -5.411
  705   1HD1  ILE  92          HD11      ILE  92   6.287  -7.106  -0.476
  706   2HD1  ILE  92          HD12      ILE  92   6.116  -6.032  -1.866
  707   3HD1  ILE  92          HD13      ILE  92   7.594  -6.955  -1.634
  708    H    PHE  93           H        PHE  93   7.798  -5.874  -5.193
  709    HA   PHE  93           HA       PHE  93  10.593  -5.682  -4.411
  710   1HB   PHE  93          HB2       PHE  93   8.716  -3.928  -5.965
  711   2HB   PHE  93          HB1       PHE  93  10.392  -3.528  -5.704
  712    HD1  PHE  93           HD1      PHE  93   8.040  -5.774  -7.411
  713    HD2  PHE  93           HD2      PHE  93  12.073  -4.556  -6.967
  714    HE1  PHE  93           HE1      PHE  93   8.599  -6.934  -9.513
  715    HE2  PHE  93           HE2      PHE  93  12.662  -5.714  -9.077
  716    HZ   PHE  93           HZ       PHE  93  10.916  -6.906 -10.346
  717    H    GLU  94           H        GLU  94  11.093  -4.679  -2.529
  718    HA   GLU  94           HA       GLU  94   9.065  -3.096  -1.250
  719   1HB   GLU  94          HB2       GLU  94  11.731  -4.031  -0.122
  720   2HB   GLU  94          HB1       GLU  94  10.387  -3.336   0.759
  721   1HG   GLU  94          HG2       GLU  94   9.117  -5.387  -0.177
  722   2HG   GLU  94          HG1       GLU  94  10.741  -6.074  -0.276
  723    H    GLN  95           H        GLN  95   9.378  -1.000  -0.964
  724    HA   GLN  95           HA       GLN  95  11.777   0.121  -2.236
  725   1HB   GLN  95          HB2       GLN  95   9.422   0.327  -3.358
  726   2HB   GLN  95          HB1       GLN  95   9.114   1.527  -2.110
  727   1HG   GLN  95          HG2       GLN  95  10.944   2.863  -2.873
  728   2HG   GLN  95          HG1       GLN  95  11.433   1.613  -4.009
  729   1HE2  GLN  95          HE21      GLN  95   9.207   4.142  -3.294
  730   2HE2  GLN  95          HE22      GLN  95   8.524   4.262  -4.874
  731    H    THR  96           H        THR  96  13.065   0.980  -0.733
  732    HA   THR  96           HA       THR  96  11.914   2.061   1.763
  733    HB   THR  96           HB       THR  96  14.764   1.604   1.846
  734    HG1  THR  96           HG1      THR  96  13.708  -0.886   1.744
  735   1HG2  THR  96          HG21      THR  96  14.088   0.136   3.772
  736   2HG2  THR  96          HG22      THR  96  12.402   0.368   3.294
  737   3HG2  THR  96          HG23      THR  96  13.335   1.729   3.843
  738    H    ILE  97           H        ILE  97  13.035   3.940   2.666
  739    HA   ILE  97           HA       ILE  97  14.173   5.681   0.565
  740    HB   ILE  97           HB       ILE  97  13.134   6.588   3.269
  741   1HG1  ILE  97          HG12      ILE  97  11.511   6.582   0.768
  742   2HG1  ILE  97          HG11      ILE  97  11.510   5.155   1.789
  743   1HG2  ILE  97          HG21      ILE  97  14.514   8.077   1.743
  744   2HG2  ILE  97          HG22      ILE  97  12.928   8.675   2.148
  745   3HG2  ILE  97          HG23      ILE  97  13.211   7.947   0.555
  746   1HD1  ILE  97          HD11      ILE  97   9.653   6.314   2.344
  747   2HD1  ILE  97          HD12      ILE  97  10.419   7.882   2.298
  748   3HD1  ILE  97          HD13      ILE  97  10.762   6.743   3.641
  749    H    ASN  98           H        ASN  98  15.936   6.966   1.154
  750    HA   ASN  98           HA       ASN  98  17.735   5.666   3.052
  751   1HB   ASN  98          HB2       ASN  98  19.447   7.121   1.831
  752   2HB   ASN  98          HB1       ASN  98  18.723   5.815   0.889
  753   1HD2  ASN  98          HD21      ASN  98  17.253   8.985   1.660
  754   2HD2  ASN  98          HD22      ASN  98  17.138   9.511   0.058
  755    H    ASP  99           H        ASP  99  15.513   7.802   3.485
  756    HA   ASP  99           HA       ASP  99  17.091   9.537   5.225
  757   1HB   ASP  99          HB2       ASP  99  17.050  10.488   2.932
  758   2HB   ASP  99          HB1       ASP  99  15.333  10.650   3.094
  759    H    LEU 100           H        LEU 100  13.961   9.345   3.668
  760    HA   LEU 100           HA       LEU 100  12.449  10.296   5.935
  761   1HB   LEU 100          HB2       LEU 100  11.391   9.019   3.414
  762   2HB   LEU 100          HB1       LEU 100  10.638  10.154   4.502
  763    HG   LEU 100           HG       LEU 100  13.080  11.118   3.150
  764   1HD1  LEU 100          HD11      LEU 100  12.098  10.070   1.251
  765   2HD1  LEU 100          HD12      LEU 100  11.627  11.751   1.170
  766   3HD1  LEU 100          HD13      LEU 100  10.482  10.533   1.762
  767   1HD2  LEU 100          HD21      LEU 100  10.366  12.281   3.604
  768   2HD2  LEU 100          HD22      LEU 100  11.793  13.122   3.031
  769   3HD2  LEU 100          HD23      LEU 100  11.748  12.494   4.699
  770    H    THR 101           H        THR 101  13.976   7.679   5.847
  771    HA   THR 101           HA       THR 101  12.504   5.382   5.821
  772    HB   THR 101           HB       THR 101  14.790   6.051   7.663
  773    HG1  THR 101           HG1      THR 101  14.964   5.263   4.952
  774   1HG2  THR 101          HG21      THR 101  13.873   3.765   7.843
  775   2HG2  THR 101          HG22      THR 101  15.489   3.748   7.136
  776   3HG2  THR 101          HG23      THR 101  14.074   3.550   6.105
  777    H    PHE 102           H        PHE 102  12.858   7.824   8.356
  778    HA   PHE 102           HA       PHE 102  10.801   6.486   9.926
  779   1HB   PHE 102          HB2       PHE 102  13.412   7.542  10.998
  780   2HB   PHE 102          HB1       PHE 102  12.057   7.057  12.017
  781    HD1  PHE 102           HD1      PHE 102  15.004   6.006  10.268
  782    HD2  PHE 102           HD2      PHE 102  11.335   4.617  11.914
  783    HE1  PHE 102           HE1      PHE 102  15.879   3.707  10.268
  784    HE2  PHE 102           HE2      PHE 102  12.205   2.315  11.922
  785    HZ   PHE 102           HZ       PHE 102  14.480   1.858  11.097
  Start of MODEL   19
    1    HA   MET   1           HA       MET   1 -33.277  -2.650  -6.716
    2   1HB   MET   1          HB2       MET   1 -33.036  -3.644  -3.873
    3   2HB   MET   1          HB1       MET   1 -31.671  -3.011  -4.765
    4   1HG   MET   1          HG2       MET   1 -34.201  -1.505  -4.183
    5   2HG   MET   1          HG1       MET   1 -32.702  -1.382  -3.264
    6   1HE   MET   1          HE1       MET   1 -30.251   0.218  -5.869
    7   2HE   MET   1          HE2       MET   1 -30.468  -1.504  -5.585
    8   3HE   MET   1          HE3       MET   1 -30.441  -0.383  -4.221
    9    H    ALA   2           H        ALA   2 -33.112  -5.717  -4.886
   10    HA   ALA   2           HA       ALA   2 -32.005  -7.607  -5.159
   11   1HB   ALA   2          HB1       ALA   2 -31.546  -8.514  -7.397
   12   2HB   ALA   2          HB2       ALA   2 -31.836  -6.929  -8.115
   13   3HB   ALA   2          HB3       ALA   2 -33.161  -7.804  -7.349
   14    H    HIS   3           H        HIS   3 -30.027  -7.983  -4.454
   15    HA   HIS   3           HA       HIS   3 -28.151  -5.853  -4.800
   16   1HB   HIS   3          HB2       HIS   3 -28.529  -6.908  -2.580
   17   2HB   HIS   3          HB1       HIS   3 -27.783  -8.381  -3.187
   18    HD1  HIS   3           HD1      HIS   3 -25.424  -8.546  -2.405
   19    HD2  HIS   3           HD2      HIS   3 -26.587  -4.616  -2.999
   20    HE1  HIS   3           HE1      HIS   3 -23.450  -7.123  -1.717
   21    H    HIS   4           H        HIS   4 -27.866  -6.092  -6.962
   22    HA   HIS   4           HA       HIS   4 -25.673  -7.911  -7.633
   23   1HB   HIS   4          HB2       HIS   4 -27.819  -8.524  -8.833
   24   2HB   HIS   4          HB1       HIS   4 -27.864  -6.894  -9.482
   25    HD1  HIS   4           HD1      HIS   4 -27.225  -7.016 -11.894
   26    HD2  HIS   4           HD2      HIS   4 -24.985  -9.601  -9.551
   27    HE1  HIS   4           HE1      HIS   4 -25.567  -8.120 -13.448
   28    H    HIS   5           H        HIS   5 -24.020  -6.826  -8.815
   29    HA   HIS   5           HA       HIS   5 -22.630  -5.137  -9.215
   30   1HB   HIS   5          HB2       HIS   5 -25.128  -3.420  -9.507
   31   2HB   HIS   5          HB1       HIS   5 -23.500  -2.855  -9.852
   32    HD1  HIS   5           HD1      HIS   5 -26.371  -4.165 -11.527
   33    HD2  HIS   5           HD2      HIS   5 -22.265  -4.558 -11.951
   34    HE1  HIS   5           HE1      HIS   5 -25.990  -5.003 -13.872
   35    H    HIS   6           H        HIS   6 -21.636  -5.199  -7.378
   36    HA   HIS   6           HA       HIS   6 -22.690  -4.296  -4.912
   37   1HB   HIS   6          HB2       HIS   6 -19.816  -4.843  -5.688
   38   2HB   HIS   6          HB1       HIS   6 -20.414  -4.669  -4.045
   39    HD1  HIS   6           HD1      HIS   6 -20.201  -7.126  -6.875
   40    HD2  HIS   6           HD2      HIS   6 -21.862  -6.874  -3.070
   41    HE1  HIS   6           HE1      HIS   6 -20.882  -9.461  -6.259
   42    H    HIS   7           H        HIS   7 -20.828  -2.853  -7.439
   43    HA   HIS   7           HA       HIS   7 -20.224  -0.782  -7.952
   44   1HB   HIS   7          HB2       HIS   7 -21.941   0.003  -5.587
   45   2HB   HIS   7          HB1       HIS   7 -21.055   1.198  -6.526
   46    HD1  HIS   7           HD1      HIS   7 -24.004  -1.221  -6.825
   47    HD2  HIS   7           HD2      HIS   7 -22.178   1.862  -8.941
   48    HE1  HIS   7           HE1      HIS   7 -25.580  -0.607  -8.671
   49    H    HIS   8           H        HIS   8 -18.250  -0.217  -7.877
   50    HA   HIS   8           HA       HIS   8 -16.478  -1.011  -5.873
   51   1HB   HIS   8          HB2       HIS   8 -14.753   0.214  -7.113
   52   2HB   HIS   8          HB1       HIS   8 -15.783  -0.688  -8.210
   53    HD1  HIS   8           HD1      HIS   8 -17.118   0.718  -9.982
   54    HD2  HIS   8           HD2      HIS   8 -14.973   3.026  -7.260
   55    HE1  HIS   8           HE1      HIS   8 -17.124   3.057 -10.887
   56    H    ASN   9           H        ASN   9 -15.031   0.312  -4.613
   57    HA   ASN   9           HA       ASN   9 -16.441   2.414  -3.309
   58   1HB   ASN   9          HB2       ASN   9 -14.474   2.580  -1.782
   59   2HB   ASN   9          HB1       ASN   9 -15.093   0.942  -1.886
   60   1HD2  ASN   9          HD21      ASN   9 -12.450   2.996  -2.265
   61   2HD2  ASN   9          HD22      ASN   9 -11.282   1.828  -2.747
   62    H    GLN  10           H        GLN  10 -16.421   4.397  -3.738
   63    HA   GLN  10           HA       GLN  10 -15.505   5.164  -6.309
   64   1HB   GLN  10          HB2       GLN  10 -16.875   6.850  -4.241
   65   2HB   GLN  10          HB1       GLN  10 -16.817   7.129  -5.977
   66   1HG   GLN  10          HG2       GLN  10 -18.103   5.118  -6.378
   67   2HG   GLN  10          HG1       GLN  10 -18.069   4.742  -4.666
   68   1HE2  GLN  10          HE21      GLN  10 -20.225   4.732  -4.426
   69   2HE2  GLN  10          HE22      GLN  10 -21.219   6.136  -4.535
   70    H    GLN  11           H        GLN  11 -14.732   6.413  -3.076
   71    HA   GLN  11           HA       GLN  11 -13.074   8.439  -4.297
   72   1HB   GLN  11          HB2       GLN  11 -14.590   8.978  -2.414
   73   2HB   GLN  11          HB1       GLN  11 -13.623   7.945  -1.374
   74   1HG   GLN  11          HG2       GLN  11 -11.690   9.377  -1.750
   75   2HG   GLN  11          HG1       GLN  11 -12.657  10.414  -2.793
   76   1HE2  GLN  11          HE21      GLN  11 -11.269  11.002  -0.350
   77   2HE2  GLN  11          HE22      GLN  11 -12.419  11.666   0.737
   78    H    ASN  12           H        ASN  12 -12.623   5.870  -1.897
   79    HA   ASN  12           HA       ASN  12  -9.748   6.203  -1.936
   80   1HB   ASN  12          HB2       ASN  12 -11.521   4.194  -0.543
   81   2HB   ASN  12          HB1       ASN  12  -9.770   4.117  -0.465
   82   1HD2  ASN  12          HD21      ASN  12  -8.659   5.714   0.692
   83   2HD2  ASN  12          HD22      ASN  12  -9.433   6.723   1.843
   84    H    LYS  13           H        LYS  13 -11.010   5.428  -4.462
   85    HA   LYS  13           HA       LYS  13 -10.299   2.677  -4.947
   86   1HB   LYS  13          HB2       LYS  13 -10.870   3.115  -7.276
   87   2HB   LYS  13          HB1       LYS  13 -12.127   3.720  -6.208
   88   1HG   LYS  13          HG2       LYS  13 -11.305   5.980  -6.468
   89   2HG   LYS  13          HG1       LYS  13  -9.977   5.398  -7.472
   90   1HD   LYS  13          HD2       LYS  13 -11.584   4.582  -9.120
   91   2HD   LYS  13          HD1       LYS  13 -12.913   5.159  -8.112
   92   1HE   LYS  13          HE2       LYS  13 -12.094   7.439  -8.319
   93   2HE   LYS  13          HE1       LYS  13 -10.735   6.872  -9.285
   94   1HZ   LYS  13          HZ1       LYS  13 -13.596   6.689 -10.020
   95   2HZ   LYS  13          HZ2       LYS  13 -12.323   6.080 -10.938
   96   3HZ   LYS  13          HZ3       LYS  13 -12.460   7.740 -10.686
   97    H    LYS  14           H        LYS  14  -8.599   5.516  -4.694
   98    HA   LYS  14           HA       LYS  14  -6.239   4.359  -5.907
   99   1HB   LYS  14          HB2       LYS  14  -7.382   6.038  -7.517
  100   2HB   LYS  14          HB1       LYS  14  -7.051   7.269  -6.317
  101   1HG   LYS  14          HG2       LYS  14  -4.866   5.635  -7.627
  102   2HG   LYS  14          HG1       LYS  14  -5.471   7.131  -8.323
  103   1HD   LYS  14          HD2       LYS  14  -4.766   8.340  -6.305
  104   2HD   LYS  14          HD1       LYS  14  -4.200   6.832  -5.600
  105   1HE   LYS  14          HE2       LYS  14  -2.364   8.172  -6.534
  106   2HE   LYS  14          HE1       LYS  14  -2.506   6.613  -7.323
  107   1HZ   LYS  14          HZ1       LYS  14  -2.134   8.507  -8.846
  108   2HZ   LYS  14          HZ2       LYS  14  -3.651   9.130  -8.458
  109   3HZ   LYS  14          HZ3       LYS  14  -3.503   7.640  -9.221
  110    H    VAL  15           H        VAL  15  -4.417   4.954  -4.704
  111    HA   VAL  15           HA       VAL  15  -4.741   5.311  -2.000
  112    HB   VAL  15           HB       VAL  15  -2.640   4.662  -3.598
  113   1HG1  VAL  15          HG11      VAL  15  -1.983   6.860  -4.243
  114   2HG1  VAL  15          HG12      VAL  15  -0.762   6.194  -3.120
  115   3HG1  VAL  15          HG13      VAL  15  -1.948   7.359  -2.545
  116   1HG2  VAL  15          HG21      VAL  15  -1.264   4.460  -1.612
  117   2HG2  VAL  15          HG22      VAL  15  -2.927   3.959  -1.278
  118   3HG2  VAL  15          HG23      VAL  15  -2.345   5.540  -0.747
  119    H    GLU  16           H        GLU  16  -5.128   7.043  -0.731
  120    HA   GLU  16           HA       GLU  16  -4.459   9.673  -1.809
  121   1HB   GLU  16          HB2       GLU  16  -6.408  10.563  -0.441
  122   2HB   GLU  16          HB1       GLU  16  -6.817   9.646  -1.879
  123   1HG   GLU  16          HG2       GLU  16  -7.291   7.710  -0.548
  124   2HG   GLU  16          HG1       GLU  16  -6.773   8.545   0.904
  125    H    GLY  17           H        GLY  17  -5.168   8.020   1.260
