*HEADER   CYTOKINE (CHEMOTACTIC)                  18-AUG-95   1HRJ    
*TITLE    HUMAN RANTES, NMR, 13 STRUCTURES                            
*COMPND   MOL_ID: 1;                                                  
*COMPND  2 MOLECULE: HUMAN REGULATED UPON ACTIVATION NORMAL T-CELL    
*COMPND  3 EXPRESSED AND SECRETED;                                    
*COMPND  4 CHAIN: A, B;                                               
*COMPND  5 SYNONYM: HUMAN RANTES;                                     
*COMPND  6 ENGINEERED: YES;                                           
*COMPND  7 OTHER_DETAILS: PH 3.2, 313 K                               
*SOURCE   MOL_ID: 1;                                                  
*SOURCE  2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                         
*SOURCE  3 ORGANISM_COMMON: HUMAN                                     
*SOURCE  4 EXPRESSION_SYSTEM: ESCHERICHIA COLI                        
*KEYWDS   CC CHEMOKINE, CYTOKINE (CHEMOTACTIC)                        
*EXPDTA   NMR, 13 STRUCTURES                                          
*AUTHOR   C.CHUNG,R.M.COOKE,A.E.I.PROUDFOOT,T.N.C.WELLS               
*REVDAT  1   14-OCT-96 1HRJ    0                                      


remarks restraints in XPLOR format
remarks all noes
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assign (resid   122 and  name H    )(resid   122 and  name HA   ) 4.0 4.0 0.0
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assign (resid   162 and  name HE*  )(resid   122 and  name HA   ) 7.0 7.0 0.0
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assign (resid   130 and  name H    )(resid   130 and  name 2HB  ) 4.0 4.0 0.0
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assign (resid   126 and  name H    )(resid   125 and  name HA   ) 4.0 4.0 0.0
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assign (resid   142 and  name HZ   )(resid   142 and  name 1HB  ) 6.7 6.7 0.0
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assign (resid   135 and  name H    )(resid   135 and  name 1HB  ) 5.8 5.8 0.0
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assign (resid   129 and  name H    )(resid   128 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   129 and  name H    )(resid   128 and  name 1HB  ) 4.0 4.0 0.0
assign (resid   162 and  name H    )(resid   162 and  name 2HB  ) 4.0 4.0 0.0
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assign (resid   130 and  name H    )(resid   129 and  name HA   ) 4.0 4.0 0.0
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assign (resid   152 and  name H    )(resid   139 and  name *HB  ) 6.0 6.0 0.0
assign (resid   158 and  name HE1  )(resid   158 and  name 1HB  ) 5.0 5.0 0.0
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assign (resid   152 and  name H    )(resid   151 and  name 2HB  ) 5.0 5.0 0.0
assign (resid   152 and  name H    )(resid   141 and  name *HG2 ) 6.0 6.0 0.0
assign (resid   126 and  name H    )(resid   125 and  name 2HG1 ) 5.0 5.0 0.0
assign (resid   163 and  name H    )(resid   163 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   128 and  name H    )(resid   166 and  name *HD1 ) 6.0 6.0 0.0
assign (resid   163 and  name H    )(resid   166 and  name *HD1 ) 6.0 6.0 0.0
assign (resid   126 and  name H    )(resid   125 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   126 and  name H    )(resid   143 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   126 and  name H    )(resid   125 and  name 1HG1 ) 5.0 5.0 0.0
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assign (resid   152 and  name H    )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   141 and  name H    )(resid   141 and  name HB   ) 4.0 4.0 0.0
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assign (resid   140 and  name H    )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   162 and  name HD*  )(resid   159 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   142 and  name HE*  )(resid   159 and  name *HG1 ) 7.0 7.0 0.0
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assign (resid   158 and  name HZ3  )(resid   159 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   128 and  name HD*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   142 and  name HE*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   129 and  name HE*  )(resid   141 and  name HB   ) 7.0 7.0 0.0
assign (resid   129 and  name HD*  )(resid   141 and  name HB   ) 7.0 7.0 0.0
assign (resid   130 and  name HD*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   142 and  name HD*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   130 and  name HE*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   128 and  name HE*  )(resid   140 and  name *HG1 ) 8.0 8.0 0.0
assign (resid   159 and  name H    )(resid   159 and  name *HG1 ) 5.0 5.0 0.0
assign (resid   159 and  name HA   )(resid   159 and  name *HG1 ) 5.0 5.0 0.0
assign (resid   128 and  name 2HB  )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   128 and  name 1HB  )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   140 and  name HA   )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   119 and  name 1HD  )(resid   119 and  name 2HG  ) 6.9 6.9 0.0
assign (resid   142 and  name 2HB  )(resid   125 and  name *HD1 ) 6.0 6.0 0.0
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assign (resid   159 and  name HB   )(resid   159 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   156 and  name 1HB  )(resid   159 and  name *HG1 ) 7.8 7.8 0.0
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assign (resid   140 and  name *HG2 )(resid   140 and  name *HG1 ) 6.0 6.0 0.0
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assign (resid   152 and  name *HB  )(resid   140 and  name *HG1 ) 7.0 7.0 0.0
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assign (resid   125 and  name HB   )(resid   125 and  name *HD1 ) 5.0 5.0 0.0
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assign (resid   220 and  name *HD1 )(resid   220 and  name HG   ) 4.0 4.0 0.0
assign (resid   244 and  name *HG2 )(resid   245 and  name *HG  ) 5.0 5.0 0.0
assign (resid   259 and  name *HG2 )(resid   256 and  name 1HB  ) 5.8 5.8 0.0
assign (resid   224 and  name HA   )(resid   223 and  name *HB  ) 6.0 6.0 0.0
assign (resid   213 and  name 1HB  )(resid   134 and  name 2HD  ) 7.5 7.5 0.0
assign (resid   220 and  name *HD1 )(resid   244 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   208 and  name HA   )(resid   208 and  name *HG2 ) 4.0 4.0 0.0
assign (resid   253 and  name HA   )(resid   252 and  name *HB  ) 6.0 6.0 0.0
assign (resid   210 and  name 1HD  )(resid   234 and  name 1HD  ) 8.6 8.6 0.0
assign (resid   249 and  name HA   )(resid   243 and  name *HG1 ) 5.0 5.0 0.0
assign (resid   211 and  name HA   )(resid   231 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   225 and  name 2HG1 )(resid   225 and  name *HG2 ) 4.0 4.0 0.0
assign (resid   242 and  name 1HB  )(resid   250 and  name *HG1 ) 5.7 5.7 0.0
assign (resid   244 and  name *HG2 )(resid   250 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   262 and  name 1HB  )(resid   266 and  name *HD1 ) 7.8 7.8 0.0
assign (resid   242 and  name 2HB  )(resid   225 and  name 2HG1 ) 8.5 8.5 0.0
assign (resid   218 and  name HA   )(resid   219 and  name 2HG  ) 5.9 5.9 0.0
assign (resid   216 and  name 2HG1 )(resid   216 and  name *HG2 ) 5.7 5.7 0.0
assign (resid   220 and  name *HD1 )(resid   225 and  name *HD1 ) 7.0 7.0 0.0
assign (resid   266 and  name *HD2 )(resid   225 and  name *HD1 ) 6.0 6.0 0.0
assign (resid   242 and  name HA   )(resid   241 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   258 and  name HD1  )(resid   219 and  name HA   ) 5.0 5.0 0.0
assign (resid   243 and  name H    )(resid   227 and  name 1HB  ) 6.7 6.7 0.0
assign (resid   251 and  name HA   )(resid   212 and  name 1HB  ) 4.0 4.0 0.0
assign (resid   244 and  name HB   )(resid   224 and  name 1HB  ) 4.0 4.0 0.0
assign (resid   240 and  name HA   )(resid   230 and  name 1HB  ) 5.8 5.8 0.0
assign (resid   241 and  name *HG2 )(resid   242 and  name HA   ) 6.0 6.0 0.0
assign (resid   266 and  name *HD1 )(resid   227 and  name HA   ) 6.0 6.0 0.0
assign (resid   241 and  name HB   )(resid   241 and  name *HG1 ) 4.0 4.0 0.0
assign (resid   248 and  name 1HB  )(resid   248 and  name 2HB  ) 4.8 4.8 0.0
assign (resid   225 and  name *HD1 )(resid   220 and  name HG   ) 4.0 4.0 0.0
assign (resid   225 and  name *HD1 )(resid   220 and  name 2HB  ) 5.8 5.8 0.0
assign (resid   220 and  name *HD2 )(resid   225 and  name *HD1 ) 7.0 7.0 0.0
assign (resid   263 and  name HA   )(resid   263 and  name 2HG1 ) 4.0 4.0 0.0
assign (resid   266 and  name HA   )(resid   266 and  name 1HB  ) 5.8 5.8 0.0
assign (resid   251 and  name HA   )(resid   241 and  name *HG1 ) 5.0 5.0 0.0
assign (resid   247 and  name HA   )(resid   243 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   224 and  name HA   )(resid   224 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   235 and  name HA   )(resid   113 and  name HD*  ) 6.0 6.0 0.0
assign (resid   229 and  name HE*  )(resid   210 and  name 2HD  ) 7.0 7.0 0.0
assign (resid   229 and  name HE*  )(resid   210 and  name 1HD  ) 7.0 7.0 0.0
assign (resid   242 and  name HE*  )(resid   262 and  name HA   ) 7.0 7.0 0.0
assign (resid   215 and  name HD*  )(resid   237 and  name HA   ) 7.0 7.0 0.0
assign (resid   229 and  name HD*  )(resid   210 and  name 2HG  ) 8.8 8.8 0.0
assign (resid   258 and  name HZ3  )(resid   252 and  name *HB  ) 5.0 5.0 0.0
assign (resid   258 and  name HZ3  )(resid   219 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   263 and  name HB   )(resid   263 and  name 2HG1 ) 4.0 4.0 0.0
assign (resid   229 and  name HE*  )(resid   230 and  name HA   ) 7.0 7.0 0.0