  126   1HA   GLY  17          HA2       GLY  17  -2.721   8.979   2.305
  127   2HA   GLY  17          HA1       GLY  17  -4.114   9.784   3.027
  128    H    GLY  18           H        GLY  18  -2.299   7.023   2.790
  129   1HA   GLY  18          HA2       GLY  18  -2.506   5.945   5.131
  130   2HA   GLY  18          HA1       GLY  18  -4.082   5.481   4.498
  131    H    TYR  19           H        TYR  19  -3.516   3.269   4.646
  132    HA   TYR  19           HA       TYR  19  -1.427   2.428   2.775
  133   1HB   TYR  19          HB2       TYR  19  -2.614   0.898   5.073
  134   2HB   TYR  19          HB1       TYR  19  -1.167   0.486   4.151
  135    HD1  TYR  19           HD1      TYR  19  -2.193   1.663   7.211
  136    HD2  TYR  19           HD2      TYR  19   0.565   2.630   4.122
  137    HE1  TYR  19           HE1      TYR  19  -0.920   2.972   8.791
  138    HE2  TYR  19           HE2      TYR  19   1.880   3.956   5.707
  139    HH   TYR  19           HH       TYR  19   1.340   3.879   9.082
  140    H    GLU  20           H        GLU  20  -2.219   1.851   0.962
  141    HA   GLU  20           HA       GLU  20  -4.864   0.638   0.790
  142   1HB   GLU  20          HB2       GLU  20  -4.482   2.452  -0.771
  143   2HB   GLU  20          HB1       GLU  20  -2.965   1.725  -1.302
  144   1HG   GLU  20          HG2       GLU  20  -4.332  -0.277  -1.999
  145   2HG   GLU  20          HG1       GLU  20  -5.750   0.724  -1.744
  146    H    CYS  21           H        CYS  21  -4.843  -1.479   0.823
  147    HA   CYS  21           HA       CYS  21  -2.531  -3.095   0.547
  148   1HB   CYS  21          HB2       CYS  21  -5.375  -3.983   0.199
  149   2HB   CYS  21          HB1       CYS  21  -3.988  -5.009   0.511
  150    H    LYS  22           H        LYS  22  -1.896  -4.427  -1.005
  151    HA   LYS  22           HA       LYS  22  -2.264  -3.971  -3.736
  152   1HB   LYS  22          HB2       LYS  22  -0.252  -4.976  -3.008
  153   2HB   LYS  22          HB1       LYS  22  -1.102  -6.208  -2.091
  154   1HG   LYS  22          HG2       LYS  22  -0.061  -7.180  -4.049
  155   2HG   LYS  22          HG1       LYS  22  -1.817  -7.269  -4.179
  156   1HD   LYS  22          HD2       LYS  22  -1.782  -5.273  -5.552
  157   2HD   LYS  22          HD1       LYS  22  -0.001  -5.285  -5.467
  158   1HE   LYS  22          HE2       LYS  22  -0.022  -7.532  -6.512
  159   2HE   LYS  22          HE1       LYS  22  -1.779  -7.456  -6.614
  160   1HZ   LYS  22          HZ1       LYS  22  -0.765  -6.907  -8.718
  161   2HZ   LYS  22          HZ2       LYS  22   0.129  -5.672  -8.032
  162   3HZ   LYS  22          HZ3       LYS  22  -1.548  -5.556  -8.115
  163    H    TYR  23           H        TYR  23  -3.986  -5.975  -1.445
  164    HA   TYR  23           HA       TYR  23  -5.340  -7.302  -3.649
  165   1HB   TYR  23          HB2       TYR  23  -5.742  -8.893  -1.382
  166   2HB   TYR  23          HB1       TYR  23  -4.677  -9.227  -2.740
  167    HD1  TYR  23           HD1      TYR  23  -2.257  -8.775  -2.559
  168    HD2  TYR  23           HD2      TYR  23  -4.855  -8.128   0.729
  169    HE1  TYR  23           HE1      TYR  23  -0.313  -8.656  -1.063
  170    HE2  TYR  23           HE2      TYR  23  -2.926  -8.014   2.237
  171    HH   TYR  23           HH       TYR  23  -0.574  -8.820   2.284
  172    H    CYS  24           H        CYS  24  -6.012  -4.822  -1.757
  173    HA   CYS  24           HA       CYS  24  -8.774  -5.333  -2.164
  174   1HB   CYS  24          HB2       CYS  24  -9.541  -4.772   0.122
  175   2HB   CYS  24          HB1       CYS  24  -8.456  -6.160   0.132
  176    H    THR  25           H        THR  25 -10.012  -3.316  -2.072
  177    HA   THR  25           HA       THR  25  -8.238  -1.164  -2.915
  178    HB   THR  25           HB       THR  25 -11.236  -1.258  -3.338
  179    HG1  THR  25           HG1      THR  25 -10.551  -3.170  -4.256
  180   1HG2  THR  25          HG21      THR  25  -8.955  -0.075  -4.957
  181   2HG2  THR  25          HG22      THR  25  -9.984   0.834  -3.857
  182   3HG2  THR  25          HG23      THR  25 -10.680   0.102  -5.305
  183    H    PHE  26           H        PHE  26  -9.569  -2.108  -0.155
  184    HA   PHE  26           HA       PHE  26 -10.520   0.491   0.666
  185   1HB   PHE  26          HB2       PHE  26 -10.486  -2.164   2.118
  186   2HB   PHE  26          HB1       PHE  26 -11.078  -0.657   2.821
  187    HD1  PHE  26           HD1      PHE  26 -11.826  -3.414   0.609
  188    HD2  PHE  26           HD2      PHE  26 -13.063   0.466   1.836
  189    HE1  PHE  26           HE1      PHE  26 -14.028  -3.792  -0.419
  190    HE2  PHE  26           HE2      PHE  26 -15.265   0.094   0.816
  191    HZ   PHE  26           HZ       PHE  26 -15.753  -2.036  -0.318
  192    H    GLN  27           H        GLN  27  -9.345   1.863   1.607
  193    HA   GLN  27           HA       GLN  27  -6.654   1.122   2.491
  194   1HB   GLN  27          HB2       GLN  27  -6.374   2.585   0.711
  195   2HB   GLN  27          HB1       GLN  27  -7.791   3.537   1.154
  196   1HG   GLN  27          HG2       GLN  27  -6.598   4.566   2.961
  197   2HG   GLN  27          HG1       GLN  27  -5.263   3.430   2.735
  198   1HE2  GLN  27          HE21      GLN  27  -3.853   3.816   1.340
  199   2HE2  GLN  27          HE22      GLN  27  -3.673   5.208   0.331
  200    H    THR  28           H        THR  28  -5.940   1.726   4.421
  201    HA   THR  28           HA       THR  28  -7.503   3.587   5.954
  202    HB   THR  28           HB       THR  28  -8.285   1.375   6.760
  203    HG1  THR  28           HG1      THR  28  -8.066   3.046   8.323
  204   1HG2  THR  28          HG21      THR  28  -6.759  -0.192   7.859
  205   2HG2  THR  28          HG22      THR  28  -5.405   0.861   7.538
  206   3HG2  THR  28          HG23      THR  28  -6.230   0.065   6.195
  207    HA   PRO  29           HA       PRO  29  -3.294   4.973   6.615
  208   1HB   PRO  29          HB2       PRO  29  -3.906   7.048   8.241
  209   2HB   PRO  29          HB1       PRO  29  -4.133   7.102   6.487
  210   1HG   PRO  29          HG2       PRO  29  -6.136   6.551   8.636
  211   2HG   PRO  29          HG1       PRO  29  -6.283   7.587   7.202
  212   1HD   PRO  29          HD2       PRO  29  -7.329   5.098   7.277
  213   2HD   PRO  29          HD1       PRO  29  -6.640   5.784   5.782
  214    H    ASP  30           H        ASP  30  -5.293   3.428   8.770
  215    HA   ASP  30           HA       ASP  30  -3.573   3.820  11.092
  216   1HB   ASP  30          HB2       ASP  30  -6.265   3.219  10.856
  217   2HB   ASP  30          HB1       ASP  30  -5.500   1.685  10.972
  218    H    LEU  31           H        LEU  31  -1.776   2.597  11.138
  219    HA   LEU  31           HA       LEU  31  -1.294   0.477   9.447
  220   1HB   LEU  31          HB2       LEU  31   0.225   1.935  10.993
  221   2HB   LEU  31          HB1       LEU  31   0.009   0.629  12.133
  222    HG   LEU  31           HG       LEU  31   2.104   0.280  11.025
  223   1HD1  LEU  31          HD11      LEU  31   1.784  -1.859   9.851
  224   2HD1  LEU  31          HD12      LEU  31   0.046  -1.482   9.804
  225   3HD1  LEU  31          HD13      LEU  31   0.835  -1.760  11.354
  226   1HD2  LEU  31          HD21      LEU  31   1.729   1.705   9.141
  227   2HD2  LEU  31          HD22      LEU  31   0.568   0.563   8.487
  228   3HD2  LEU  31          HD23      LEU  31   2.286   0.115   8.585
  229    H    ASN  32           H        ASN  32  -2.563   0.521  12.818
  230    HA   ASN  32           HA       ASN  32  -2.440  -2.210  13.247
  231   1HB   ASN  32          HB2       ASN  32  -2.895  -0.509  15.030
  232   2HB   ASN  32          HB1       ASN  32  -4.467  -0.260  14.240
  233   1HD2  ASN  32          HD21      ASN  32  -6.098  -1.751  14.479
  234   2HD2  ASN  32          HD22      ASN  32  -5.938  -3.063  15.583
  235    H    MET  33           H        MET  33  -4.938  -0.108  11.969
  236    HA   MET  33           HA       MET  33  -6.818  -2.238  11.606
  237   1HB   MET  33          HB2       MET  33  -6.790   0.422  10.182
  238   2HB   MET  33          HB1       MET  33  -8.115  -0.717  10.205
  239   1HG   MET  33          HG2       MET  33  -6.943   0.672  12.535
  240   2HG   MET  33          HG1       MET  33  -8.464   1.103  11.749
  241   1HE   MET  33          HE1       MET  33  -9.704  -1.814  11.099
  242   2HE   MET  33          HE2       MET  33 -10.642  -0.473  11.752
  243   3HE   MET  33          HE3       MET  33 -10.717  -2.060  12.522
  244    H    PHE  34           H        PHE  34  -4.423  -0.729   9.639
  245    HA   PHE  34           HA       PHE  34  -5.023  -2.030   7.224
  246   1HB   PHE  34          HB2       PHE  34  -3.458  -0.235   7.149
  247   2HB   PHE  34          HB1       PHE  34  -2.418  -0.982   8.334
  248    HD1  PHE  34           HD1      PHE  34  -3.727  -1.446   4.870
  249    HD2  PHE  34           HD2      PHE  34  -0.648  -2.319   7.675
  250    HE1  PHE  34           HE1      PHE  34  -2.400  -2.482   3.079
  251    HE2  PHE  34           HE2      PHE  34   0.695  -3.355   5.879
  252    HZ   PHE  34           HZ       PHE  34  -0.186  -3.437   3.580
  253    H    THR  35           H        THR  35  -2.698  -2.975   9.703
  254    HA   THR  35           HA       THR  35  -2.134  -5.393   8.318
  255    HB   THR  35           HB       THR  35  -0.408  -4.218   9.677
  256    HG1  THR  35           HG1      THR  35   0.592  -5.969  10.216
  257   1HG2  THR  35          HG21      THR  35  -0.387  -4.482  12.132
  258   2HG2  THR  35          HG22      THR  35  -2.035  -5.140  12.043
  259   3HG2  THR  35          HG23      THR  35  -1.701  -3.483  11.518
  260    H    PHE  36           H        PHE  36  -4.350  -4.464  10.795
  261    HA   PHE  36           HA       PHE  36  -5.048  -7.039  11.705
  262   1HB   PHE  36          HB2       PHE  36  -5.725  -5.236  13.121
  263   2HB   PHE  36          HB1       PHE  36  -6.466  -4.368  11.810
  264    HD1  PHE  36           HD1      PHE  36  -8.762  -4.349  11.796
  265    HD2  PHE  36           HD2      PHE  36  -6.761  -7.735  13.378
  266    HE1  PHE  36           HE1      PHE  36 -10.940  -5.371  12.323
  267    HE2  PHE  36           HE2      PHE  36  -8.933  -8.774  13.931
  268    HZ   PHE  36           HZ       PHE  36 -11.026  -7.587  13.394
  269    H    HIS  37           H        HIS  37  -6.556  -4.879   9.306
  270    HA   HIS  37           HA       HIS  37  -8.500  -6.826   8.705
  271   1HB   HIS  37          HB2       HIS  37  -9.419  -5.348   7.115
  272   2HB   HIS  37          HB1       HIS  37  -8.650  -4.274   8.270
  273    HD1  HIS  37           HD1      HIS  37  -7.027  -2.606   7.295
  274    HD2  HIS  37           HD2      HIS  37  -7.974  -5.672   4.694
  275    HE1  HIS  37           HE1      HIS  37  -6.132  -1.892   5.026
  276    H    VAL  38           H        VAL  38  -5.317  -6.237   7.569
  277    HA   VAL  38           HA       VAL  38  -5.458  -7.913   5.299
  278    HB   VAL  38           HB       VAL  38  -3.160  -7.060   7.043
  279   1HG1  VAL  38          HG11      VAL  38  -1.630  -8.018   5.300
  280   2HG1  VAL  38          HG12      VAL  38  -3.041  -8.677   4.463
  281   3HG1  VAL  38          HG13      VAL  38  -2.614  -9.267   6.068
  282   1HG2  VAL  38          HG21      VAL  38  -3.922  -6.334   4.217
  283   2HG2  VAL  38          HG22      VAL  38  -2.488  -5.752   5.059
  284   3HG2  VAL  38          HG23      VAL  38  -4.096  -5.323   5.650
  285    H    ASP  39           H        ASP  39  -4.270  -8.502   8.606
  286    HA   ASP  39           HA       ASP  39  -3.730 -11.226   8.212
  287   1HB   ASP  39          HB2       ASP  39  -2.748  -9.950  10.039
  288   2HB   ASP  39          HB1       ASP  39  -4.335  -9.679  10.738
  289    H    SER  40           H        SER  40  -6.618  -9.566   8.859
  290    HA   SER  40           HA       SER  40  -7.972 -11.983   9.723
  291   1HB   SER  40          HB2       SER  40  -8.303  -9.665  10.766
  292   2HB   SER  40          HB1       SER  40  -9.250  -9.284   9.332
  293    HG   SER  40           HG       SER  40 -10.827 -10.390  10.082
  294    H    GLU  41           H        GLU  41  -8.030  -9.749   6.911
  295    HA   GLU  41           HA       GLU  41 -10.231 -11.335   5.767
  296   1HB   GLU  41          HB2       GLU  41  -9.104  -8.692   4.837
  297   2HB   GLU  41          HB1       GLU  41 -10.464  -9.525   4.108
  298   1HG   GLU  41          HG2       GLU  41 -11.708  -9.295   6.208
  299   2HG   GLU  41          HG1       GLU  41 -10.327  -8.442   6.896
  300    H    HIS  42           H        HIS  42  -6.879 -10.407   5.056
  301    HA   HIS  42           HA       HIS  42  -6.767 -12.419   3.011
  302   1HB   HIS  42          HB2       HIS  42  -5.291 -10.475   1.896
  303   2HB   HIS  42          HB1       HIS  42  -6.935 -10.832   1.355
  304    HD1  HIS  42           HD1      HIS  42  -8.734  -8.988   2.088
  305    HD2  HIS  42           HD2      HIS  42  -4.812  -8.002   3.065
  306    HE1  HIS  42           HE1      HIS  42  -8.769  -6.564   2.616
  307    HA   PRO  43           HA       PRO  43  -3.182 -12.138   5.938
  308   1HB   PRO  43          HB2       PRO  43  -3.176 -14.770   6.691
  309   2HB   PRO  43          HB1       PRO  43  -4.094 -13.506   7.520
  310   1HG   PRO  43          HG2       PRO  43  -5.007 -15.522   5.528
  311   2HG   PRO  43          HG1       PRO  43  -5.851 -14.923   6.970
  312   1HD   PRO  43          HD2       PRO  43  -6.391 -14.122   4.413
  313   2HD   PRO  43          HD1       PRO  43  -6.661 -13.105   5.838
  314    H    ASN  44           H        ASN  44  -3.856 -14.968   3.852
  315    HA   ASN  44           HA       ASN  44  -1.077 -14.831   2.937
  316   1HB   ASN  44          HB2       ASN  44  -2.882 -17.227   3.252
  317   2HB   ASN  44          HB1       ASN  44  -1.502 -17.258   2.164
  318   1HD2  ASN  44          HD21      ASN  44  -2.530 -17.216   5.478
  319   2HD2  ASN  44          HD22      ASN  44  -0.984 -17.532   6.156
  320    H    VAL  45           H        VAL  45  -0.738 -14.320   0.962
  321    HA   VAL  45           HA       VAL  45  -2.510 -14.809  -1.189
  322    HB   VAL  45           HB       VAL  45  -3.737 -12.970  -0.021
  323   1HG1  VAL  45          HG11      VAL  45  -1.235 -11.393  -0.253
  324   2HG1  VAL  45          HG12      VAL  45  -1.982 -12.036   1.213
  325   3HG1  VAL  45          HG13      VAL  45  -2.810 -10.798   0.274
  326   1HG2  VAL  45          HG21      VAL  45  -3.855 -12.987  -2.469
  327   2HG2  VAL  45          HG22      VAL  45  -2.402 -11.988  -2.546
  328   3HG2  VAL  45          HG23      VAL  45  -3.884 -11.338  -1.836
  329    H    VAL  46           H        VAL  46  -1.474 -13.979  -3.192
  330    HA   VAL  46           HA       VAL  46   1.213 -12.951  -2.881
  331    HB   VAL  46           HB       VAL  46   1.773 -15.266  -3.070
  332   1HG1  VAL  46          HG11      VAL  46   0.912 -16.799  -4.769
  333   2HG1  VAL  46          HG12      VAL  46  -0.138 -15.530  -5.393
  334   3HG1  VAL  46          HG13      VAL  46  -0.387 -16.159  -3.763
  335   1HG2  VAL  46          HG21      VAL  46   1.958 -14.168  -5.876
  336   2HG2  VAL  46          HG22      VAL  46   2.933 -15.481  -5.217
  337   3HG2  VAL  46          HG23      VAL  46   3.100 -13.845  -4.579
  338    H    LEU  47           H        LEU  47  -1.026 -13.981  -5.439
  339    HA   LEU  47           HA       LEU  47  -1.837 -13.055  -7.252
  340   1HB   LEU  47          HB2       LEU  47  -2.423 -11.224  -5.572
  341   2HB   LEU  47          HB1       LEU  47  -1.044 -10.340  -6.173
  342    HG   LEU  47           HG       LEU  47  -3.244  -9.541  -7.048
  343   1HD1  LEU  47          HD11      LEU  47  -1.242  -9.075  -8.334
  344   2HD1  LEU  47          HD12      LEU  47  -2.640  -9.339  -9.378
  345   3HD1  LEU  47          HD13      LEU  47  -1.429 -10.608  -9.188
  346   1HD2  LEU  47          HD21      LEU  47  -3.315 -12.193  -8.482
  347   2HD2  LEU  47          HD22      LEU  47  -4.433 -10.851  -8.717
  348   3HD2  LEU  47          HD23      LEU  47  -4.377 -11.688  -7.170
  349    H    ASN  48           H        ASN  48   1.122 -11.034  -6.687
  350    HA   ASN  48           HA       ASN  48   2.584 -12.049  -8.865
  351   1HB   ASN  48          HB2       ASN  48   0.632 -10.938 -10.122
  352   2HB   ASN  48          HB1       ASN  48   1.214  -9.408  -9.501
  353   1HD2  ASN  48          HD21      ASN  48   1.889 -12.052 -11.685
  354   2HD2  ASN  48          HD22      ASN  48   3.044 -11.203 -12.650
  355    H    SER  49           H        SER  49   3.917  -9.594  -9.617
  356    HA   SER  49           HA       SER  49   5.380  -9.210  -7.159
  357   1HB   SER  49          HB2       SER  49   6.012  -8.347  -9.998
  358   2HB   SER  49          HB1       SER  49   7.106  -8.351  -8.606
  359    HG   SER  49           HG       SER  49   6.151 -10.743  -8.721
  360    H    SER  50           H        SER  50   5.121  -7.459  -6.048
  361    HA   SER  50           HA       SER  50   3.707  -5.148  -7.125
  362   1HB   SER  50          HB2       SER  50   3.307  -6.518  -4.486
  363   2HB   SER  50          HB1       SER  50   2.332  -5.213  -5.156
  364    HG   SER  50           HG       SER  50   2.541  -7.899  -6.029
  365    H    TYR  51           H        TYR  51   3.899  -3.402  -5.337
  366    HA   TYR  51           HA       TYR  51   6.633  -3.424  -4.309
  367   1HB   TYR  51          HB2       TYR  51   4.982  -1.248  -5.519
  368   2HB   TYR  51          HB1       TYR  51   6.239  -0.885  -4.362
  369    HD1  TYR  51           HD1      TYR  51   6.662  -3.592  -6.850
  370    HD2  TYR  51           HD2      TYR  51   7.469   0.469  -5.887
  371    HE1  TYR  51           HE1      TYR  51   8.310  -3.488  -8.675
  372    HE2  TYR  51           HE2      TYR  51   9.121   0.580  -7.705
  373    HH   TYR  51           HH       TYR  51   9.323  -1.825 -10.072
  374    H    VAL  52           H        VAL  52   6.962  -2.771  -2.290
  375    HA   VAL  52           HA       VAL  52   4.654  -1.972  -0.675
  376    HB   VAL  52           HB       VAL  52   5.141  -4.373  -0.294
  377   1HG1  VAL  52          HG11      VAL  52   7.841  -3.483   0.597
  378   2HG1  VAL  52          HG12      VAL  52   7.446  -4.382  -0.873
  379   3HG1  VAL  52          HG13      VAL  52   7.177  -5.118   0.695
  380   1HG2  VAL  52          HG21      VAL  52   4.316  -3.152   1.600
  381   2HG2  VAL  52          HG22      VAL  52   5.957  -2.679   2.042
  382   3HG2  VAL  52          HG23      VAL  52   5.471  -4.375   2.123
  383    H    CYS  53           H        CYS  53   5.076  -0.313   0.677
  384    HA   CYS  53           HA       CYS  53   7.700   0.969   0.600
  385   1HB   CYS  53          HB2       CYS  53   5.780   2.389   0.667
  386   2HB   CYS  53          HB1       CYS  53   5.109   1.572   2.061
  387    H    VAL  54           H        VAL  54   9.178  -0.322   1.630
  388    HA   VAL  54           HA       VAL  54   8.752  -2.091   3.708
  389    HB   VAL  54           HB       VAL  54  11.296  -0.758   4.015
  390   1HG1  VAL  54          HG11      VAL  54  12.179  -2.897   3.530
  391   2HG1  VAL  54          HG12      VAL  54  10.605  -3.379   2.914
  392   3HG1  VAL  54          HG13      VAL  54  10.802  -3.036   4.659
  393   1HG2  VAL  54          HG21      VAL  54  11.144   0.001   1.832
  394   2HG2  VAL  54          HG22      VAL  54  10.463  -1.482   1.250
  395   3HG2  VAL  54          HG23      VAL  54  12.168  -1.432   1.747
  396    H    GLU  55           H        GLU  55   9.262   1.286   3.708
  397    HA   GLU  55           HA       GLU  55   9.971   1.800   6.334
  398   1HB   GLU  55          HB2       GLU  55   8.262   3.560   4.586
  399   2HB   GLU  55          HB1       GLU  55   9.297   4.058   5.910
  400   1HG   GLU  55          HG2       GLU  55  10.309   2.809   3.370
  401   2HG   GLU  55          HG1       GLU  55  10.182   4.542   3.638
  402    H    CYS  56           H        CYS  56   6.878   1.476   4.790
  403    HA   CYS  56           HA       CYS  56   5.471   1.869   7.402
  404   1HB   CYS  56          HB2       CYS  56   4.298   1.649   4.653
  405   2HB   CYS  56          HB1       CYS  56   3.508   2.295   6.081
  406    H    ASN  57           H        ASN  57   6.472  -0.402   5.240
  407    HA   ASN  57           HA       ASN  57   5.893  -2.257   4.335
  408   1HB   ASN  57          HB2       ASN  57   6.518  -2.911   6.783
  409   2HB   ASN  57          HB1       ASN  57   4.874  -3.501   6.842
  410   1HD2  ASN  57          HD21      ASN  57   7.736  -3.679   5.316
  411   2HD2  ASN  57          HD22      ASN  57   7.538  -5.237   4.590
  412    H    PHE  58           H        PHE  58   4.437  -1.162   3.211
  413    HA   PHE  58           HA       PHE  58   1.896  -2.421   3.615
  414   1HB   PHE  58          HB2       PHE  58   0.589  -0.538   3.616
  415   2HB   PHE  58          HB1       PHE  58   2.074   0.216   4.156
  416    HD1  PHE  58           HD1      PHE  58   3.267   1.765   2.661
  417    HD2  PHE  58           HD2      PHE  58  -0.262  -0.207   1.435
  418    HE1  PHE  58           HE1      PHE  58   3.024   3.381   0.740
  419    HE2  PHE  58           HE2      PHE  58  -0.512   1.402  -0.444
  420    HZ   PHE  58           HZ       PHE  58   1.138   3.172  -0.768
  421    H    LEU  59           H        LEU  59   1.172  -3.424   1.831
  422    HA   LEU  59           HA       LEU  59   2.694  -3.146  -0.632
  423   1HB   LEU  59          HB2       LEU  59   1.022  -5.294   0.545
  424   2HB   LEU  59          HB1       LEU  59   1.000  -5.121  -1.202
  425    HG   LEU  59           HG       LEU  59   3.586  -5.435   0.285
  426   1HD1  LEU  59          HD11      LEU  59   3.402  -7.814  -0.282
  427   2HD1  LEU  59          HD12      LEU  59   1.813  -7.517  -0.993
  428   3HD1  LEU  59          HD13      LEU  59   2.042  -7.345   0.748
  429   1HD2  LEU  59          HD21      LEU  59   2.680  -5.868  -2.564
  430   2HD2  LEU  59          HD22      LEU  59   4.288  -6.194  -1.955
  431   3HD2  LEU  59          HD23      LEU  59   3.682  -4.542  -1.992
  432    H    THR  60           H        THR  60   1.714  -2.370  -2.457
  433    HA   THR  60           HA       THR  60  -1.132  -1.799  -2.283
  434    HB   THR  60           HB       THR  60  -0.231   0.290  -1.891
  435    HG1  THR  60           HG1      THR  60  -1.558   1.039  -3.385
  436   1HG2  THR  60          HG21      THR  60   1.819  -0.117  -4.089
  437   2HG2  THR  60          HG22      THR  60   2.117  -0.263  -2.368
  438   3HG2  THR  60          HG23      THR  60   1.718   1.295  -3.032
  439    H    LYS  61           H        LYS  61  -2.096  -1.362  -4.381
  440    HA   LYS  61           HA       LYS  61  -1.368  -3.528  -6.188
  441   1HB   LYS  61          HB2       LYS  61  -3.523  -3.143  -7.244
  442   2HB   LYS  61          HB1       LYS  61  -3.726  -3.258  -5.503
  443   1HG   LYS  61          HG2       LYS  61  -3.881  -0.817  -5.359
  444   2HG   LYS  61          HG1       LYS  61  -3.645  -0.698  -7.098
  445   1HD   LYS  61          HD2       LYS  61  -5.996  -0.463  -6.617
  446   2HD   LYS  61          HD1       LYS  61  -5.737  -2.011  -7.415
  447   1HE   LYS  61          HE2       LYS  61  -7.312  -2.149  -5.511
  448   2HE   LYS  61          HE1       LYS  61  -5.897  -3.178  -5.299
  449   1HZ   LYS  61          HZ1       LYS  61  -6.099  -0.452  -4.118
  450   2HZ   LYS  61          HZ2       LYS  61  -4.984  -1.669  -3.750
  451   3HZ   LYS  61          HZ3       LYS  61  -6.565  -1.855  -3.301
  452    H    ARG  62           H        ARG  62  -0.893  -0.215  -5.934
  453    HA   ARG  62           HA       ARG  62  -0.418  -0.031  -8.823
  454   1HB   ARG  62          HB2       ARG  62  -0.980   2.293  -8.713
  455   2HB   ARG  62          HB1       ARG  62  -2.281   1.402  -7.941
  456   1HG   ARG  62          HG2       ARG  62  -1.108   1.927  -5.737
  457   2HG   ARG  62          HG1       ARG  62  -0.142   3.061  -6.678
  458   1HD   ARG  62          HD2       ARG  62  -1.937   4.282  -5.728
  459   2HD   ARG  62          HD1       ARG  62  -2.282   4.095  -7.448
  460    HE   ARG  62           HE       ARG  62  -3.468   2.479  -5.295
  461   1HH1  ARG  62          HH11      ARG  62  -3.745   3.937  -8.556
  462   2HH1  ARG  62          HH12      ARG  62  -5.355   3.431  -8.742
  463   1HH2  ARG  62          HH21      ARG  62  -5.633   1.882  -5.594
  464   2HH2  ARG  62          HH22      ARG  62  -6.493   2.319  -7.000
  465    H    TYR  63           H        TYR  63   1.427   1.234  -9.387
  466    HA   TYR  63           HA       TYR  63   3.482   0.963  -7.385
  467   1HB   TYR  63          HB2       TYR  63   3.676   1.696 -10.319
  468   2HB   TYR  63          HB1       TYR  63   5.045   1.381  -9.249
  469    HD1  TYR  63           HD1      TYR  63   2.501  -0.118 -11.349
  470    HD2  TYR  63           HD2      TYR  63   5.318  -0.938  -8.276
  471    HE1  TYR  63           HE1      TYR  63   2.316  -2.535 -11.834
  472    HE2  TYR  63           HE2      TYR  63   5.148  -3.346  -8.754
  473    HH   TYR  63           HH       TYR  63   3.592  -4.913  -9.726
  474    H    ASP  64           H        ASP  64   1.445   3.302  -8.694
  475    HA   ASP  64           HA       ASP  64   2.798   5.752  -8.377
  476   1HB   ASP  64          HB2       ASP  64  -0.105   5.167  -7.747
  477   2HB   ASP  64          HB1       ASP  64   0.589   6.768  -7.783
  478    H    ALA  65           H        ALA  65   1.129   3.858  -5.996
  479    HA   ALA  65           HA       ALA  65   1.009   5.819  -4.041
  480   1HB   ALA  65          HB1       ALA  65  -0.409   3.903  -3.986
  481   2HB   ALA  65          HB2       ALA  65   0.540   3.958  -2.497
  482   3HB   ALA  65          HB3       ALA  65   0.977   2.841  -3.802
  483    H    LEU  66           H        LEU  66   3.599   3.751  -4.951
  484    HA   LEU  66           HA       LEU  66   5.100   4.243  -2.532
  485   1HB   LEU  66          HB2       LEU  66   6.065   3.120  -5.124
  486   2HB   LEU  66          HB1       LEU  66   6.928   3.073  -3.596
  487    HG   LEU  66           HG       LEU  66   6.157   0.940  -3.841
  488   1HD1  LEU  66          HD11      LEU  66   5.636   1.755  -1.627
  489   2HD1  LEU  66          HD12      LEU  66   4.442   0.565  -2.150
  490   3HD1  LEU  66          HD13      LEU  66   4.047   2.279  -2.193
  491   1HD2  LEU  66          HD21      LEU  66   4.744   1.263  -5.757
  492   2HD2  LEU  66          HD22      LEU  66   3.517   2.038  -4.763
  493   3HD2  LEU  66          HD23      LEU  66   3.877   0.321  -4.540
  494    H    SER  67           H        SER  67   4.885   5.456  -5.780
  495    HA   SER  67           HA       SER  67   7.319   6.999  -5.791
  496   1HB   SER  67          HB2       SER  67   4.825   6.750  -7.328
  497   2HB   SER  67          HB1       SER  67   5.952   8.038  -7.765
  498    HG   SER  67           HG       SER  67   6.764   5.310  -7.493
  499    H    GLU  68           H        GLU  68   3.900   7.691  -5.418
  500    HA   GLU  68           HA       GLU  68   4.363  10.427  -4.840
  501   1HB   GLU  68          HB2       GLU  68   1.828   9.229  -3.928
  502   2HB   GLU  68          HB1       GLU  68   2.153  10.718  -4.794
  503   1HG   GLU  68          HG2       GLU  68   2.740   9.244  -6.787
  504   2HG   GLU  68          HG1       GLU  68   1.985   7.971  -5.895
  505    H    HIS  69           H        HIS  69   4.467   7.590  -3.108
  506    HA   HIS  69           HA       HIS  69   3.604   8.140  -0.569
  507   1HB   HIS  69          HB2       HIS  69   4.658   6.038  -1.582
  508   2HB   HIS  69          HB1       HIS  69   6.179   6.716  -0.958
  509    HD1  HIS  69           HD1      HIS  69   2.714   5.821   0.298
  510    HD2  HIS  69           HD2      HIS  69   6.651   5.993   1.465
  511    HE1  HIS  69           HE1      HIS  69   2.744   4.971   2.674
  512    H    ASN  70           H        ASN  70   7.023   8.652  -1.599
  513    HA   ASN  70           HA       ASN  70   7.611  10.223   0.723
  514   1HB   ASN  70          HB2       ASN  70   9.746  10.709  -0.442
  515   2HB   ASN  70          HB1       ASN  70   9.412   8.997  -0.256
  516   1HD2  ASN  70          HD21      ASN  70  11.157  10.052  -1.941
  517   2HD2  ASN  70          HD22      ASN  70  10.648   9.704  -3.597
  518    H    LEU  71           H        LEU  71   6.010  10.945  -2.035
  519    HA   LEU  71           HA       LEU  71   6.710  13.726  -2.145
  520   1HB   LEU  71          HB2       LEU  71   6.049  12.906  -4.214
  521   2HB   LEU  71          HB1       LEU  71   4.835  11.869  -3.514
  522    HG   LEU  71           HG       LEU  71   3.354  13.710  -3.243
  523   1HD1  LEU  71          HD11      LEU  71   5.527  15.347  -4.627
  524   2HD1  LEU  71          HD12      LEU  71   5.008  15.549  -2.955
  525   3HD1  LEU  71          HD13      LEU  71   3.903  15.937  -4.273
  526   1HD2  LEU  71          HD21      LEU  71   4.489  13.487  -6.023
  527   2HD2  LEU  71          HD22      LEU  71   2.908  14.158  -5.625
  528   3HD2  LEU  71          HD23      LEU  71   3.255  12.464  -5.289
  529    H    LYS  72           H        LYS  72   3.936  11.829  -1.044
  530    HA   LYS  72           HA       LYS  72   2.999  14.185   0.415
  531   1HB   LYS  72          HB2       LYS  72   0.831  12.521   0.372
  532   2HB   LYS  72          HB1       LYS  72   1.070  13.902  -0.712
  533   1HG   LYS  72          HG2       LYS  72   2.233  12.167  -2.211
  534   2HG   LYS  72          HG1       LYS  72   1.547  10.963  -1.173
  535   1HD   LYS  72          HD2       LYS  72   0.001  13.004  -2.763
  536   2HD   LYS  72          HD1       LYS  72   0.086  11.260  -3.034
  537   1HE   LYS  72          HE2       LYS  72  -1.022  10.887  -0.856
  538   2HE   LYS  72          HE1       LYS  72  -1.086  12.620  -0.618