assign (resid   228 and  name HA   )(resid   241 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   228 and  name HA   )(resid   240 and  name *HG2 ) 6.0 6.0 0.0
assign (resid   258 and  name HZ3  )(resid   258 and  name HA   ) 5.0 5.0 0.7
assign (resid   215 and  name HA   )(resid   214 and  name HA   ) 4.0 4.0 0.0
assign (resid   258 and  name HD1  )(resid   256 and  name HA   ) 5.0 5.0 0.0
assign (resid   262 and  name HD*  )(resid   222 and  name HA   ) 7.0 7.0 0.0
assign (resid   262 and  name HE*  )(resid   262 and  name 2HB  ) 7.0 7.0 0.0
assign (resid   230 and  name 2HB  )(resid   230 and  name HE*  ) 7.0 7.0 0.0
assign (resid   241 and  name HA   )(resid   242 and  name HD*  ) 7.0 7.0 0.0
assign (resid   227 and  name HA   )(resid   242 and  name HD*  ) 7.0 7.0 0.0
assign (resid   258 and  name HE3  )(resid   242 and  name HZ   ) 4.0 4.0 0.0
assign (resid   258 and  name HE3  )(resid   262 and  name HE*  ) 6.0 6.0 0.0
assign (resid   228 and  name HA   )(resid   242 and  name HE*  ) 7.0 7.0 0.0
assign (resid   262 and  name HD*  )(resid   258 and  name HE3  ) 7.0 7.0 0.0
assign (resid   258 and  name HD1  )(resid   258 and  name HE3  ) 5.0 5.0 0.0
assign (resid   258 and  name HE3  )(resid   219 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   258 and  name HE3  )(resid   252 and  name *HB  ) 6.0 6.0 0.0
assign (resid   228 and  name HA   )(resid   243 and  name *HG1 ) 6.0 6.0 0.0
assign (resid   242 and  name HA   )(resid   220 and  name *HD1 ) 6.0 6.0 0.0
assign (resid   215 and  name 2HB  )(resid   253 and  name 2HB  ) 8.5 8.5 0.0
assign (resid   220 and  name *HD1 )(resid   258 and  name HZ3  ) 6.0 6.0 0.0
assign (resid   220 and  name *HD1 )(resid   242 and  name HE*  ) 8.0 8.0 0.0
assign (resid   237 and  name HA   )(resid   238 and  name *HB  ) 6.0 6.0 0.0
assign (resid   241 and  name HB   )(resid   230 and  name HA   ) 5.0 5.0 0.0
assign (resid   253 and  name HA   )(resid   239 and  name *HB  ) 6.0 6.0 0.0
assign (resid   242 and  name HE*  )(resid   225 and  name *HD1 ) 7.0 7.0 0.0
assign (resid   263 and  name *HG2 )(resid   242 and  name HE*  ) 7.0 7.0 0.0
assign (resid   259 and  name *HG2 )(resid   258 and  name HZ2  ) 5.0 5.0 0.0
assign (resid   211 and  name HA   )(resid   209 and  name *HG2 ) 6.0 6.0 0.0
assign (resid   228 and  name HD*  )(resid   240 and  name HA   ) 7.0 7.0 0.0
assign (resid   240 and  name *HG2 )(resid   242 and  name HE*  ) 7.0 7.0 0.0
assign (resid   258 and  name HD1  )(resid   219 and  name 2HB  ) 5.0 5.0 0.0
assign (resid   242 and  name HD*  )(resid   240 and  name *HG2 ) 8.0 8.0 0.0
assign (resid   228 and  name HE*  )(resid   227 and  name HA   ) 7.0 7.0 0.0
assign (resid   266 and  name *HD2 )(resid   242 and  name HD*  ) 8.0 8.0 0.0
assign (resid   220 and  name *HD2 )(resid   242 and  name HD*  ) 8.0 8.0 0.0
assign (resid   263 and  name HB   )(resid   228 and  name HE*  ) 7.0 7.0 0.0
assign (resid   263 and  name HB   )(resid   228 and  name HD*  ) 7.0 7.0 0.0
assign (resid   258 and  name HZ2  )(resid   252 and  name HA   ) 5.0 5.0 0.0
assign (resid   228 and  name HA   )(resid   241 and  name HB   ) 5.0 5.0 0.0
assign (resid   225 and  name *HG2 )(resid   222 and  name HA   ) 6.0 6.0 0.0
assign (resid   222 and  name 1HG  )(resid   222 and  name HA   ) 5.0 5.0 0.0
assign (resid   225 and  name 1HG1 )(resid   222 and  name HA   ) 5.0 5.0 0.0
assign (resid   266 and  name *HD2 )(resid   262 and  name HA   ) 6.0 6.0 0.0
assign (resid   266 and  name *HD1 )(resid   262 and  name HA   ) 6.0 6.0 0.0
assign (resid   215 and  name HE*  )(resid   254 and  name 1HD  ) 8.8 8.8 0.0
assign (resid   266 and  name *HD1 )(resid   225 and  name *HD1 ) 6.0 6.0 0.0
assign (resid   220 and  name *HD2 )(resid   250 and  name HB   ) 5.0 5.0 0.0
assign (resid   220 and  name *HD2 )(resid   244 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   258 and  name HD1  )(resid   219 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   239 and  name *HB  )(resid   254 and  name 1HD  ) 7.8 7.8 0.0
assign (resid   240 and  name *HG1 )(resid   254 and  name 2HB  ) 6.0 6.0 0.0
assign (resid   254 and  name 2HD  )(resid   254 and  name 1HG  ) 4.0 4.0 0.0
assign (resid   235 and  name HA   )(resid   113 and  name 1HB  ) 6.8 6.8 0.0
assign (resid   250 and  name *HG1 )(resid   242 and  name HD*  ) 7.0 7.0 0.0
assign (resid   209 and  name HA   )(resid   210 and  name 2HG  ) 4.0 4.0 0.0
assign (resid   209 and  name HA   )(resid   210 and  name 1HG  ) 4.0 4.0 0.0
assign (resid   210 and  name 2HD  )(resid   209 and  name *HG2 ) 5.0 5.0 0.0
assign (resid   266 and  name *HD2 )(resid   227 and  name 1HB  ) 7.7 7.7 0.0
! extra from rmph45_18h
assign (resid   104 and  name H    )(resid   103 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   134 and  name 2HD  )(resid   213 and  name HD*  ) 7.8 7.8 0.0
assign (resid   134 and  name 2HD  )(resid   213 and  name 1HB  ) 8.5 8.5 0.0