  539   1HZ   LYS  72          HZ1       LYS  72  -2.561  12.839  -2.471
  540   2HZ   LYS  72          HZ2       LYS  72  -3.177  11.691  -1.412
  541   3HZ   LYS  72          HZ3       LYS  72  -2.435  11.199  -2.846
  542    H    TYR  73           H        TYR  73   3.538  10.837   0.781
  543    HA   TYR  73           HA       TYR  73   2.466  10.683   3.480
  544   1HB   TYR  73          HB2       TYR  73   3.904   8.696   1.756
  545   2HB   TYR  73          HB1       TYR  73   3.282   8.290   3.361
  546    HD1  TYR  73           HD1      TYR  73   2.050   9.874   0.210
  547    HD2  TYR  73           HD2      TYR  73   1.306   7.074   3.299
  548    HE1  TYR  73           HE1      TYR  73  -0.015   9.251  -0.889
  549    HE2  TYR  73           HE2      TYR  73  -0.776   6.420   2.207
  550    HH   TYR  73           HH       TYR  73  -2.439   7.718   0.599
  551    H    HIS  74           H        HIS  74   5.687  10.162   1.986
  552    HA   HIS  74           HA       HIS  74   6.897  10.980   4.597
  553   1HB   HIS  74          HB2       HIS  74   8.130   9.290   2.387
  554   2HB   HIS  74          HB1       HIS  74   9.015   9.855   3.784
  555    HD1  HIS  74           HD1      HIS  74   9.053   8.209   5.755
  556    HD2  HIS  74           HD2      HIS  74   6.190   7.371   2.893
  557    HE1  HIS  74           HE1      HIS  74   8.245   5.890   6.273
  558    HA   PRO  75           HA       PRO  75   7.781  14.160   1.292
  559   1HB   PRO  75          HB2       PRO  75   6.968  16.334   2.613
  560   2HB   PRO  75          HB1       PRO  75   5.821  15.271   1.785
  561   1HG   PRO  75          HG2       PRO  75   6.576  15.303   4.698
  562   2HG   PRO  75          HG1       PRO  75   4.952  15.246   3.969
  563   1HD   PRO  75          HD2       PRO  75   6.197  13.021   4.860
  564   2HD   PRO  75          HD1       PRO  75   5.134  13.041   3.441
  565    H    GLY  76           H        GLY  76   9.525  15.383   1.051
  566   1HA   GLY  76          HA2       GLY  76  10.918  17.020   2.625
  567   2HA   GLY  76          HA1       GLY  76  11.482  15.446   3.173
  568    H    GLU  77           H        GLU  77  11.425  14.096   0.710
  569    HA   GLU  77           HA       GLU  77  13.028  15.452  -1.222
  570   1HB   GLU  77          HB2       GLU  77  15.014  14.005  -0.935
  571   2HB   GLU  77          HB1       GLU  77  14.759  15.013   0.474
  572   1HG   GLU  77          HG2       GLU  77  15.108  13.094   1.611
  573   2HG   GLU  77          HG1       GLU  77  13.422  12.785   1.187
  574    H    GLU  78           H        GLU  78  13.767  13.616  -2.854
  575    HA   GLU  78           HA       GLU  78  11.670  11.581  -2.804
  576   1HB   GLU  78          HB2       GLU  78  10.949  13.501  -4.179
  577   2HB   GLU  78          HB1       GLU  78  12.436  13.286  -5.109
  578   1HG   GLU  78          HG2       GLU  78  11.669  11.204  -5.966
  579   2HG   GLU  78          HG1       GLU  78  10.250  11.222  -4.915
  580    H    ASN  79           H        ASN  79  13.260  10.089  -2.238
  581    HA   ASN  79           HA       ASN  79  14.851   9.078  -4.472
  582   1HB   ASN  79          HB2       ASN  79  15.898   9.768  -1.749
  583   2HB   ASN  79          HB1       ASN  79  16.841   8.845  -2.936
  584   1HD2  ASN  79          HD21      ASN  79  15.596  11.832  -1.957
  585   2HD2  ASN  79          HD22      ASN  79  16.347  12.893  -3.094
  586    H    PHE  80           H        PHE  80  13.519   7.317  -4.461
  587    HA   PHE  80           HA       PHE  80  13.477   5.675  -2.038
  588   1HB   PHE  80          HB2       PHE  80  11.550   6.118  -4.202
  589   2HB   PHE  80          HB1       PHE  80  11.856   4.421  -3.888
  590    HD1  PHE  80           HD1      PHE  80  11.648   3.676  -1.419
  591    HD2  PHE  80           HD2      PHE  80  10.006   7.275  -2.939
  592    HE1  PHE  80           HE1      PHE  80   9.962   3.650   0.358
  593    HE2  PHE  80           HE2      PHE  80   8.339   7.274  -1.115
  594    HZ   PHE  80           HZ       PHE  80   8.310   5.446   0.509
  595    H    LYS  81           H        LYS  81  14.159   3.534  -2.112
  596    HA   LYS  81           HA       LYS  81  15.816   2.809  -4.435
  597   1HB   LYS  81          HB2       LYS  81  17.409   2.001  -2.964
  598   2HB   LYS  81          HB1       LYS  81  16.628   3.165  -1.897
  599   1HG   LYS  81          HG2       LYS  81  15.315   1.482  -0.869
  600   2HG   LYS  81          HG1       LYS  81  15.860   0.278  -2.027
  601   1HD   LYS  81          HD2       LYS  81  18.211   0.786  -1.169
  602   2HD   LYS  81          HD1       LYS  81  17.371   1.585   0.176
  603   1HE   LYS  81          HE2       LYS  81  16.127  -0.463   0.616
  604   2HE   LYS  81          HE1       LYS  81  16.954  -1.232  -0.734
  605   1HZ   LYS  81          HZ1       LYS  81  19.054  -1.059   0.468
  606   2HZ   LYS  81          HZ2       LYS  81  17.939  -1.823   1.452
  607   3HZ   LYS  81          HZ3       LYS  81  18.310  -0.216   1.720
  608    H    LEU  82           H        LEU  82  15.876   0.290  -4.664
  609    HA   LEU  82           HA       LEU  82  13.316  -0.804  -3.849
  610   1HB   LEU  82          HB2       LEU  82  13.053  -1.944  -6.013
  611   2HB   LEU  82          HB1       LEU  82  12.994  -0.206  -6.172
  612    HG   LEU  82           HG       LEU  82  15.515  -1.726  -6.736
  613   1HD1  LEU  82          HD11      LEU  82  13.245  -1.099  -8.661
  614   2HD1  LEU  82          HD12      LEU  82  13.715  -2.712  -8.121
  615   3HD1  LEU  82          HD13      LEU  82  14.813  -1.762  -9.122
  616   1HD2  LEU  82          HD21      LEU  82  15.670   0.712  -6.549
  617   2HD2  LEU  82          HD22      LEU  82  14.429   0.893  -7.790
  618   3HD2  LEU  82          HD23      LEU  82  15.988   0.178  -8.196
  619    H    THR  83           H        THR  83  13.437  -2.723  -2.970
  620    HA   THR  83           HA       THR  83  15.786  -4.321  -3.460
  621    HB   THR  83           HB       THR  83  16.304  -3.093  -1.444
  622    HG1  THR  83           HG1      THR  83  16.594  -5.452  -1.601
  623   1HG2  THR  83          HG21      THR  83  14.027  -2.452  -0.763
  624   2HG2  THR  83          HG22      THR  83  14.943  -3.110   0.581
  625   3HG2  THR  83          HG23      THR  83  13.731  -4.111  -0.233
  626    H    MET  84           H        MET  84  15.097  -6.536  -3.797
  627    HA   MET  84           HA       MET  84  12.207  -6.905  -3.257
  628   1HB   MET  84          HB2       MET  84  13.816  -9.023  -4.625
  629   2HB   MET  84          HB1       MET  84  12.154  -8.522  -4.887
  630   1HG   MET  84          HG2       MET  84  13.327  -7.998  -6.843
  631   2HG   MET  84          HG1       MET  84  13.035  -6.489  -5.989
  632   1HE   MET  84          HE1       MET  84  16.454  -5.778  -7.757
  633   2HE   MET  84          HE2       MET  84  14.820  -5.192  -7.463
  634   3HE   MET  84          HE3       MET  84  15.069  -6.672  -8.386
  635    H    VAL  85           H        VAL  85  12.083  -7.490  -1.177
  636    HA   VAL  85           HA       VAL  85  13.011 -10.115  -0.585
  637    HB   VAL  85           HB       VAL  85  13.619  -9.201   1.857
  638   1HG1  VAL  85          HG11      VAL  85  15.541  -9.000  -0.464
  639   2HG1  VAL  85          HG12      VAL  85  15.162 -10.470   0.436
  640   3HG1  VAL  85          HG13      VAL  85  15.994  -9.135   1.233
  641   1HG2  VAL  85          HG21      VAL  85  13.130  -6.846   1.369
  642   2HG2  VAL  85          HG22      VAL  85  14.344  -6.854   0.087
  643   3HG2  VAL  85          HG23      VAL  85  14.840  -7.055   1.766
  644    H    LYS  86           H        LYS  86  10.956 -11.006  -0.166
  645    HA   LYS  86           HA       LYS  86   9.692  -9.650   2.040
  646   1HB   LYS  86          HB2       LYS  86   8.568  -8.989  -0.183
  647   2HB   LYS  86          HB1       LYS  86   7.911 -10.628  -0.162
  648   1HG   LYS  86          HG2       LYS  86   6.284  -9.251   0.672
  649   2HG   LYS  86          HG1       LYS  86   6.942 -10.078   2.092
  650   1HD   LYS  86          HD2       LYS  86   8.217  -8.145   2.741
  651   2HD   LYS  86          HD1       LYS  86   7.949  -7.350   1.204
  652   1HE   LYS  86          HE2       LYS  86   6.436  -6.182   2.541
  653   2HE   LYS  86          HE1       LYS  86   5.455  -7.473   1.914
  654   1HZ   LYS  86          HZ1       LYS  86   5.300  -7.085   4.401
  655   2HZ   LYS  86          HZ2       LYS  86   6.834  -7.702   4.528
  656   3HZ   LYS  86          HZ3       LYS  86   5.607  -8.688   3.989
  657    H    ARG  87           H        ARG  87   9.207 -10.994   3.562
  658    HA   ARG  87           HA       ARG  87   9.487 -13.798   2.830
  659   1HB   ARG  87          HB2       ARG  87  10.505 -12.424   5.330
  660   2HB   ARG  87          HB1       ARG  87  10.649 -14.138   4.977
  661   1HG   ARG  87          HG2       ARG  87  12.788 -13.289   4.421
  662   2HG   ARG  87          HG1       ARG  87  11.933 -13.403   2.881
  663   1HD   ARG  87          HD2       ARG  87  13.157 -11.310   2.966
  664   2HD   ARG  87          HD1       ARG  87  11.429 -11.024   2.948
  665    HE   ARG  87           HE       ARG  87  12.597 -11.051   5.591
  666   1HH1  ARG  87          HH11      ARG  87  11.638  -8.898   2.853
  667   2HH1  ARG  87          HH12      ARG  87  11.755  -7.508   3.740
  668   1HH2  ARG  87          HH21      ARG  87  12.708  -9.049   6.804
  669   2HH2  ARG  87          HH22      ARG  87  12.392  -7.565   6.012
  670    H    ASN  88           H        ASN  88   8.282 -15.284   4.075
  671    HA   ASN  88           HA       ASN  88   6.463 -16.082   5.100
  672   1HB   ASN  88          HB2       ASN  88   6.750 -13.564   6.744
  673   2HB   ASN  88          HB1       ASN  88   5.494 -14.750   7.065
  674   1HD2  ASN  88          HD21      ASN  88   6.054 -16.726   7.902
  675   2HD2  ASN  88          HD22      ASN  88   7.584 -17.055   8.597
  676    H    ASN  89           H        ASN  89   6.208 -14.149   2.812
  677    HA   ASN  89           HA       ASN  89   3.293 -13.939   2.955
  678   1HB   ASN  89          HB2       ASN  89   5.071 -11.629   2.067
  679   2HB   ASN  89          HB1       ASN  89   3.341 -11.699   1.813
  680   1HD2  ASN  89          HD21      ASN  89   5.922 -11.085   4.042
  681   2HD2  ASN  89          HD22      ASN  89   4.921 -10.506   5.316
  682    H    GLN  90           H        GLN  90   5.430 -12.524   0.581
  683    HA   GLN  90           HA       GLN  90   5.439 -14.671  -1.250
  684   1HB   GLN  90          HB2       GLN  90   4.274 -13.562  -3.019
  685   2HB   GLN  90          HB1       GLN  90   3.164 -13.585  -1.635
  686   1HG   GLN  90          HG2       GLN  90   4.814 -11.251  -2.431
  687   2HG   GLN  90          HG1       GLN  90   3.190 -11.515  -3.074
  688   1HE2  GLN  90          HE21      GLN  90   5.119 -10.497  -0.458
  689   2HE2  GLN  90          HE22      GLN  90   3.775  -9.972   0.537
  690    H    THR  91           H        THR  91   6.682 -13.639  -3.256
  691    HA   THR  91           HA       THR  91   8.464 -11.759  -1.995
  692    HB   THR  91           HB       THR  91   9.980 -12.446  -4.040
  693    HG1  THR  91           HG1      THR  91   8.427 -14.782  -3.624
  694   1HG2  THR  91          HG21      THR  91   9.530 -14.240  -1.618
  695   2HG2  THR  91          HG22      THR  91  10.513 -12.801  -1.623
  696   3HG2  THR  91          HG23      THR  91  10.995 -14.188  -2.591
  697    H    ILE  92           H        ILE  92   8.316  -9.826  -2.363
  698    HA   ILE  92           HA       ILE  92   7.511  -8.732  -4.864
  699    HB   ILE  92           HB       ILE  92   6.076  -7.054  -3.574
  700   1HG1  ILE  92          HG12      ILE  92   4.931  -8.293  -1.559
  701   2HG1  ILE  92          HG11      ILE  92   6.469  -9.118  -1.525
  702   1HG2  ILE  92          HG21      ILE  92   5.126  -8.742  -5.091
  703   2HG2  ILE  92          HG22      ILE  92   4.064  -8.369  -3.750
  704   3HG2  ILE  92          HG23      ILE  92   5.006  -9.868  -3.747
  705   1HD1  ILE  92          HD11      ILE  92   6.397  -7.144  -0.070
  706   2HD1  ILE  92          HD12      ILE  92   6.283  -6.137  -1.517
  707   3HD1  ILE  92          HD13      ILE  92   7.696  -7.144  -1.248
  708    H    PHE  93           H        PHE  93   7.898  -6.284  -4.915
  709    HA   PHE  93           HA       PHE  93  10.680  -6.016  -4.081
  710   1HB   PHE  93          HB2       PHE  93   8.867  -4.258  -5.735
  711   2HB   PHE  93          HB1       PHE  93  10.565  -3.974  -5.464
  712    HD1  PHE  93           HD1      PHE  93   8.131  -6.222  -7.110
  713    HD2  PHE  93           HD2      PHE  93  12.132  -4.936  -6.783
  714    HE1  PHE  93           HE1      PHE  93   8.663  -7.387  -9.241
  715    HE2  PHE  93           HE2      PHE  93  12.697  -6.102  -8.909
  716    HZ   PHE  93           HZ       PHE  93  10.945  -7.323 -10.125
  717    H    GLU  94           H        GLU  94  11.160  -4.817  -2.315
  718    HA   GLU  94           HA       GLU  94   9.104  -3.181  -1.116
  719   1HB   GLU  94          HB2       GLU  94  11.788  -4.021   0.032
  720   2HB   GLU  94          HB1       GLU  94  10.454  -3.272   0.881
  721   1HG   GLU  94          HG2       GLU  94   9.155  -5.381   0.194
  722   2HG   GLU  94          HG1       GLU  94  10.758  -6.072  -0.027
  723    H    GLN  95           H        GLN  95   9.466  -1.037  -0.823
  724    HA   GLN  95           HA       GLN  95  11.818   0.018  -2.227
  725   1HB   GLN  95          HB2       GLN  95   9.486   0.186  -3.349
  726   2HB   GLN  95          HB1       GLN  95   9.131   1.387  -2.111
  727   1HG   GLN  95          HG2       GLN  95  10.902   2.775  -2.862
  728   2HG   GLN  95          HG1       GLN  95  11.474   1.528  -3.963
  729   1HE2  GLN  95          HE21      GLN  95   9.144   4.031  -3.377
  730   2HE2  GLN  95          HE22      GLN  95   8.517   4.067  -4.980
  731    H    THR  96           H        THR  96  13.144   0.950  -0.757
  732    HA   THR  96           HA       THR  96  11.987   2.182   1.660
  733    HB   THR  96           HB       THR  96  14.827   1.787   1.845
  734    HG1  THR  96           HG1      THR  96  14.373  -0.684   1.899
  735   1HG2  THR  96          HG21      THR  96  13.353   1.986   3.765
  736   2HG2  THR  96          HG22      THR  96  14.132   0.399   3.816
  737   3HG2  THR  96          HG23      THR  96  12.465   0.559   3.275
  738    H    ILE  97           H        ILE  97  13.162   4.043   2.471
  739    HA   ILE  97           HA       ILE  97  14.169   5.737   0.279
  740    HB   ILE  97           HB       ILE  97  13.285   6.685   3.029
  741   1HG1  ILE  97          HG12      ILE  97  11.508   6.674   0.636
  742   2HG1  ILE  97          HG11      ILE  97  11.575   5.230   1.632
  743   1HG2  ILE  97          HG21      ILE  97  13.224   7.974   0.273
  744   2HG2  ILE  97          HG22      ILE  97  14.571   8.136   1.384
  745   3HG2  ILE  97          HG23      ILE  97  12.995   8.767   1.841
  746   1HD1  ILE  97          HD11      ILE  97  10.939   6.830   3.557
  747   2HD1  ILE  97          HD12      ILE  97   9.750   6.340   2.387
  748   3HD1  ILE  97          HD13      ILE  97  10.452   7.945   2.249
  749    H    ASN  98           H        ASN  98  15.958   7.034   0.729
  750    HA   ASN  98           HA       ASN  98  17.859   5.758   2.544
  751   1HB   ASN  98          HB2       ASN  98  19.510   7.217   1.231
  752   2HB   ASN  98          HB1       ASN  98  18.751   5.895   0.345
  753   1HD2  ASN  98          HD21      ASN  98  17.249   9.048   1.121
  754   2HD2  ASN  98          HD22      ASN  98  17.118   9.560  -0.486
  755    H    ASP  99           H        ASP  99  15.656   7.905   3.072
  756    HA   ASP  99           HA       ASP  99  17.311   9.722   4.691
  757   1HB   ASP  99          HB2       ASP  99  17.121  10.590   2.346
  758   2HB   ASP  99          HB1       ASP  99  15.415  10.757   2.627
  759    H    LEU 100           H        LEU 100  14.049   9.358   3.342
  760    HA   LEU 100           HA       LEU 100  12.739  10.627   5.558
  761   1HB   LEU 100          HB2       LEU 100  11.483   9.158   3.211
  762   2HB   LEU 100          HB1       LEU 100  10.798  10.361   4.271
  763    HG   LEU 100           HG       LEU 100  13.157  11.244   2.740
  764   1HD1  LEU 100          HD11      LEU 100  11.572  11.781   0.838
  765   2HD1  LEU 100          HD12      LEU 100  10.520  10.501   1.479
  766   3HD1  LEU 100          HD13      LEU 100  12.156  10.148   0.929
  767   1HD2  LEU 100          HD21      LEU 100  11.897  13.257   2.619
  768   2HD2  LEU 100          HD22      LEU 100  11.824  12.681   4.300
  769   3HD2  LEU 100          HD23      LEU 100  10.460  12.447   3.190
  770    H    THR 101           H        THR 101  14.161   7.968   5.591
  771    HA   THR 101           HA       THR 101  12.359   5.974   6.414
  772    HB   THR 101           HB       THR 101  15.330   6.272   6.906
  773    HG1  THR 101           HG1      THR 101  13.978   5.159   4.695
  774   1HG2  THR 101          HG21      THR 101  13.624   3.824   6.402
  775   2HG2  THR 101          HG22      THR 101  14.261   4.273   7.994
  776   3HG2  THR 101          HG23      THR 101  15.354   3.825   6.674
  777    H    PHE 102           H        PHE 102  13.940   8.723   7.786
  778    HA   PHE 102           HA       PHE 102  13.233   7.909  10.518
  779   1HB   PHE 102          HB2       PHE 102  15.431   9.803   9.630
  780   2HB   PHE 102          HB1       PHE 102  15.005   9.457  11.300
  781    HD1  PHE 102           HD1      PHE 102  15.431   7.190  12.223
  782    HD2  PHE 102           HD2      PHE 102  16.813   8.357   8.375
  783    HE1  PHE 102           HE1      PHE 102  17.023   5.315  12.231
  784    HE2  PHE 102           HE2      PHE 102  18.406   6.485   8.369
  785    HZ   PHE 102           HZ       PHE 102  18.514   4.959  10.299
  Start of MODEL   20
    1    HA   MET   1           HA       MET   1 -10.087  28.494 -15.333
    2   1HB   MET   1          HB2       MET   1  -8.299  28.763 -13.712
    3   2HB   MET   1          HB1       MET   1  -8.836  30.391 -13.332
    4   1HG   MET   1          HG2       MET   1  -9.441  28.746 -11.595
    5   2HG   MET   1          HG1       MET   1 -10.842  29.552 -12.296
    6   1HE   MET   1          HE1       MET   1 -12.477  27.740 -11.303
    7   2HE   MET   1          HE2       MET   1 -11.134  26.862 -10.564
    8   3HE   MET   1          HE3       MET   1 -12.306  26.006 -11.559
    9    H    ALA   2           H        ALA   2 -12.167  28.514 -14.984
   10    HA   ALA   2           HA       ALA   2 -13.520  30.913 -14.116
   11   1HB   ALA   2          HB1       ALA   2 -13.468  31.178 -16.534
   12   2HB   ALA   2          HB2       ALA   2 -15.112  30.835 -15.980
   13   3HB   ALA   2          HB3       ALA   2 -14.150  29.565 -16.736
   14    H    HIS   3           H        HIS   3 -14.187  27.713 -15.569
   15    HA   HIS   3           HA       HIS   3 -15.832  27.071 -13.224
   16   1HB   HIS   3          HB2       HIS   3 -16.672  26.838 -16.117
   17   2HB   HIS   3          HB1       HIS   3 -17.513  26.040 -14.796
   18    HD1  HIS   3           HD1      HIS   3 -17.471  29.134 -16.698
   19    HD2  HIS   3           HD2      HIS   3 -18.602  27.941 -12.889
   20    HE1  HIS   3           HE1      HIS   3 -18.979  30.954 -15.813
   21    H    HIS   4           H        HIS   4 -13.153  26.207 -14.115
   22    HA   HIS   4           HA       HIS   4 -13.470  23.527 -15.062
   23   1HB   HIS   4          HB2       HIS   4 -11.323  24.876 -15.325
   24   2HB   HIS   4          HB1       HIS   4 -11.063  24.660 -13.599
   25    HD1  HIS   4           HD1      HIS   4  -9.618  22.640 -13.020
   26    HD2  HIS   4           HD2      HIS   4 -11.495  22.281 -16.713
   27    HE1  HIS   4           HE1      HIS   4  -8.788  20.500 -14.019
   28    H    HIS   5           H        HIS   5 -14.412  22.058 -13.925
   29    HA   HIS   5           HA       HIS   5 -14.731  22.255 -11.099
   30   1HB   HIS   5          HB2       HIS   5 -15.626  20.222 -13.130
   31   2HB   HIS   5          HB1       HIS   5 -15.919  20.020 -11.408
   32    HD1  HIS   5           HD1      HIS   5 -16.985  22.180 -14.358
   33    HD2  HIS   5           HD2      HIS   5 -17.883  21.575 -10.349
   34    HE1  HIS   5           HE1      HIS   5 -19.110  23.442 -13.921
   35    H    HIS   6           H        HIS   6 -13.260  21.697  -9.733
   36    HA   HIS   6           HA       HIS   6 -11.344  19.602 -10.414
   37   1HB   HIS   6          HB2       HIS   6 -11.326  21.653  -8.184
   38   2HB   HIS   6          HB1       HIS   6 -10.075  20.447  -8.453
   39    HD1  HIS   6           HD1      HIS   6 -11.104  23.834  -9.409
   40    HD2  HIS   6           HD2      HIS   6  -8.592  20.880 -10.876
   41    HE1  HIS   6           HE1      HIS   6  -9.571  24.979 -11.030
   42    H    HIS   7           H        HIS   7 -12.025  17.675  -9.771
   43    HA   HIS   7           HA       HIS   7 -13.730  17.392  -7.467
   44   1HB   HIS   7          HB2       HIS   7 -12.346  15.295  -9.180
   45   2HB   HIS   7          HB1       HIS   7 -13.510  14.950  -7.913
   46    HD1  HIS   7           HD1      HIS   7 -13.264  16.027 -11.470
   47    HD2  HIS   7           HD2      HIS   7 -16.178  15.562  -8.548
   48    HE1  HIS   7           HE1      HIS   7 -15.486  16.072 -12.679
   49    H    HIS   8           H        HIS   8 -12.710  17.905  -5.626
   50    HA   HIS   8           HA       HIS   8  -9.950  17.455  -5.175
   51   1HB   HIS   8          HB2       HIS   8 -12.142  17.914  -3.123
   52   2HB   HIS   8          HB1       HIS   8 -10.413  18.030  -2.830
   53    HD1  HIS   8           HD1      HIS   8 -13.172  20.155  -3.341
   54    HD2  HIS   8           HD2      HIS   8  -9.265  20.106  -4.735
   55    HE1  HIS   8           HE1      HIS   8 -12.672  22.508  -4.108
   56    H    ASN   9           H        ASN   9  -9.190  15.549  -5.169
   57    HA   ASN   9           HA       ASN   9  -8.954  13.347  -5.100
   58   1HB   ASN   9          HB2       ASN   9 -10.426  13.624  -2.481
   59   2HB   ASN   9          HB1       ASN   9  -9.900  12.067  -3.086
   60   1HD2  ASN   9          HD21      ASN   9  -8.509  11.658  -1.515
   61   2HD2  ASN   9          HD22      ASN   9  -7.057  12.551  -1.188
   62    H    GLN  10           H        GLN  10 -12.096  13.023  -3.564
   63    HA   GLN  10           HA       GLN  10 -13.863  11.672  -4.109
   64   1HB   GLN  10          HB2       GLN  10 -13.807  13.714  -5.929
   65   2HB   GLN  10          HB1       GLN  10 -13.559  12.365  -7.020
   66   1HG   GLN  10          HG2       GLN  10 -15.921  12.712  -5.163
   67   2HG   GLN  10          HG1       GLN  10 -15.916  13.066  -6.885
   68   1HE2  GLN  10          HE21      GLN  10 -15.940  10.585  -4.459
   69   2HE2  GLN  10          HE22      GLN  10 -16.352   9.284  -5.513
   70    H    GLN  11           H        GLN  11 -11.513  10.498  -3.829
   71    HA   GLN  11           HA       GLN  11 -10.992   8.911  -6.208
   72   1HB   GLN  11          HB2       GLN  11  -9.219  10.426  -5.322
   73   2HB   GLN  11          HB1       GLN  11  -9.188   9.453  -3.862
   74   1HG   GLN  11          HG2       GLN  11  -7.379   8.906  -5.429
   75   2HG   GLN  11          HG1       GLN  11  -8.446   7.536  -5.112
   76   1HE2  GLN  11          HE21      GLN  11  -7.485   9.927  -7.421
   77   2HE2  GLN  11          HE22      GLN  11  -8.226   9.206  -8.797
   78    H    ASN  12           H        ASN  12 -10.611   6.777  -5.968
   79    HA   ASN  12           HA       ASN  12 -10.951   5.314  -3.521
   80   1HB   ASN  12          HB2       ASN  12 -13.329   6.000  -4.022
   81   2HB   ASN  12          HB1       ASN  12 -13.205   5.121  -5.538
   82   1HD2  ASN  12          HD21      ASN  12 -14.943   3.785  -4.940
   83   2HD2  ASN  12          HD22      ASN  12 -14.783   2.559  -3.736
   84    H    LYS  13           H        LYS  13 -10.519   5.573  -6.938
   85    HA   LYS  13           HA       LYS  13  -9.936   2.756  -7.279
   86   1HB   LYS  13          HB2       LYS  13  -9.873   5.055  -9.227
   87   2HB   LYS  13          HB1       LYS  13  -9.625   3.366  -9.636
   88   1HG   LYS  13          HG2       LYS  13 -12.140   4.523  -8.471
   89   2HG   LYS  13          HG1       LYS  13 -11.890   4.172 -10.179
   90   1HD   LYS  13          HD2       LYS  13 -11.514   1.781  -9.544
   91   2HD   LYS  13          HD1       LYS  13 -11.939   2.209  -7.887
   92   1HE   LYS  13          HE2       LYS  13 -13.869   1.275  -9.044
   93   2HE   LYS  13          HE1       LYS  13 -14.138   2.966  -8.633
   94   1HZ   LYS  13          HZ1       LYS  13 -13.577   3.554 -10.939
   95   2HZ   LYS  13          HZ2       LYS  13 -14.888   2.520 -10.856
   96   3HZ   LYS  13          HZ3       LYS  13 -13.383   1.917 -11.318
   97    H    LYS  14           H        LYS  14  -8.295   5.354  -6.111
   98    HA   LYS  14           HA       LYS  14  -5.726   4.225  -6.804
   99   1HB   LYS  14          HB2       LYS  14  -6.335   5.969  -8.550
  100   2HB   LYS  14          HB1       LYS  14  -6.374   7.170  -7.284
  101   1HG   LYS  14          HG2       LYS  14  -3.897   5.589  -7.902
  102   2HG   LYS  14          HG1       LYS  14  -4.310   7.036  -8.816
  103   1HD   LYS  14          HD2       LYS  14  -4.257   8.328  -6.734
  104   2HD   LYS  14          HD1       LYS  14  -3.869   6.861  -5.841
  105   1HE   LYS  14          HE2       LYS  14  -1.838   8.079  -6.183
  106   2HE   LYS  14          HE1       LYS  14  -1.811   6.649  -7.212
  107   1HZ   LYS  14          HZ1       LYS  14  -2.590   9.347  -8.190
  108   2HZ   LYS  14          HZ2       LYS  14  -2.215   8.005  -9.137
  109   3HZ   LYS  14          HZ3       LYS  14  -1.021   8.773  -8.224
  110    H    VAL  15           H        VAL  15  -4.094   4.918  -5.293
  111    HA   VAL  15           HA       VAL  15  -4.878   5.008  -2.617
  112    HB   VAL  15           HB       VAL  15  -2.635   4.362  -3.837
  113   1HG1  VAL  15          HG11      VAL  15  -1.879   6.424  -4.660
  114   2HG1  VAL  15          HG12      VAL  15  -0.791   5.932  -3.332
  115   3HG1  VAL  15          HG13      VAL  15  -2.015   7.159  -3.059
  116   1HG2  VAL  15          HG21      VAL  15  -1.401   4.400  -1.729
  117   2HG2  VAL  15          HG22      VAL  15  -3.079   3.849  -1.520
  118   3HG2  VAL  15          HG23      VAL  15  -2.614   5.495  -1.083
  119    H    GLU  16           H        GLU  16  -5.386   6.757  -1.179
  120    HA   GLU  16           HA       GLU  16  -5.056   9.456  -2.307
  121   1HB   GLU  16          HB2       GLU  16  -6.662   8.677   0.111
  122   2HB   GLU  16          HB1       GLU  16  -6.673  10.217  -0.731
  123   1HG   GLU  16          HG2       GLU  16  -7.561   9.017  -2.701
  124   2HG   GLU  16          HG1       GLU  16  -7.681   7.587  -1.672
  125    H    GLY  17           H        GLY  17  -5.174   8.404   1.050
  126   1HA   GLY  17          HA2       GLY  17  -2.515   9.609   1.453
  127   2HA   GLY  17          HA1       GLY  17  -3.897  10.235   2.352
  128    H    GLY  18           H        GLY  18  -4.057   6.992   1.722
  129   1HA   GLY  18          HA2       GLY  18  -2.835   6.358   4.306
  130   2HA   GLY  18          HA1       GLY  18  -4.448   5.762   3.933
  131    H    TYR  19           H        TYR  19  -3.732   3.601   4.166
  132    HA   TYR  19           HA       TYR  19  -1.792   2.734   2.153
  133   1HB   TYR  19          HB2       TYR  19  -2.715   1.255   4.613
  134   2HB   TYR  19          HB1       TYR  19  -1.325   0.884   3.594
  135    HD1  TYR  19           HD1      TYR  19  -2.203   2.178   6.660
  136    HD2  TYR  19           HD2      TYR  19   0.310   3.070   3.348
  137    HE1  TYR  19           HE1      TYR  19  -0.878   3.609   8.081
  138    HE2  TYR  19           HE2      TYR  19   1.684   4.521   4.779
  139    HH   TYR  19           HH       TYR  19   1.422   4.573   8.164
  140    H    GLU  20           H        GLU  20  -2.650   2.086   0.446
  141    HA   GLU  20           HA       GLU  20  -5.250   0.818   0.350
  142   1HB   GLU  20          HB2       GLU  20  -4.707   2.407  -1.415
  143   2HB   GLU  20          HB1       GLU  20  -3.205   1.565  -1.762
  144   1HG   GLU  20          HG2       GLU  20  -4.663  -0.447  -2.324
  145   2HG   GLU  20          HG1       GLU  20  -6.011   0.674  -2.306
  146    H    CYS  21           H        CYS  21  -5.320  -1.279   0.604
  147    HA   CYS  21           HA       CYS  21  -3.147  -3.099   0.683
  148   1HB   CYS  21          HB2       CYS  21  -6.020  -3.573   0.011
  149   2HB   CYS  21          HB1       CYS  21  -4.867  -4.878   0.273
  150    H    LYS  22           H        LYS  22  -2.221  -4.368  -0.904
  151    HA   LYS  22           HA       LYS  22  -2.739  -3.903  -3.664
  152   1HB   LYS  22          HB2       LYS  22  -0.500  -4.527  -2.957
  153   2HB   LYS  22          HB1       LYS  22  -1.089  -5.981  -2.184
  154   1HG   LYS  22          HG2       LYS  22  -1.436  -5.674  -5.135
  155   2HG   LYS  22          HG1       LYS  22   0.155  -6.078  -4.495
  156   1HD   LYS  22          HD2       LYS  22  -0.589  -8.129  -3.646
  157   2HD   LYS  22          HD1       LYS  22  -2.277  -7.625  -3.673
  158   1HE   LYS  22          HE2       LYS  22  -1.850  -9.230  -5.426
  159   2HE   LYS  22          HE1       LYS  22  -2.253  -7.661  -6.103
  160   1HZ   LYS  22          HZ1       LYS  22  -0.523  -8.588  -7.317
  161   2HZ   LYS  22          HZ2       LYS  22   0.465  -8.888  -5.980
  162   3HZ   LYS  22          HZ3       LYS  22   0.150  -7.300  -6.484
  163    H    TYR  23           H        TYR  23  -4.138  -5.843  -1.271
  164    HA   TYR  23           HA       TYR  23  -4.909  -7.974  -3.106
  165   1HB   TYR  23          HB2       TYR  23  -5.624  -8.294  -0.291
  166   2HB   TYR  23          HB1       TYR  23  -4.743  -9.376  -1.367