assign (resid   103 and  name HA   )(resid   104 and  name 1HB  ) 5.7 5.7 0.0
assign (resid   104 and  name HD*  )(resid   104 and  name 2HB  ) 6.0 6.0 0.0
assign (resid   104 and  name H    )(resid   103 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   104 and  name H    )(resid   104 and  name 1HB  ) 4.0 4.0 0.0
assign (resid   104 and  name H    )(resid   104 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   104 and  name H    )(resid   104 and  name HA   ) 4.0 4.0 0.0
assign (resid   104 and  name H    )(resid   104 and  name HD*  ) 6.0 6.0 0.0
assign (resid   204 and  name H    )(resid   203 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   234 and  name 2HD  )(resid   113 and  name HD*  ) 7.8 7.8 0.0
assign (resid   234 and  name 2HD  )(resid   113 and  name 1HB  ) 8.5 8.5 0.0
assign (resid   203 and  name HA   )(resid   204 and  name 1HB  ) 5.7 5.7 0.0
assign (resid   204 and  name HD*  )(resid   204 and  name 2HB ) 6.0 6.0 0.0
assign (resid   204 and  name H    )(resid   203 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   204 and  name H    )(resid   204 and  name 1HB  ) 4.0 4.0 0.0
assign (resid   204 and  name H    )(resid   204 and  name 2HB  ) 4.0 4.0 0.0
assign (resid   204 and  name H    )(resid   204 and  name HA   ) 4.0 4.0 0.0
assign (resid   204 and  name H    )(resid   204 and  name HD*  ) 6.0 6.0 0.0
assign (resid   124 and  name HD2  )(resid   123 and  name HA   ) 5.0 5.0 0.0
assign (resid   124 and  name HD2  )(resid   123 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   124 and  name HD2  )(resid   124 and  name 2HB  ) 5.0 5.0 0.0
assign (resid   124 and  name HD2  )(resid   123 and  name *HB  ) 5.0 5.0 0.5
assign (resid   124 and  name HA   )(resid   124 and  name HD2  ) 4.0 4.0 0.0
assign (resid   129 and  name HE*  )(resid   140 and  name HA   ) 7.0 7.0 0.0
assign (resid   224 and  name HD2  )(resid   223 and  name HA   ) 5.0 5.0 0.0
assign (resid   224 and  name HD2  )(resid   223 and  name 1HB  ) 5.0 5.0 0.0
assign (resid   224 and  name HD2  )(resid   224 and  name 2HB  ) 5.0 5.0 0.0
assign (resid   224 and  name HD2  )(resid   223 and  name *HB  ) 5.0 5.0 0.5
assign (resid   224 and  name HA   )(resid   224 and  name HD2  ) 4.0 4.0 0.0
assign (resid   229 and  name HE*  )(resid   240 and  name HA   ) 7.0 7.0 0.0
!
! symmetrical distance constraints
! distance pair 101 269
assign (resid 101 and name ca and segid a)
       (resid 269 and name ca and segid b)  0 0 0
assign (resid 201 and name ca and segid b)
       (resid 169 and name ca and segid a)  0 0 0
! distance pair 102 268
assign (resid 102 and name ca and segid a)
       (resid 268 and name ca and segid b)  0 0 0
assign (resid 202 and name ca and segid b)
       (resid 168 and name ca and segid a)  0 0 0
! distance pair 103 267
assign (resid 103 and name ca and segid a)
       (resid 267 and name ca and segid b)  0 0 0
assign (resid 203 and name ca and segid b)
       (resid 167 and name ca and segid a)  0 0 0
! distance pair 104 266
assign (resid 104 and name ca and segid a)
       (resid 266 and name ca and segid b)  0 0 0
assign (resid 204 and name ca and segid b)
       (resid 166 and name ca and segid a)  0 0 0
! distance pair 105 265
assign (resid 105 and name ca and segid a)
       (resid 265 and name ca and segid b)  0 0 0
assign (resid 205 and name ca and segid b)
       (resid 165 and name ca and segid a)  0 0 0
! distance pair 106 264
assign (resid 106 and name ca and segid a)
       (resid 264 and name ca and segid b)  0 0 0
assign (resid 206 and name ca and segid b)
       (resid 164 and name ca and segid a)  0 0 0
! distance pair 107 263
assign (resid 107 and name ca and segid a)
       (resid 263 and name ca and segid b)  0 0 0
assign (resid 207 and name ca and segid b)
       (resid 163 and name ca and segid a)  0 0 0
! distance pair 108 262
assign (resid 108 and name ca and segid a)
       (resid 262 and name ca and segid b)  0 0 0
assign (resid 208 and name ca and segid b)
       (resid 162 and name ca and segid a)  0 0 0
! distance pair 109 261
assign (resid 109 and name ca and segid a)
       (resid 261 and name ca and segid b)  0 0 0
assign (resid 209 and name ca and segid b)
       (resid 161 and name ca and segid a)  0 0 0
! distance pair 110 260
assign (resid 110 and name ca and segid a)
       (resid 260 and name ca and segid b)  0 0 0
assign (resid 210 and name ca and segid b)
       (resid 160 and name ca and segid a)  0 0 0
! distance pair 111 259
assign (resid 111 and name ca and segid a)
       (resid 259 and name ca and segid b)  0 0 0
assign (resid 211 and name ca and segid b)
       (resid 159 and name ca and segid a)  0 0 0
! distance pair 112 258
assign (resid 112 and name ca and segid a)
       (resid 258 and name ca and segid b)  0 0 0
assign (resid 212 and name ca and segid b)
       (resid 158 and name ca and segid a)  0 0 0
! distance pair 113 257
assign (resid 113 and name ca and segid a)