  167    HD1  TYR  23           HD1      TYR  23  -4.492  -6.934   1.269
  168    HD2  TYR  23           HD2      TYR  23  -2.264  -9.015  -1.684
  169    HE1  TYR  23           HE1      TYR  23  -2.426  -6.354   2.443
  170    HE2  TYR  23           HE2      TYR  23  -0.188  -8.444  -0.508
  171    HH   TYR  23           HH       TYR  23  -0.120  -7.262   2.641
  172    H    CYS  24           H        CYS  24  -6.129  -5.156  -2.049
  173    HA   CYS  24           HA       CYS  24  -8.759  -5.717  -2.880
  174   1HB   CYS  24          HB2       CYS  24  -9.951  -5.418  -0.760
  175   2HB   CYS  24          HB1       CYS  24  -8.786  -6.737  -0.628
  176    H    THR  25           H        THR  25  -9.811  -3.699  -3.292
  177    HA   THR  25           HA       THR  25  -7.960  -1.513  -2.943
  178    HB   THR  25           HB       THR  25 -10.554  -1.498  -4.515
  179    HG1  THR  25           HG1      THR  25  -8.352  -2.804  -4.975
  180   1HG2  THR  25          HG21      THR  25  -9.706   0.735  -3.883
  181   2HG2  THR  25          HG22      THR  25  -9.526   0.467  -5.615
  182   3HG2  THR  25          HG23      THR  25  -8.128   0.325  -4.548
  183    H    PHE  26           H        PHE  26  -8.207  -1.433  -0.747
  184    HA   PHE  26           HA       PHE  26 -10.339   0.333   0.123
  185   1HB   PHE  26          HB2       PHE  26  -9.491  -2.169   1.636
  186   2HB   PHE  26          HB1       PHE  26 -10.486  -0.889   2.311
  187    HD1  PHE  26           HD1      PHE  26 -10.482  -3.986   0.664
  188    HD2  PHE  26           HD2      PHE  26 -12.684  -0.380   1.037
  189    HE1  PHE  26           HE1      PHE  26 -12.486  -5.130  -0.178
  190    HE2  PHE  26           HE2      PHE  26 -14.692  -1.511   0.203
  191    HZ   PHE  26           HZ       PHE  26 -14.591  -3.902  -0.402
  192    H    GLN  27           H        GLN  27  -9.551   1.824   1.581
  193    HA   GLN  27           HA       GLN  27  -6.716   1.530   2.119
  194   1HB   GLN  27          HB2       GLN  27  -6.770   2.978   0.317
  195   2HB   GLN  27          HB1       GLN  27  -8.148   3.886   0.961
  196   1HG   GLN  27          HG2       GLN  27  -6.776   4.867   2.627
  197   2HG   GLN  27          HG1       GLN  27  -5.470   3.739   2.245
  198   1HE2  GLN  27          HE21      GLN  27  -4.319   4.057   0.644
  199   2HE2  GLN  27          HE22      GLN  27  -4.187   5.459  -0.350
  200    H    THR  28           H        THR  28  -6.040   2.074   4.047
  201    HA   THR  28           HA       THR  28  -7.620   3.891   5.618
  202    HB   THR  28           HB       THR  28  -8.246   1.643   6.500
  203    HG1  THR  28           HG1      THR  28  -8.293   2.666   8.315
  204   1HG2  THR  28          HG21      THR  28  -6.141   0.439   5.927
  205   2HG2  THR  28          HG22      THR  28  -6.604   0.237   7.622
  206   3HG2  THR  28          HG23      THR  28  -5.325   1.353   7.204
  207    HA   PRO  29           HA       PRO  29  -3.461   5.558   5.950
  208   1HB   PRO  29          HB2       PRO  29  -4.138   7.697   7.499
  209   2HB   PRO  29          HB1       PRO  29  -4.378   7.648   5.746
  210   1HG   PRO  29          HG2       PRO  29  -6.333   7.154   7.945
  211   2HG   PRO  29          HG1       PRO  29  -6.548   8.061   6.430
  212   1HD   PRO  29          HD2       PRO  29  -7.471   5.532   6.757
  213   2HD   PRO  29          HD1       PRO  29  -6.876   6.115   5.184
  214    H    ASP  30           H        ASP  30  -5.251   4.037   8.243
  215    HA   ASP  30           HA       ASP  30  -3.475   4.622  10.490
  216   1HB   ASP  30          HB2       ASP  30  -6.150   3.931  10.397
  217   2HB   ASP  30          HB1       ASP  30  -5.343   2.424  10.519
  218    H    LEU  31           H        LEU  31  -1.627   3.460  10.528
  219    HA   LEU  31           HA       LEU  31  -1.179   1.214   8.997
  220   1HB   LEU  31          HB2       LEU  31   0.383   2.844  10.315
  221   2HB   LEU  31          HB1       LEU  31   0.259   1.645  11.580
  222    HG   LEU  31           HG       LEU  31   2.292   1.207  10.398
  223   1HD1  LEU  31          HD11      LEU  31   1.091  -0.827  10.927
  224   2HD1  LEU  31          HD12      LEU  31   1.952  -1.014   9.386
  225   3HD1  LEU  31          HD13      LEU  31   0.211  -0.679   9.413
  226   1HD2  LEU  31          HD21      LEU  31   2.382   0.890   7.985
  227   2HD2  LEU  31          HD22      LEU  31   1.788   2.502   8.448
  228   3HD2  LEU  31          HD23      LEU  31   0.652   1.272   7.911
  229    H    ASN  32           H        ASN  32  -2.352   1.559  12.399
  230    HA   ASN  32           HA       ASN  32  -2.057  -1.114  13.121
  231   1HB   ASN  32          HB2       ASN  32  -2.587   0.833  14.680
  232   2HB   ASN  32          HB1       ASN  32  -4.205   0.749  13.931
  233   1HD2  ASN  32          HD21      ASN  32  -5.615  -0.849  14.472
  234   2HD2  ASN  32          HD22      ASN  32  -5.260  -1.989  15.707
  235    H    MET  33           H        MET  33  -4.681   0.758  11.736
  236    HA   MET  33           HA       MET  33  -6.489  -1.454  11.705
  237   1HB   MET  33          HB2       MET  33  -6.674   1.004   9.953
  238   2HB   MET  33          HB1       MET  33  -7.950  -0.139  10.310
  239   1HG   MET  33          HG2       MET  33  -6.614   1.683  12.247
  240   2HG   MET  33          HG1       MET  33  -8.219   1.926  11.558
  241   1HE   MET  33          HE1       MET  33  -7.806   2.114  14.643
  242   2HE   MET  33          HE2       MET  33  -9.125   1.114  15.256
  243   3HE   MET  33          HE3       MET  33  -9.397   2.185  13.882
  244    H    PHE  34           H        PHE  34  -4.264  -0.032   9.414
  245    HA   PHE  34           HA       PHE  34  -4.968  -1.638   7.231
  246   1HB   PHE  34          HB2       PHE  34  -3.518   0.237   6.842
  247   2HB   PHE  34          HB1       PHE  34  -2.329  -0.354   7.966
  248    HD1  PHE  34           HD1      PHE  34  -3.925  -1.121   4.630
  249    HD2  PHE  34           HD2      PHE  34  -0.661  -1.832   7.310
  250    HE1  PHE  34           HE1      PHE  34  -2.756  -2.333   2.875
  251    HE2  PHE  34           HE2      PHE  34   0.520  -3.056   5.512
  252    HZ   PHE  34           HZ       PHE  34  -0.543  -3.304   3.297
  253    H    THR  35           H        THR  35  -2.402  -2.158   9.621
  254    HA   THR  35           HA       THR  35  -1.759  -4.666   8.491
  255    HB   THR  35           HB       THR  35  -0.006  -3.421   9.671
  256    HG1  THR  35           HG1      THR  35  -0.283  -5.654  11.314
  257   1HG2  THR  35          HG21      THR  35  -1.597  -3.972  12.176
  258   2HG2  THR  35          HG22      THR  35  -1.308  -2.406  11.399
  259   3HG2  THR  35          HG23      THR  35   0.040  -3.290  12.122
  260    H    PHE  36           H        PHE  36  -3.994  -3.654  10.888
  261    HA   PHE  36           HA       PHE  36  -4.570  -6.200  11.977
  262   1HB   PHE  36          HB2       PHE  36  -5.424  -4.377  13.213
  263   2HB   PHE  36          HB1       PHE  36  -6.134  -3.605  11.825
  264    HD1  PHE  36           HD1      PHE  36  -8.405  -3.908  11.425
  265    HD2  PHE  36           HD2      PHE  36  -6.341  -6.731  13.821
  266    HE1  PHE  36           HE1      PHE  36 -10.549  -5.026  11.933
  267    HE2  PHE  36           HE2      PHE  36  -8.483  -7.858  14.358
  268    HZ   PHE  36           HZ       PHE  36 -10.581  -7.004  13.401
  269    H    HIS  37           H        HIS  37  -6.169  -4.274   9.495
  270    HA   HIS  37           HA       HIS  37  -7.974  -6.176   8.606
  271   1HB   HIS  37          HB2       HIS  37  -8.381  -3.958   8.023
  272   2HB   HIS  37          HB1       HIS  37  -6.745  -3.677   7.490
  273    HD1  HIS  37           HD1      HIS  37 -10.100  -4.906   6.323
  274    HD2  HIS  37           HD2      HIS  37  -6.273  -4.296   4.841
  275    HE1  HIS  37           HE1      HIS  37 -10.329  -4.916   3.816
  276    H    VAL  38           H        VAL  38  -4.624  -5.688   7.828
  277    HA   VAL  38           HA       VAL  38  -4.598  -7.591   5.727
  278    HB   VAL  38           HB       VAL  38  -2.411  -6.332   7.340
  279   1HG1  VAL  38          HG11      VAL  38  -1.658  -8.574   6.600
  280   2HG1  VAL  38          HG12      VAL  38  -0.800  -7.322   5.699
  281   3HG1  VAL  38          HG13      VAL  38  -2.135  -8.193   4.942
  282   1HG2  VAL  38          HG21      VAL  38  -3.270  -6.002   4.478
  283   2HG2  VAL  38          HG22      VAL  38  -1.896  -5.179   5.223
  284   3HG2  VAL  38          HG23      VAL  38  -3.537  -4.867   5.798
  285    H    ASP  39           H        ASP  39  -3.565  -7.753   9.149
  286    HA   ASP  39           HA       ASP  39  -2.733 -10.463   8.823
  287   1HB   ASP  39          HB2       ASP  39  -1.928  -8.876  10.602
  288   2HB   ASP  39          HB1       ASP  39  -3.478  -9.097  11.412
  289    H    SER  40           H        SER  40  -5.710  -8.955   9.431
  290    HA   SER  40           HA       SER  40  -7.019 -11.331  10.410
  291   1HB   SER  40          HB2       SER  40  -7.691  -9.077  11.181
  292   2HB   SER  40          HB1       SER  40  -8.181  -8.672   9.547
  293    HG   SER  40           HG       SER  40  -9.802 -10.224   9.656
  294    H    GLU  41           H        GLU  41  -7.052  -9.398   7.376
  295    HA   GLU  41           HA       GLU  41  -8.897 -11.419   6.296
  296   1HB   GLU  41          HB2       GLU  41  -8.454  -8.607   5.309
  297   2HB   GLU  41          HB1       GLU  41  -9.676  -9.735   4.746
  298   1HG   GLU  41          HG2       GLU  41  -9.456  -8.568   7.484
  299   2HG   GLU  41          HG1       GLU  41 -10.634  -8.091   6.258
  300    H    HIS  42           H        HIS  42  -5.736 -10.188   5.923
  301    HA   HIS  42           HA       HIS  42  -5.402 -11.832   3.498
  302   1HB   HIS  42          HB2       HIS  42  -3.872  -9.247   3.765
  303   2HB   HIS  42          HB1       HIS  42  -4.206 -10.209   2.339
  304    HD1  HIS  42           HD1      HIS  42  -6.901  -9.977   1.537
  305    HD2  HIS  42           HD2      HIS  42  -5.289  -6.993   3.945
  306    HE1  HIS  42           HE1      HIS  42  -8.372  -7.955   1.226
  307    HA   PRO  43           HA       PRO  43  -2.327 -12.170   7.181
  308   1HB   PRO  43          HB2       PRO  43  -2.583 -14.850   7.638
  309   2HB   PRO  43          HB1       PRO  43  -3.633 -13.615   8.362
  310   1HG   PRO  43          HG2       PRO  43  -4.130 -15.255   5.886
  311   2HG   PRO  43          HG1       PRO  43  -5.212 -15.005   7.272
  312   1HD   PRO  43          HD2       PRO  43  -5.517 -13.588   5.065
  313   2HD   PRO  43          HD1       PRO  43  -5.674 -12.828   6.661
  314    H    ASN  44           H        ASN  44  -2.779 -14.289   4.433
  315    HA   ASN  44           HA       ASN  44   0.117 -14.417   3.994
  316   1HB   ASN  44          HB2       ASN  44  -0.355 -16.558   4.991
  317   2HB   ASN  44          HB1       ASN  44  -1.800 -16.743   4.004
  318   1HD2  ASN  44          HD21      ASN  44   1.681 -16.798   3.971
  319   2HD2  ASN  44          HD22      ASN  44   1.851 -17.721   2.531
  320    H    VAL  45           H        VAL  45   0.436 -13.516   2.104
  321    HA   VAL  45           HA       VAL  45  -1.613 -13.953   0.079
  322    HB   VAL  45           HB       VAL  45  -0.985 -11.644  -0.810
  323   1HG1  VAL  45          HG11      VAL  45  -2.579 -10.568   0.703
  324   2HG1  VAL  45          HG12      VAL  45  -2.409 -11.932   1.824
  325   3HG1  VAL  45          HG13      VAL  45  -3.098 -12.186   0.216
  326   1HG2  VAL  45          HG21      VAL  45  -0.199 -10.046   0.904
  327   2HG2  VAL  45          HG22      VAL  45   1.016 -11.273   0.539
  328   3HG2  VAL  45          HG23      VAL  45   0.059 -11.392   2.016
  329    H    VAL  46           H        VAL  46  -0.942 -14.963  -1.587
  330    HA   VAL  46           HA       VAL  46   1.745 -14.375  -2.451
  331    HB   VAL  46           HB       VAL  46   0.373 -17.083  -2.754
  332   1HG1  VAL  46          HG11      VAL  46   3.150 -16.231  -3.552
  333   2HG1  VAL  46          HG12      VAL  46   1.819 -16.614  -4.642
  334   3HG1  VAL  46          HG13      VAL  46   2.524 -17.878  -3.631
  335   1HG2  VAL  46          HG21      VAL  46   1.107 -16.709  -0.450
  336   2HG2  VAL  46          HG22      VAL  46   2.728 -16.309  -1.021
  337   3HG2  VAL  46          HG23      VAL  46   2.100 -17.943  -1.225
  338    H    LEU  47           H        LEU  47   1.046 -12.814  -3.867
  339    HA   LEU  47           HA       LEU  47  -0.668 -13.710  -6.077
  340   1HB   LEU  47          HB2       LEU  47  -0.600 -11.038  -4.677
  341   2HB   LEU  47          HB1       LEU  47  -1.296 -11.238  -6.260
  342    HG   LEU  47           HG       LEU  47  -3.089 -11.178  -4.777
  343   1HD1  LEU  47          HD11      LEU  47  -3.383 -12.843  -6.443
  344   2HD1  LEU  47          HD12      LEU  47  -4.177 -13.325  -4.945
  345   3HD1  LEU  47          HD13      LEU  47  -2.648 -14.068  -5.408
  346   1HD2  LEU  47          HD21      LEU  47  -1.959 -11.515  -2.676
  347   2HD2  LEU  47          HD22      LEU  47  -1.694 -13.218  -3.049
  348   3HD2  LEU  47          HD23      LEU  47  -3.334 -12.613  -2.789
  349    H    ASN  48           H        ASN  48  -0.354 -11.421  -7.714
  350    HA   ASN  48           HA       ASN  48   2.130 -12.023  -8.971
  351   1HB   ASN  48          HB2       ASN  48   0.235  -9.730  -9.590
  352   2HB   ASN  48          HB1       ASN  48   1.513 -10.327 -10.637
  353   1HD2  ASN  48          HD21      ASN  48   1.244 -12.418 -11.626
  354   2HD2  ASN  48          HD22      ASN  48  -0.330 -13.081 -11.775
  355    H    SER  49           H        SER  49   3.012  -9.436  -9.919
  356    HA   SER  49           HA       SER  49   4.609  -8.879  -7.589
  357   1HB   SER  49          HB2       SER  49   6.033  -7.674  -9.290
  358   2HB   SER  49          HB1       SER  49   5.837  -9.406  -9.569
  359    HG   SER  49           HG       SER  49   5.030  -8.945 -11.405
  360    H    SER  50           H        SER  50   4.874  -6.859  -6.704
  361    HA   SER  50           HA       SER  50   3.403  -4.577  -7.471
  362   1HB   SER  50          HB2       SER  50   2.726  -6.278  -5.079
  363   2HB   SER  50          HB1       SER  50   2.130  -4.652  -5.351
  364    HG   SER  50           HG       SER  50   1.640  -6.033  -7.535
  365    H    TYR  51           H        TYR  51   3.734  -3.039  -5.510
  366    HA   TYR  51           HA       TYR  51   6.448  -3.486  -4.519
  367   1HB   TYR  51          HB2       TYR  51   5.026  -1.015  -5.394
  368   2HB   TYR  51          HB1       TYR  51   6.439  -0.963  -4.350
  369    HD1  TYR  51           HD1      TYR  51   6.271  -3.380  -7.125
  370    HD2  TYR  51           HD2      TYR  51   7.576   0.473  -5.902
  371    HE1  TYR  51           HE1      TYR  51   7.659  -3.234  -9.138
  372    HE2  TYR  51           HE2      TYR  51   9.002   0.627  -7.924