       (resid 257 and name ca and segid b)  0 0 0
assign (resid 213 and name ca and segid b)
       (resid 157 and name ca and segid a)  0 0 0
! distance pair 114 256
assign (resid 114 and name ca and segid a)
       (resid 256 and name ca and segid b)  0 0 0
assign (resid 214 and name ca and segid b)
       (resid 156 and name ca and segid a)  0 0 0
! distance pair 115 255
assign (resid 115 and name ca and segid a)
       (resid 255 and name ca and segid b)  0 0 0
assign (resid 215 and name ca and segid b)
       (resid 155 and name ca and segid a)  0 0 0
! distance pair 116 254
assign (resid 116 and name ca and segid a)
       (resid 254 and name ca and segid b)  0 0 0
assign (resid 216 and name ca and segid b)
       (resid 154 and name ca and segid a)  0 0 0
! distance pair 117 253
assign (resid 117 and name ca and segid a)
       (resid 253 and name ca and segid b)  0 0 0
assign (resid 217 and name ca and segid b)
       (resid 153 and name ca and segid a)  0 0 0
! distance pair 118 252
assign (resid 118 and name ca and segid a)
       (resid 252 and name ca and segid b)  0 0 0
assign (resid 218 and name ca and segid b)
       (resid 152 and name ca and segid a)  0 0 0
! distance pair 119 251
assign (resid 119 and name ca and segid a)
       (resid 251 and name ca and segid b)  0 0 0
assign (resid 219 and name ca and segid b)
       (resid 151 and name ca and segid a)  0 0 0
! distance pair 120 250
assign (resid 120 and name ca and segid a)
       (resid 250 and name ca and segid b)  0 0 0
assign (resid 220 and name ca and segid b)
       (resid 150 and name ca and segid a)  0 0 0
! distance pair 121 249
assign (resid 121 and name ca and segid a)
       (resid 249 and name ca and segid b)  0 0 0
assign (resid 221 and name ca and segid b)
       (resid 149 and name ca and segid a)  0 0 0
! distance pair 122 248
assign (resid 122 and name ca and segid a)
       (resid 248 and name ca and segid b)  0 0 0
assign (resid 222 and name ca and segid b)
       (resid 148 and name ca and segid a)  0 0 0
! distance pair 123 247
assign (resid 123 and name ca and segid a)
       (resid 247 and name ca and segid b)  0 0 0
assign (resid 223 and name ca and segid b)
       (resid 147 and name ca and segid a)  0 0 0
! distance pair 124 246
assign (resid 124 and name ca and segid a)
       (resid 246 and name ca and segid b)  0 0 0
assign (resid 224 and name ca and segid b)
       (resid 146 and name ca and segid a)  0 0 0
! distance pair 125 245
assign (resid 125 and name ca and segid a)
       (resid 245 and name ca and segid b)  0 0 0
assign (resid 225 and name ca and segid b)
       (resid 145 and name ca and segid a)  0 0 0
! distance pair 126 244
assign (resid 126 and name ca and segid a)
       (resid 244 and name ca and segid b)  0 0 0
assign (resid 226 and name ca and segid b)
       (resid 144 and name ca and segid a)  0 0 0
! distance pair 127 243
assign (resid 127 and name ca and segid a)
       (resid 243 and name ca and segid b)  0 0 0
assign (resid 227 and name ca and segid b)
       (resid 143 and name ca and segid a)  0 0 0
! distance pair 128 242
assign (resid 128 and name ca and segid a)
       (resid 242 and name ca and segid b)  0 0 0
assign (resid 228 and name ca and segid b)
       (resid 142 and name ca and segid a)  0 0 0
! distance pair 129 241
assign (resid 129 and name ca and segid a)
       (resid 241 and name ca and segid b)  0 0 0
assign (resid 229 and name ca and segid b)
       (resid 141 and name ca and segid a)  0 0 0
! distance pair 130 240
assign (resid 130 and name ca and segid a)
       (resid 240 and name ca and segid b)  0 0 0
assign (resid 230 and name ca and segid b)
       (resid 140 and name ca and segid a)  0 0 0
! distance pair 131 239
assign (resid 131 and name ca and segid a)
       (resid 239 and name ca and segid b)  0 0 0
assign (resid 231 and name ca and segid b)
       (resid 139 and name ca and segid a)  0 0 0
! distance pair 132 238
assign (resid 132 and name ca and segid a)
       (resid 238 and name ca and segid b)  0 0 0
assign (resid 232 and name ca and segid b)
       (resid 138 and name ca and segid a)  0 0 0
! distance pair 133 237
assign (resid 133 and name ca and segid a)
       (resid 237 and name ca and segid b)  0 0 0
assign (resid 233 and name ca and segid b)
       (resid 137 and name ca and segid a)  0 0 0
! distance pair 134 236
assign (resid 134 and name ca and segid a)
       (resid 236 and name ca and segid b)  0 0 0
assign (resid 234 and name ca and segid b)
       (resid 136 and name ca and segid a)  0 0 0
! distance pair 135 235
assign (resid 135 and name ca and segid a)
       (resid 235 and name ca and segid b)  0 0 0
assign (resid 235 and name ca and segid b)
       (resid 135 and name ca and segid a)  0 0 0
! distance pair 136 234
assign (resid 136 and name ca and segid a)
       (resid 234 and name ca and segid b)  0 0 0
assign (resid 236 and name ca and segid b)
       (resid 134 and name ca and segid a)  0 0 0
! distance pair 137 233
assign (resid 137 and name ca and segid a)
       (resid 233 and name ca and segid b)  0 0 0
assign (resid 237 and name ca and segid b)
       (resid 133 and name ca and segid a)  0 0 0
! distance pair 138 232
assign (resid 138 and name ca and segid a)
       (resid 232 and name ca and segid b)  0 0 0
assign (resid 238 and name ca and segid b)
       (resid 132 and name ca and segid a)  0 0 0
! distance pair 139 231
assign (resid 139 and name ca and segid a)
       (resid 231 and name ca and segid b)  0 0 0
assign (resid 239 and name ca and segid b)
       (resid 131 and name ca and segid a)  0 0 0
! distance pair 140 230
assign (resid 140 and name ca and segid a)
       (resid 230 and name ca and segid b)  0 0 0
assign (resid 240 and name ca and segid b)
       (resid 130 and name ca and segid a)  0 0 0
! distance pair 141 229
assign (resid 141 and name ca and segid a)
       (resid 229 and name ca and segid b)  0 0 0
assign (resid 241 and name ca and segid b)
       (resid 129 and name ca and segid a)  0 0 0
! distance pair 142 228
assign (resid 142 and name ca and segid a)
       (resid 228 and name ca and segid b)  0 0 0
assign (resid 242 and name ca and segid b)
       (resid 128 and name ca and segid a)  0 0 0
! distance pair 143 227
assign (resid 143 and name ca and segid a)
       (resid 227 and name ca and segid b)  0 0 0
assign (resid 243 and name ca and segid b)
       (resid 127 and name ca and segid a)  0 0 0
! distance pair 144 226
assign (resid 144 and name ca and segid a)
       (resid 226 and name ca and segid b)  0 0 0
assign (resid 244 and name ca and segid b)
       (resid 126 and name ca and segid a)  0 0 0
! distance pair 145 225
assign (resid 145 and name ca and segid a)
       (resid 225 and name ca and segid b)  0 0 0
assign (resid 245 and name ca and segid b)
       (resid 125 and name ca and segid a)  0 0 0
! distance pair 146 224
assign (resid 146 and name ca and segid a)
       (resid 224 and name ca and segid b)  0 0 0
assign (resid 246 and name ca and segid b)
       (resid 124 and name ca and segid a)  0 0 0
! distance pair 147 223
assign (resid 147 and name ca and segid a)
       (resid 223 and name ca and segid b)  0 0 0
assign (resid 247 and name ca and segid b)
       (resid 123 and name ca and segid a)  0 0 0
! distance pair 148 222
assign (resid 148 and name ca and segid a)
       (resid 222 and name ca and segid b)  0 0 0
assign (resid 248 and name ca and segid b)
       (resid 122 and name ca and segid a)  0 0 0
! distance pair 149 221
assign (resid 149 and name ca and segid a)
       (resid 221 and name ca and segid b)  0 0 0
assign (resid 249 and name ca and segid b)
       (resid 121 and name ca and segid a)  0 0 0
! distance pair 150 220
assign (resid 150 and name ca and segid a)
       (resid 220 and name ca and segid b)  0 0 0
assign (resid 250 and name ca and segid b)
       (resid 120 and name ca and segid a)  0 0 0
! distance pair 151 219
assign (resid 151 and name ca and segid a)
       (resid 219 and name ca and segid b)  0 0 0
assign (resid 251 and name ca and segid b)
       (resid 119 and name ca and segid a)  0 0 0
! distance pair 152 218
assign (resid 152 and name ca and segid a)
       (resid 218 and name ca and segid b)  0 0 0
assign (resid 252 and name ca and segid b)
       (resid 118 and name ca and segid a)  0 0 0
! distance pair 153 217
assign (resid 153 and name ca and segid a)
       (resid 217 and name ca and segid b)  0 0 0
assign (resid 253 and name ca and segid b)
       (resid 117 and name ca and segid a)  0 0 0
! distance pair 154 216
assign (resid 154 and name ca and segid a)
       (resid 216 and name ca and segid b)  0 0 0
assign (resid 254 and name ca and segid b)
       (resid 116 and name ca and segid a)  0 0 0
! distance pair 155 215
assign (resid 155 and name ca and segid a)
       (resid 215 and name ca and segid b)  0 0 0
assign (resid 255 and name ca and segid b)
       (resid 115 and name ca and segid a)  0 0 0
! distance pair 156 214
assign (resid 156 and name ca and segid a)
       (resid 214 and name ca and segid b)  0 0 0
assign (resid 256 and name ca and segid b)
       (resid 114 and name ca and segid a)  0 0 0
! distance pair 157 213
assign (resid 157 and name ca and segid a)
       (resid 213 and name ca and segid b)  0 0 0
assign (resid 257 and name ca and segid b)
       (resid 113 and name ca and segid a)  0 0 0
! distance pair 158 212
assign (resid 158 and name ca and segid a)
       (resid 212 and name ca and segid b)  0 0 0
assign (resid 258 and name ca and segid b)
       (resid 112 and name ca and segid a)  0 0 0
! distance pair 159 211
assign (resid 159 and name ca and segid a)
       (resid 211 and name ca and segid b)  0 0 0
assign (resid 259 and name ca and segid b)
       (resid 111 and name ca and segid a)  0 0 0