  373    HH   TYR  51           HH       TYR  51   8.594  -1.489 -10.505
  374    H    VAL  52           H        VAL  52   6.839  -2.842  -2.438
  375    HA   VAL  52           HA       VAL  52   4.525  -2.091  -0.815
  376    HB   VAL  52           HB       VAL  52   4.943  -4.525  -0.488
  377   1HG1  VAL  52          HG11      VAL  52   7.286  -4.530  -1.016
  378   2HG1  VAL  52          HG12      VAL  52   6.908  -5.344   0.490
  379   3HG1  VAL  52          HG13      VAL  52   7.616  -3.718   0.525
  380   1HG2  VAL  52          HG21      VAL  52   5.225  -4.610   1.920
  381   2HG2  VAL  52          HG22      VAL  52   4.131  -3.315   1.440
  382   3HG2  VAL  52          HG23      VAL  52   5.788  -2.939   1.915
  383    H    CYS  53           H        CYS  53   4.945  -0.579   0.662
  384    HA   CYS  53           HA       CYS  53   7.460   0.810   0.648
  385   1HB   CYS  53          HB2       CYS  53   5.589   2.129   0.779
  386   2HB   CYS  53          HB1       CYS  53   4.731   0.942   1.826
  387    H    VAL  54           H        VAL  54   9.005  -0.480   1.652
  388    HA   VAL  54           HA       VAL  54   8.511  -2.412   3.601
  389    HB   VAL  54           HB       VAL  54  11.081  -1.224   3.978
  390   1HG1  VAL  54          HG11      VAL  54  10.527  -3.492   4.491
  391   2HG1  VAL  54          HG12      VAL  54  11.863  -3.339   3.309
  392   3HG1  VAL  54          HG13      VAL  54  10.229  -3.743   2.752
  393   1HG2  VAL  54          HG21      VAL  54  11.938  -1.751   1.692
  394   2HG2  VAL  54          HG22      VAL  54  10.958  -0.303   1.904
  395   3HG2  VAL  54          HG23      VAL  54  10.242  -1.701   1.161
  396    H    GLU  55           H        GLU  55   8.848   1.000   3.829
  397    HA   GLU  55           HA       GLU  55   9.767   1.068   6.531
  398   1HB   GLU  55          HB2       GLU  55   8.054   3.085   5.267
  399   2HB   GLU  55          HB1       GLU  55   9.333   3.436   6.480
  400   1HG   GLU  55          HG2       GLU  55  10.406   4.163   4.546
  401   2HG   GLU  55          HG1       GLU  55  10.460   2.445   4.076
  402    H    CYS  56           H        CYS  56   6.725   1.124   4.869
  403    HA   CYS  56           HA       CYS  56   5.317   1.297   7.461
  404   1HB   CYS  56          HB2       CYS  56   4.227   1.575   4.692
  405   2HB   CYS  56          HB1       CYS  56   3.435   2.073   6.183
  406    H    ASN  57           H        ASN  57   6.223  -0.881   5.153
  407    HA   ASN  57           HA       ASN  57   5.751  -2.960   4.519
  408   1HB   ASN  57          HB2       ASN  57   4.957  -2.857   7.341
  409   2HB   ASN  57          HB1       ASN  57   4.627  -4.378   6.461
  410   1HD2  ASN  57          HD21      ASN  57   7.005  -4.243   4.827
  411   2HD2  ASN  57          HD22      ASN  57   8.311  -4.559   5.893
  412    H    PHE  58           H        PHE  58   4.226  -1.424   3.292
  413    HA   PHE  58           HA       PHE  58   1.564  -2.633   3.400
  414   1HB   PHE  58          HB2       PHE  58   0.431  -0.668   3.607
  415   2HB   PHE  58          HB1       PHE  58   1.959   0.013   4.125
  416    HD1  PHE  58           HD1      PHE  58   3.145   1.546   2.693
  417    HD2  PHE  58           HD2      PHE  58  -0.433  -0.279   1.379
  418    HE1  PHE  58           HE1      PHE  58   2.993   3.202   0.814
  419    HE2  PHE  58           HE2      PHE  58  -0.616   1.380  -0.464
  420    HZ   PHE  58           HZ       PHE  58   1.100   3.103  -0.738
  421    H    LEU  59           H        LEU  59   0.951  -3.523   1.680
  422    HA   LEU  59           HA       LEU  59   2.541  -3.214  -0.723
  423   1HB   LEU  59          HB2       LEU  59   1.005  -5.335   0.518
  424   2HB   LEU  59          HB1       LEU  59   0.645  -5.152  -1.183
  425    HG   LEU  59           HG       LEU  59   3.383  -5.592  -0.040
  426   1HD1  LEU  59          HD11      LEU  59   1.880  -7.504   0.282
  427   2HD1  LEU  59          HD12      LEU  59   3.114  -7.879  -0.920
  428   3HD1  LEU  59          HD13      LEU  59   1.470  -7.459  -1.430
  429   1HD2  LEU  59          HD21      LEU  59   3.967  -6.082  -2.416
  430   2HD2  LEU  59          HD22      LEU  59   3.452  -4.426  -2.191
  431   3HD2  LEU  59          HD23      LEU  59   2.353  -5.587  -2.905
  432    H    THR  60           H        THR  60   1.720  -2.259  -2.463
  433    HA   THR  60           HA       THR  60  -1.153  -1.853  -2.565
  434    HB   THR  60           HB       THR  60  -0.339   0.305  -2.062
  435    HG1  THR  60           HG1      THR  60  -1.685   0.712  -3.778
  436   1HG2  THR  60          HG21      THR  60   2.040  -0.265  -2.397
  437   2HG2  THR  60          HG22      THR  60   1.648   1.323  -2.984
  438   3HG2  THR  60          HG23      THR  60   1.852  -0.006  -4.131
  439    H    LYS  61           H        LYS  61  -1.950  -1.705  -4.706
  440    HA   LYS  61           HA       LYS  61  -0.551  -3.622  -6.395
  441   1HB   LYS  61          HB2       LYS  61  -2.783  -3.857  -7.503
  442   2HB   LYS  61          HB1       LYS  61  -2.745  -4.319  -5.815
  443   1HG   LYS  61          HG2       LYS  61  -3.697  -2.091  -5.242
  444   2HG   LYS  61          HG1       LYS  61  -3.865  -1.780  -6.969
  445   1HD   LYS  61          HD2       LYS  61  -5.083  -4.122  -5.522
  446   2HD   LYS  61          HD1       LYS  61  -5.953  -2.639  -5.881
  447   1HE   LYS  61          HE2       LYS  61  -4.776  -4.592  -7.872
  448   2HE   LYS  61          HE1       LYS  61  -6.480  -4.331  -7.500
  449   1HZ   LYS  61          HZ1       LYS  61  -6.064  -3.167  -9.474
  450   2HZ   LYS  61          HZ2       LYS  61  -4.629  -2.535  -8.936
  451   3HZ   LYS  61          HZ3       LYS  61  -6.069  -1.944  -8.307
  452    H    ARG  62           H        ARG  62   0.064  -0.743  -6.241
  453    HA   ARG  62           HA       ARG  62   0.143  -0.307  -9.111
  454   1HB   ARG  62          HB2       ARG  62  -0.570   1.979  -8.949
  455   2HB   ARG  62          HB1       ARG  62  -1.801   0.998  -8.175
  456   1HG   ARG  62          HG2       ARG  62  -0.733   1.559  -5.975
  457   2HG   ARG  62          HG1       ARG  62   0.282   2.705  -6.856
  458   1HD   ARG  62          HD2       ARG  62  -1.582   3.902  -5.955
  459   2HD   ARG  62          HD1       ARG  62  -1.798   3.797  -7.693
  460    HE   ARG  62           HE       ARG  62  -3.185   2.125  -5.702
  461   1HH1  ARG  62          HH11      ARG  62  -3.103   3.565  -8.997
  462   2HH1  ARG  62          HH12      ARG  62  -4.699   3.089  -9.317
  463   1HH2  ARG  62          HH21      ARG  62  -5.324   1.615  -6.191
  464   2HH2  ARG  62          HH22      ARG  62  -6.012   2.037  -7.699
  465    H    TYR  63           H        TYR  63   1.859   1.262  -9.601
  466    HA   TYR  63           HA       TYR  63   4.065   0.938  -7.748
  467   1HB   TYR  63          HB2       TYR  63   5.443   1.888  -9.582
  468   2HB   TYR  63          HB1       TYR  63   4.484   0.518 -10.115
  469    HD1  TYR  63           HD1      TYR  63   5.100   4.085 -10.502
  470    HD2  TYR  63           HD2      TYR  63   2.530   0.884 -11.615
  471    HE1  TYR  63           HE1      TYR  63   4.223   5.439 -12.353
  472    HE2  TYR  63           HE2      TYR  63   1.643   2.237 -13.468
  473    HH   TYR  63           HH       TYR  63   1.435   4.692 -14.003
  474    H    ASP  64           H        ASP  64   1.846   3.314  -8.787
  475    HA   ASP  64           HA       ASP  64   3.177   5.718  -8.341
  476   1HB   ASP  64          HB2       ASP  64   0.245   5.179  -7.901
  477   2HB   ASP  64          HB1       ASP  64   0.988   6.747  -8.165
  478    H    ALA  65           H        ALA  65   1.353   3.780  -6.054
  479    HA   ALA  65           HA       ALA  65   1.100   5.773  -4.117
  480   1HB   ALA  65          HB1       ALA  65   1.054   2.796  -3.899
  481   2HB   ALA  65          HB2       ALA  65  -0.330   3.874  -4.071
  482   3HB   ALA  65          HB3       ALA  65   0.612   3.879  -2.582
  483    H    LEU  66           H        LEU  66   3.717   3.719  -4.873
  484    HA   LEU  66           HA       LEU  66   5.133   4.162  -2.389
  485   1HB   LEU  66          HB2       LEU  66   6.190   3.045  -4.957
  486   2HB   LEU  66          HB1       LEU  66   6.978   2.974  -3.392
  487    HG   LEU  66           HG       LEU  66   6.162   0.846  -3.725
  488   1HD1  LEU  66          HD11      LEU  66   4.440   0.497  -2.052
  489   2HD1  LEU  66          HD12      LEU  66   4.074   2.218  -2.084
  490   3HD1  LEU  66          HD13      LEU  66   5.651   1.667  -1.505
  491   1HD2  LEU  66          HD21      LEU  66   3.883   0.316  -4.445
  492   2HD2  LEU  66          HD22      LEU  66   4.754   1.281  -5.643
  493   3HD2  LEU  66          HD23      LEU  66   3.547   2.036  -4.610
  494    H    SER  67           H        SER  67   5.114   5.385  -5.645
  495    HA   SER  67           HA       SER  67   7.568   6.890  -5.500
  496   1HB   SER  67          HB2       SER  67   5.200   6.669  -7.240
  497   2HB   SER  67          HB1       SER  67   6.399   7.910  -7.582
  498    HG   SER  67           HG       SER  67   7.750   5.719  -7.274
  499    H    GLU  68           H        GLU  68   4.175   7.630  -5.357
  500    HA   GLU  68           HA       GLU  68   4.646  10.376  -4.779
  501   1HB   GLU  68          HB2       GLU  68   2.051   9.235  -4.010
  502   2HB   GLU  68          HB1       GLU  68   2.453  10.686  -4.919
  503   1HG   GLU  68          HG2       GLU  68   3.045   9.178  -6.846
  504   2HG   GLU  68          HG1       GLU  68   2.412   7.890  -5.902
  505    H    HIS  69           H        HIS  69   4.544   7.516  -3.020
  506    HA   HIS  69           HA       HIS  69   3.464   8.066  -0.569
  507   1HB   HIS  69          HB2       HIS  69   4.629   5.940  -1.385
  508   2HB   HIS  69          HB1       HIS  69   6.106   6.687  -0.747
  509    HD1  HIS  69           HD1      HIS  69   2.670   5.620   0.479
  510    HD2  HIS  69           HD2      HIS  69   6.555   6.121   1.753
  511    HE1  HIS  69           HE1      HIS  69   2.724   4.768   2.854
  512    H    ASN  70           H        ASN  70   6.947   8.574  -1.228
  513    HA   ASN  70           HA       ASN  70   7.353  10.174   1.131
  514   1HB   ASN  70          HB2       ASN  70   9.561  10.664   0.120
  515   2HB   ASN  70          HB1       ASN  70   9.231   8.952   0.274
  516   1HD2  ASN  70          HD21      ASN  70  11.065  10.022  -1.326
  517   2HD2  ASN  70          HD22      ASN  70  10.642   9.665  -3.013
  518    H    LEU  71           H        LEU  71   6.041  10.913  -1.794
  519    HA   LEU  71           HA       LEU  71   6.715  13.699  -1.783
  520   1HB   LEU  71          HB2       LEU  71   6.328  12.915  -3.930
  521   2HB   LEU  71          HB1       LEU  71   5.036  11.859  -3.420
  522    HG   LEU  71           HG       LEU  71   3.520  13.706  -3.301
  523   1HD1  LEU  71          HD11      LEU  71   4.186  15.959  -4.192
  524   2HD1  LEU  71          HD12      LEU  71   5.847  15.385  -4.351
  525   3HD1  LEU  71          HD13      LEU  71   5.120  15.541  -2.754
  526   1HD2  LEU  71          HD21      LEU  71   3.690  12.508  -5.372
  527   2HD2  LEU  71          HD22      LEU  71   5.011  13.544  -5.910
  528   3HD2  LEU  71          HD23      LEU  71   3.392  14.212  -5.715
  529    H    LYS  72           H        LYS  72   3.845  11.773  -1.044
  530    HA   LYS  72           HA       LYS  72   2.703  14.139   0.244
  531   1HB   LYS  72          HB2       LYS  72   0.567  12.427  -0.075
  532   2HB   LYS  72          HB1       LYS  72   0.923  13.819  -1.115
  533   1HG   LYS  72          HG2       LYS  72   2.349  12.120  -2.422
  534   2HG   LYS  72          HG1       LYS  72   1.507  10.891  -1.523
  535   1HD   LYS  72          HD2       LYS  72   0.225  12.967  -3.287
  536   2HD   LYS  72          HD1       LYS  72   0.494  11.272  -3.690
  537   1HE   LYS  72          HE2       LYS  72  -1.024  10.638  -1.815
  538   2HE   LYS  72          HE1       LYS  72  -1.320  12.340  -1.522
  539   1HZ   LYS  72          HZ1       LYS  72  -2.299  12.540  -3.705
  540   2HZ   LYS  72          HZ2       LYS  72  -3.050  11.262  -2.901
  541   3HZ   LYS  72          HZ3       LYS  72  -1.912  10.960  -4.079
  542    H    TYR  73           H        TYR  73   3.254  10.824   0.699
  543    HA   TYR  73           HA       TYR  73   1.932  10.638   3.279
  544   1HB   TYR  73          HB2       TYR  73   3.619   8.672   1.753
  545   2HB   TYR  73          HB1       TYR  73   2.817   8.295   3.276
  546    HD1  TYR  73           HD1      TYR  73   0.966   6.993   3.016
  547    HD2  TYR  73           HD2      TYR  73   1.829   9.821  -0.043
  548    HE1  TYR  73           HE1      TYR  73  -1.003   6.291   1.762
  549    HE2  TYR  73           HE2      TYR  73  -0.100   9.115  -1.261
  550    HH   TYR  73           HH       TYR  73  -2.474   7.293   0.169
  551    H    HIS  74           H        HIS  74   5.334  10.136   2.145
  552    HA   HIS  74           HA       HIS  74   6.202  10.940   4.869
  553   1HB   HIS  74          HB2       HIS  74   7.617   9.213   2.844
  554   2HB   HIS  74          HB1       HIS  74   8.367   9.730   4.333
  555    HD1  HIS  74           HD1      HIS  74   5.755   8.920   6.181
  556    HD2  HIS  74           HD2      HIS  74   7.692   6.695   3.278
  557    HE1  HIS  74           HE1      HIS  74   5.202   6.526   6.663
  558    HA   PRO  75           HA       PRO  75   7.618  14.170   1.836
  559   1HB   PRO  75          HB2       PRO  75   6.782  16.337   3.191
  560   2HB   PRO  75          HB1       PRO  75   5.683  15.383   2.180
  561   1HG   PRO  75          HG2       PRO  75   6.079  15.252   5.153
  562   2HG   PRO  75          HG1       PRO  75   4.565  15.305   4.225
  563   1HD   PRO  75          HD2       PRO  75   5.609  12.968   5.154
  564   2HD   PRO  75          HD1       PRO  75   4.694  13.096   3.635
  565    H    GLY  76           H        GLY  76   9.406  15.314   1.840
  566   1HA   GLY  76          HA2       GLY  76  10.747  16.674   3.711
  567   2HA   GLY  76          HA1       GLY  76  11.200  15.019   4.088
  568    H    GLU  77           H        GLU  77  11.169  13.992   1.484
  569    HA   GLU  77           HA       GLU  77  12.779  15.478  -0.296
  570   1HB   GLU  77          HB2       GLU  77  14.783  14.050  -0.155
  571   2HB   GLU  77          HB1       GLU  77  14.538  14.945   1.337
  572   1HG   GLU  77          HG2       GLU  77  13.607  12.962   2.394
  573   2HG   GLU  77          HG1       GLU  77  13.795  12.069   0.887
  574    H    GLU  78           H        GLU  78  13.570  13.793  -2.032
  575    HA   GLU  78           HA       GLU  78  11.568  11.669  -2.122
  576   1HB   GLU  78          HB2       GLU  78  11.025  13.618  -3.579
  577   2HB   GLU  78          HB1       GLU  78  12.578  13.310  -4.372
  578   1HG   GLU  78          HG2       GLU  78  11.851  11.232  -5.183
  579   2HG   GLU  78          HG1       GLU  78  10.375  11.281  -4.216