! distance pair 160 210
assign (resid 160 and name ca and segid a)
       (resid 210 and name ca and segid b)  0 0 0
assign (resid 260 and name ca and segid b)
       (resid 110 and name ca and segid a)  0 0 0
! distance pair 161 209
assign (resid 161 and name ca and segid a)
       (resid 209 and name ca and segid b)  0 0 0
assign (resid 261 and name ca and segid b)
       (resid 109 and name ca and segid a)  0 0 0
! distance pair 162 208
assign (resid 162 and name ca and segid a)
       (resid 208 and name ca and segid b)  0 0 0
assign (resid 262 and name ca and segid b)
       (resid 108 and name ca and segid a)  0 0 0
! distance pair 163 207
assign (resid 163 and name ca and segid a)
       (resid 207 and name ca and segid b)  0 0 0
assign (resid 263 and name ca and segid b)
       (resid 107 and name ca and segid a)  0 0 0
! distance pair 164 206
assign (resid 164 and name ca and segid a)
       (resid 206 and name ca and segid b)  0 0 0
assign (resid 264 and name ca and segid b)
       (resid 106 and name ca and segid a)  0 0 0
! distance pair 165 205
assign (resid 165 and name ca and segid a)
       (resid 205 and name ca and segid b)  0 0 0
assign (resid 265 and name ca and segid b)
       (resid 105 and name ca and segid a)  0 0 0
! distance pair 166 204
assign (resid 166 and name ca and segid a)
       (resid 204 and name ca and segid b)  0 0 0
assign (resid 266 and name ca and segid b)
       (resid 104 and name ca and segid a)  0 0 0
! distance pair 167 203
assign (resid 167 and name ca and segid a)
       (resid 203 and name ca and segid b)  0 0 0
assign (resid 267 and name ca and segid b)
       (resid 103 and name ca and segid a)  0 0 0
! distance pair 168 202
assign (resid 168 and name ca and segid a)
       (resid 202 and name ca and segid b)  0 0 0
assign (resid 268 and name ca and segid b)
       (resid 102 and name ca and segid a)  0 0 0
! distance pair 169 201
assign (resid 169 and name ca and segid a)
       (resid 201 and name ca and segid b)  0 0 0
assign (resid 269 and name ca and segid b)
       (resid 101 and name ca and segid a)  0 0 0

! hydrogen bond constraints
assign (resid   124 and  name H    )(resid   121 and  name O    ) 2.3 0.6 0.2
assign (resid   224 and  name H    )(resid   221 and  name O    ) 2.3 0.6 0.2
assign (resid   124 and  name N    )(resid   121 and  name O    ) 3.3 0.8 0.2
assign (resid   224 and  name N    )(resid   221 and  name O    ) 3.3 0.8 0.2
assign (resid   125 and  name H    )(resid   122 and  name O    ) 2.3 0.6 0.2
assign (resid   225 and  name H    )(resid   222 and  name O    ) 2.3 0.6 0.2
assign (resid   125 and  name N    )(resid   122 and  name O    ) 3.3 0.8 0.2
assign (resid   225 and  name N    )(resid   222 and  name O    ) 3.3 0.8 0.2
assign (resid   143 and  name H    )(resid   127 and  name O    ) 2.3 0.6 0.2
assign (resid   243 and  name H    )(resid   227 and  name O    ) 2.3 0.6 0.2
assign (resid   143 and  name N    )(resid   127 and  name O    ) 3.3 0.8 0.2
assign (resid   243 and  name N    )(resid   227 and  name O    ) 3.3 0.8 0.2
assign (resid   148 and  name O    )(resid   144 and  name H    ) 2.3 0.6 0.2
assign (resid   248 and  name O    )(resid   244 and  name H    ) 2.3 0.6 0.2
assign (resid   148 and  name O    )(resid   144 and  name N    ) 3.3 0.8 0.2
assign (resid   248 and  name O    )(resid   244 and  name N    ) 3.3 0.8 0.2
assign (resid   129 and  name H    )(resid   141 and  name O    ) 2.3 0.6 0.2
assign (resid   229 and  name H    )(resid   241 and  name O    ) 2.3 0.6 0.2
assign (resid   129 and  name N    )(resid   141 and  name O    ) 3.3 0.8 0.2
assign (resid   229 and  name N    )(resid   241 and  name O    ) 3.3 0.8 0.2
assign (resid   129 and  name O    )(resid   141 and  name H    ) 2.3 0.6 0.2
assign (resid   229 and  name O    )(resid   241 and  name H    ) 2.3 0.6 0.2
assign (resid   129 and  name O    )(resid   141 and  name N    ) 3.3 0.8 0.2
assign (resid   229 and  name O    )(resid   241 and  name N    ) 3.3 0.8 0.2
assign (resid   131 and  name H    )(resid   139 and  name O    ) 2.3 0.6 0.2
assign (resid   231 and  name H    )(resid   239 and  name O    ) 2.3 0.6 0.2
assign (resid   131 and  name N    )(resid   139 and  name O    ) 3.3 0.8 0.2
assign (resid   231 and  name N    )(resid   239 and  name O    ) 3.3 0.8 0.2
assign (resid   137 and  name H    )(resid   135 and  name O    ) 2.3 0.6 0.2
assign (resid   237 and  name H    )(resid   235 and  name O    ) 2.3 0.6 0.2
assign (resid   137 and  name N    )(resid   135 and  name O    ) 3.3 0.8 0.2
assign (resid   237 and  name N    )(resid   235 and  name O    ) 3.3 0.8 0.2
assign (resid   152 and  name H    )(resid   140 and  name O    ) 2.3 0.6 0.2
assign (resid   252 and  name H    )(resid   240 and  name O    ) 2.3 0.6 0.2
assign (resid   152 and  name N    )(resid   140 and  name O    ) 3.3 0.8 0.2