  580    H    ASN  79           H        ASN  79  13.000  10.089  -1.496
  581    HA   ASN  79           HA       ASN  79  14.964   9.217  -3.451
  582   1HB   ASN  79          HB2       ASN  79  15.773   9.822  -0.574
  583   2HB   ASN  79          HB1       ASN  79  16.783   9.005  -1.758
  584   1HD2  ASN  79          HD21      ASN  79  15.373  11.924  -0.776
  585   2HD2  ASN  79          HD22      ASN  79  16.199  13.030  -1.833
  586    H    PHE  80           H        PHE  80  13.697   7.414  -3.676
  587    HA   PHE  80           HA       PHE  80  13.449   5.655  -1.328
  588   1HB   PHE  80          HB2       PHE  80  11.685   6.236  -3.598
  589   2HB   PHE  80          HB1       PHE  80  11.976   4.526  -3.372
  590    HD1  PHE  80           HD1      PHE  80  10.098   7.352  -2.328
  591    HD2  PHE  80           HD2      PHE  80  11.476   3.542  -0.987
  592    HE1  PHE  80           HE1      PHE  80   8.269   7.241  -0.650
  593    HE2  PHE  80           HE2      PHE  80   9.660   3.437   0.569
  594    HZ   PHE  80           HZ       PHE  80   8.046   5.261   0.755
  595    H    LYS  81           H        LYS  81  14.042   3.484  -1.611
  596    HA   LYS  81           HA       LYS  81  15.807   2.964  -3.914
  597   1HB   LYS  81          HB2       LYS  81  17.362   2.061  -2.452
  598   2HB   LYS  81          HB1       LYS  81  16.507   3.130  -1.328
  599   1HG   LYS  81          HG2       LYS  81  15.182   1.371  -0.497
  600   2HG   LYS  81          HG1       LYS  81  15.762   0.268  -1.732
  601   1HD   LYS  81          HD2       LYS  81  18.094   0.729  -0.750
  602   2HD   LYS  81          HD1       LYS  81  17.163   1.337   0.637
  603   1HE   LYS  81          HE2       LYS  81  16.021  -0.767   0.870
  604   2HE   LYS  81          HE1       LYS  81  16.783  -1.366  -0.603
  605   1HZ   LYS  81          HZ1       LYS  81  17.861  -2.245   1.364
  606   2HZ   LYS  81          HZ2       LYS  81  18.203  -0.701   1.923
  607   3HZ   LYS  81          HZ3       LYS  81  18.922  -1.260   0.516
  608    H    LEU  82           H        LEU  82  15.832   0.470  -4.358
  609    HA   LEU  82           HA       LEU  82  13.262  -0.659  -3.609
  610   1HB   LEU  82          HB2       LEU  82  13.030  -1.696  -5.838
  611   2HB   LEU  82          HB1       LEU  82  12.948   0.046  -5.890
  612    HG   LEU  82           HG       LEU  82  15.493  -1.407  -6.554
  613   1HD1  LEU  82          HD11      LEU  82  13.204  -0.693  -8.420
  614   2HD1  LEU  82          HD12      LEU  82  13.700  -2.329  -7.982
  615   3HD1  LEU  82          HD13      LEU  82  14.778  -1.305  -8.928
  616   1HD2  LEU  82          HD21      LEU  82  15.938   0.599  -7.890
  617   2HD2  LEU  82          HD22      LEU  82  15.606   1.035  -6.211
  618   3HD2  LEU  82          HD23      LEU  82  14.369   1.260  -7.442
  619    H    THR  83           H        THR  83  13.277  -2.700  -2.977
  620    HA   THR  83           HA       THR  83  15.593  -4.326  -3.488
  621    HB   THR  83           HB       THR  83  16.173  -3.293  -1.406
  622    HG1  THR  83           HG1      THR  83  15.377  -5.535  -0.115
  623   1HG2  THR  83          HG21      THR  83  14.789  -3.318   0.614
  624   2HG2  THR  83          HG22      THR  83  13.531  -4.179  -0.269
  625   3HG2  THR  83          HG23      THR  83  13.933  -2.519  -0.719
  626    H    MET  84           H        MET  84  14.707  -6.333  -4.177
  627    HA   MET  84           HA       MET  84  11.836  -6.690  -3.543
  628   1HB   MET  84          HB2       MET  84  12.666  -6.839  -5.891
  629   2HB   MET  84          HB1       MET  84  13.662  -8.196  -5.386
  630   1HG   MET  84          HG2       MET  84  11.583  -9.438  -4.832
  631   2HG   MET  84          HG1       MET  84  10.656  -8.099  -5.509
  632   1HE   MET  84          HE1       MET  84  10.228 -11.016  -6.666
  633   2HE   MET  84          HE2       MET  84  10.261 -10.687  -8.397
  634   3HE   MET  84          HE3       MET  84   9.434  -9.577  -7.303
  635    H    VAL  85           H        VAL  85  11.729  -7.577  -1.557
  636    HA   VAL  85           HA       VAL  85  12.586 -10.281  -1.323
  637    HB   VAL  85           HB       VAL  85  13.304  -9.663   1.188
  638   1HG1  VAL  85          HG11      VAL  85  15.127  -9.259  -1.186
  639   2HG1  VAL  85          HG12      VAL  85  14.773 -10.802  -0.405
  640   3HG1  VAL  85          HG13      VAL  85  15.667  -9.552   0.467
  641   1HG2  VAL  85          HG21      VAL  85  14.048  -7.154  -0.339
  642   2HG2  VAL  85          HG22      VAL  85  14.570  -7.548   1.298
  643   3HG2  VAL  85          HG23      VAL  85  12.861  -7.251   0.961
  644    H    LYS  86           H        LYS  86  10.494 -11.167  -0.934
  645    HA   LYS  86           HA       LYS  86   9.279  -9.984   1.435
  646   1HB   LYS  86          HB2       LYS  86   8.155  -9.156  -0.732
  647   2HB   LYS  86          HB1       LYS  86   7.482 -10.795  -0.848
  648   1HG   LYS  86          HG2       LYS  86   5.869  -9.449   0.026
  649   2HG   LYS  86          HG1       LYS  86   6.436 -10.437   1.371
  650   1HD   LYS  86          HD2       LYS  86   7.717  -8.601   2.290
  651   2HD   LYS  86          HD1       LYS  86   7.498  -7.621   0.853
  652   1HE   LYS  86          HE2       LYS  86   5.898  -6.644   2.309
  653   2HE   LYS  86          HE1       LYS  86   4.983  -7.849   1.434
  654   1HZ   LYS  86          HZ1       LYS  86   6.157  -8.240   4.106
  655   2HZ   LYS  86          HZ2       LYS  86   5.280  -9.416   3.318
  656   3HZ   LYS  86          HZ3       LYS  86   4.532  -7.982   3.821
  657    H    ARG  87           H        ARG  87   9.015 -11.493   2.865
  658    HA   ARG  87           HA       ARG  87   9.404 -14.165   1.820
  659   1HB   ARG  87          HB2       ARG  87  10.264 -13.025   4.479
  660   2HB   ARG  87          HB1       ARG  87  10.488 -14.696   3.977
  661   1HG   ARG  87          HG2       ARG  87  12.594 -13.696   3.529
  662   2HG   ARG  87          HG1       ARG  87  11.751 -13.745   1.978
  663   1HD   ARG  87          HD2       ARG  87  12.892 -11.607   2.251
  664   2HD   ARG  87          HD1       ARG  87  11.144 -11.401   2.183
  665    HE   ARG  87           HE       ARG  87  12.156 -11.592   4.850
  666   1HH1  ARG  87          HH11      ARG  87  11.416  -9.189   2.245
  667   2HH1  ARG  87          HH12      ARG  87  11.539  -7.892   3.262
  668   1HH2  ARG  87          HH21      ARG  87  12.280  -9.748   6.205
  669   2HH2  ARG  87          HH22      ARG  87  12.058  -8.177   5.540
  670    H    ASN  88           H        ASN  88   8.251 -15.843   2.430
  671    HA   ASN  88           HA       ASN  88   6.510 -17.066   3.066
  672   1HB   ASN  88          HB2       ASN  88   6.376 -15.154   5.410
  673   2HB   ASN  88          HB1       ASN  88   5.269 -16.506   5.233
  674   1HD2  ASN  88          HD21      ASN  88   6.105 -18.620   5.300
  675   2HD2  ASN  88          HD22      ASN  88   7.624 -18.969   6.026
  676    H    ASN  89           H        ASN  89   6.305 -14.696   1.433
  677    HA   ASN  89           HA       ASN  89   3.441 -14.842   0.998
  678   1HB   ASN  89          HB2       ASN  89   4.975 -12.200   1.113
  679   2HB   ASN  89          HB1       ASN  89   3.348 -12.379   0.486
  680   1HD2  ASN  89          HD21      ASN  89   5.221 -11.708   3.156
  681   2HD2  ASN  89          HD22      ASN  89   3.973 -11.733   4.347
  682    H    GLN  90           H        GLN  90   3.892 -12.737  -1.111
  683    HA   GLN  90           HA       GLN  90   5.262 -14.475  -2.999
  684   1HB   GLN  90          HB2       GLN  90   4.443 -12.975  -4.684
  685   2HB   GLN  90          HB1       GLN  90   3.057 -13.471  -3.675
  686   1HG   GLN  90          HG2       GLN  90   4.554 -10.950  -3.406
  687   2HG   GLN  90          HG1       GLN  90   3.189 -11.100  -4.520
  688   1HE2  GLN  90          HE21      GLN  90   4.220 -10.705  -1.278
  689   2HE2  GLN  90          HE22      GLN  90   2.623 -10.601  -0.582
  690    H    THR  91           H        THR  91   6.804 -13.338  -4.449
  691    HA   THR  91           HA       THR  91   8.263 -11.479  -2.822
  692    HB   THR  91           HB       THR  91  10.049 -11.827  -4.696
  693    HG1  THR  91           HG1      THR  91   9.140 -13.024  -6.251
  694   1HG2  THR  91          HG21      THR  91   9.327 -14.081  -2.786
  695   2HG2  THR  91          HG22      THR  91  10.295 -12.686  -2.362
  696   3HG2  THR  91          HG23      THR  91  10.903 -13.850  -3.530
  697    H    ILE  92           H        ILE  92   7.902  -9.625  -3.011
  698    HA   ILE  92           HA       ILE  92   7.220  -8.296  -5.449
  699    HB   ILE  92           HB       ILE  92   5.807  -6.756  -3.931
  700   1HG1  ILE  92          HG12      ILE  92   4.626  -8.298  -2.157
  701   2HG1  ILE  92          HG11      ILE  92   6.172  -9.100  -2.215
  702   1HG2  ILE  92          HG21      ILE  92   3.783  -8.079  -4.254
  703   2HG2  ILE  92          HG22      ILE  92   4.784  -9.489  -4.641
  704   3HG2  ILE  92          HG23      ILE  92   4.813  -8.077  -5.673
  705   1HD1  ILE  92          HD11      ILE  92   7.384  -7.157  -1.642
  706   2HD1  ILE  92          HD12      ILE  92   6.060  -7.335  -0.485
  707   3HD1  ILE  92          HD13      ILE  92   5.950  -6.158  -1.776
  708    H    PHE  93           H        PHE  93   7.635  -5.916  -5.294
  709    HA   PHE  93           HA       PHE  93  10.420  -5.814  -4.454
  710   1HB   PHE  93          HB2       PHE  93   8.670  -3.953  -6.048
  711   2HB   PHE  93          HB1       PHE  93  10.370  -3.673  -5.771
  712    HD1  PHE  93           HD1      PHE  93   7.859  -5.604  -7.588
  713    HD2  PHE  93           HD2      PHE  93  12.010  -4.987  -6.932
  714    HE1  PHE  93           HE1      PHE  93   8.354  -6.850  -9.653
  715    HE2  PHE  93           HE2      PHE  93  12.529  -6.242  -9.006
  716    HZ   PHE  93           HZ       PHE  93  10.691  -7.171 -10.363
  717    H    GLU  94           H        GLU  94  10.928  -4.816  -2.554
  718    HA   GLU  94           HA       GLU  94   8.899  -3.226  -1.281
  719   1HB   GLU  94          HB2       GLU  94  11.569  -4.187  -0.186
  720   2HB   GLU  94          HB1       GLU  94  10.240  -3.490   0.718
  721   1HG   GLU  94          HG2       GLU  94   8.903  -5.486  -0.043
  722   2HG   GLU  94          HG1       GLU  94  10.437  -6.252  -0.438
  723    H    GLN  95           H        GLN  95   9.303  -1.115  -0.860
  724    HA   GLN  95           HA       GLN  95  11.693   0.008  -2.138
  725   1HB   GLN  95          HB2       GLN  95   9.364   0.277  -3.288
  726   2HB   GLN  95          HB1       GLN  95   9.044   1.429  -1.997
  727   1HG   GLN  95          HG2       GLN  95  10.913   2.764  -2.659
  728   2HG   GLN  95          HG1       GLN  95  11.395   1.556  -3.841
  729   1HE2  GLN  95          HE21      GLN  95   9.201   4.103  -3.066
  730   2HE2  GLN  95          HE22      GLN  95   8.610   4.333  -4.666
  731    H    THR  96           H        THR  96  12.975   0.848  -0.604
  732    HA   THR  96           HA       THR  96  11.750   1.816   1.914
  733    HB   THR  96           HB       THR  96  14.610   1.420   1.992
  734    HG1  THR  96           HG1      THR  96  13.755  -1.097   1.968
  735   1HG2  THR  96          HG21      THR  96  12.315   0.114   3.463
  736   2HG2  THR  96          HG22      THR  96  13.133   1.579   3.974
  737   3HG2  THR  96          HG23      THR  96  14.002   0.036   3.958
  738    H    ILE  97           H        ILE  97  12.562   3.705   2.831
  739    HA   ILE  97           HA       ILE  97  13.961   5.530   0.982
  740    HB   ILE  97           HB       ILE  97  12.766   6.315   3.659
  741   1HG1  ILE  97          HG12      ILE  97  11.308   6.504   1.068
  742   2HG1  ILE  97          HG11      ILE  97  11.204   5.027   2.010
  743   1HG2  ILE  97          HG21      ILE  97  13.086   7.816   1.034
  744   2HG2  ILE  97          HG22      ILE  97  14.292   7.822   2.296
  745   3HG2  ILE  97          HG23      ILE  97  12.707   8.499   2.624
  746   1HD1  ILE  97          HD11      ILE  97   9.352   6.221   2.492
  747   2HD1  ILE  97          HD12      ILE  97  10.146   7.762   2.617
  748   3HD1  ILE  97          HD13      ILE  97  10.365   6.513   3.895
  749    H    ASN  98           H        ASN  98  15.713   6.711   1.796
  750    HA   ASN  98           HA       ASN  98  17.216   5.224   3.781
  751   1HB   ASN  98          HB2       ASN  98  19.148   6.578   2.756
  752   2HB   ASN  98          HB1       ASN  98  18.448   5.292   1.772
  753   1HD2  ASN  98          HD21      ASN  98  17.186   8.595   2.332
  754   2HD2  ASN  98          HD22      ASN  98  17.269   9.074   0.688
  755    H    ASP  99           H        ASP  99  15.091   7.400   4.196
  756    HA   ASP  99           HA       ASP  99  16.537   8.778   6.266
  757   1HB   ASP  99          HB2       ASP  99  16.916   9.942   4.001
  758   2HB   ASP  99          HB1       ASP  99  15.290  10.543   4.232
  759    H    LEU 100           H        LEU 100  13.632   9.132   4.212
  760    HA   LEU 100           HA       LEU 100  11.914  10.104   6.327
  761   1HB   LEU 100          HB2       LEU 100  11.091   8.969   3.670
  762   2HB   LEU 100          HB1       LEU 100  10.249  10.100   4.689
  763    HG   LEU 100           HG       LEU 100  12.849  11.007   3.613
  764   1HD1  LEU 100          HD11      LEU 100  11.667  11.628   1.512
  765   2HD1  LEU 100          HD12      LEU 100  10.317  10.598   2.033
  766   3HD1  LEU 100          HD13      LEU 100  11.894   9.896   1.706
  767   1HD2  LEU 100          HD21      LEU 100  10.124  12.252   3.804
  768   2HD2  LEU 100          HD22      LEU 100  11.632  13.056   3.432
  769   3HD2  LEU 100          HD23      LEU 100  11.367  12.394   5.063
  770    H    THR 101           H        THR 101  13.181   7.368   6.422
  771    HA   THR 101           HA       THR 101  11.626   5.192   5.878
  772    HB   THR 101           HB       THR 101  13.429   5.411   8.255
  773    HG1  THR 101           HG1      THR 101  15.074   5.067   6.459
  774   1HG2  THR 101          HG21      THR 101  12.399   3.204   7.671
  775   2HG2  THR 101          HG22      THR 101  14.150   3.188   7.480
  776   3HG2  THR 101          HG23      THR 101  13.110   3.323   6.063
  777    H    PHE 102           H        PHE 102  11.193   7.465   8.415
  778    HA   PHE 102           HA       PHE 102   9.780   5.853  10.284
  779   1HB   PHE 102          HB2       PHE 102   9.008   8.017  11.241
  780   2HB   PHE 102          HB1       PHE 102  10.752   7.923  11.043
  781    HD1  PHE 102           HD1      PHE 102   7.663   9.543   9.910
  782    HD2  PHE 102           HD2      PHE 102  11.886   9.335   9.418
  783    HE1  PHE 102           HE1      PHE 102   7.620  11.671   8.679
  784    HE2  PHE 102           HE2      PHE 102  11.850  11.469   8.185
  785    HZ   PHE 102           HZ       PHE 102   9.715  12.637   7.813