assign (resid   252 and  name N    )(resid   240 and  name O    ) 3.3 0.8 0.2
assign (resid   142 and  name H    )(resid   150 and  name O    ) 2.3 0.6 0.2
assign (resid   242 and  name H    )(resid   250 and  name O    ) 2.3 0.6 0.2
assign (resid   142 and  name N    )(resid   150 and  name O    ) 3.3 0.8 0.2
assign (resid   242 and  name N    )(resid   250 and  name O    ) 3.3 0.8 0.2
assign (resid   150 and  name H    )(resid   142 and  name O    ) 2.3 0.6 0.2
assign (resid   250 and  name H    )(resid   242 and  name O    ) 2.3 0.6 0.2
assign (resid   250 and  name N    )(resid   242 and  name O    ) 3.3 0.8 0.2
assign (resid   150 and  name N    )(resid   142 and  name O    ) 3.3 0.8 0.2
assign (resid   156 and  name H    )(resid   153 and  name O    ) 2.3 0.6 0.2
assign (resid   256 and  name H    )(resid   253 and  name O    ) 2.3 0.6 0.2
assign (resid   156 and  name N    )(resid   153 and  name O    ) 3.3 0.8 0.2
assign (resid   256 and  name N    )(resid   253 and  name O    ) 3.3 0.8 0.2
assign (resid   159 and  name H    )(resid   156 and  name O    ) 2.3 0.6 0.2
assign (resid   259 and  name H    )(resid   256 and  name O    ) 2.3 0.6 0.2
assign (resid   159 and  name N    )(resid   156 and  name O    ) 3.3 0.8 0.2
assign (resid   259 and  name N    )(resid   256 and  name O    ) 3.3 0.8 0.2
assign (resid   161 and  name H    )(resid   157 and  name O    ) 2.3 0.6 0.2
assign (resid   261 and  name H    )(resid   257 and  name O    ) 2.3 0.6 0.2
assign (resid   161 and  name N    )(resid   157 and  name O    ) 3.3 0.8 0.2
assign (resid   261 and  name N    )(resid   257 and  name O    ) 3.3 0.8 0.2
assign (resid   162 and  name H    )(resid   158 and  name O    ) 2.3 0.6 0.2
assign (resid   262 and  name H    )(resid   258 and  name O    ) 2.3 0.6 0.2
assign (resid   162 and  name N    )(resid   158 and  name O    ) 3.3 0.8 0.2
assign (resid   262 and  name N    )(resid   258 and  name O    ) 3.3 0.8 0.2
assign (resid   163 and  name H    )(resid   159 and  name O    ) 2.3 0.6 0.2
assign (resid   263 and  name H    )(resid   259 and  name O    ) 2.3 0.6 0.2
assign (resid   163 and  name N    )(resid   159 and  name O    ) 3.3 0.8 0.2
assign (resid   263 and  name N    )(resid   259 and  name O    ) 3.3 0.8 0.2
assign (resid   164 and  name H    )(resid   160 and  name O    ) 2.3 0.6 0.2
assign (resid   264 and  name H    )(resid   260 and  name O    ) 2.3 0.6 0.2
assign (resid   164 and  name N    )(resid   160 and  name O    ) 3.3 0.8 0.2
assign (resid   264 and  name N    )(resid   260 and  name O    ) 3.3 0.8 0.2
assign (resid   165 and  name H    )(resid   161 and  name O    ) 2.3 0.6 0.2
assign (resid   265 and  name H    )(resid   261 and  name O    ) 2.3 0.6 0.2
assign (resid   165 and  name N    )(resid   161 and  name O    ) 3.3 0.8 0.2
assign (resid   265 and  name N    )(resid   261 and  name O    ) 3.3 0.8 0.2
assign (resid   166 and  name H    )(resid   162 and  name O    ) 2.3 0.6 0.2
assign (resid   266 and  name H    )(resid   262 and  name O    ) 2.3 0.6 0.2
assign (resid   266 and  name N    )(resid   262 and  name O    ) 3.3 0.8 0.2
assign (resid   166 and  name N    )(resid   162 and  name O    ) 3.3 0.8 0.2
assign (resid   151 and  name H    )(resid   206 and  name O    ) 2.3 0.6 0.2
assign (resid   251 and  name H    )(resid   106 and  name O    ) 2.3 0.6 0.2
assign (resid   151 and  name N    )(resid   206 and  name O    ) 3.3 0.8 0.2
assign (resid   251 and  name N    )(resid   106 and  name O    ) 3.3 0.8 0.2
assign (resid   111 and  name H    )(resid   209 and  name O    ) 2.3 0.6 0.2
assign (resid   211 and  name H    )(resid   109 and  name O    ) 2.3 0.6 0.2
assign (resid   111 and  name N    )(resid   209 and  name O    ) 3.3 0.8 0.2
assign (resid   211 and  name N    )(resid   109 and  name O    ) 3.3 0.8 0.2

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    SER   1           H        SER   1   9.337 -15.474  -8.627
    2    HA   SER   1           HA       SER   1  10.653 -13.120  -9.710
    3   1HB   SER   1          1HB       SER   1   7.694 -12.994  -9.058
    4   2HB   SER   1          2HB       SER   1   8.722 -11.575  -9.262
    5    HG   SER   1           HG       SER   1   8.434 -11.795 -11.310
    6    HA   PRO   2           HA       PRO   2  11.145 -13.964  -5.188
    7   1HB   PRO   2          1HB       PRO   2  13.764 -12.764  -5.471
    8   2HB   PRO   2          2HB       PRO   2  13.370 -14.447  -5.100
    9   1HG   PRO   2          1HG       PRO   2  14.401 -13.386  -7.572
   10   2HG   PRO   2          2HG       PRO   2  13.977 -15.064  -7.212
   11   1HD   PRO   2          1HD       PRO   2  12.564 -13.205  -8.907
   12   2HD   PRO   2          2HD       PRO   2  12.138 -14.888  -8.545
   13    H    TYR   3           H        TYR   3  10.184 -12.391  -3.972
   14    HA   TYR   3           HA       TYR   3  10.443  -9.563  -4.763
   15   1HB   TYR   3          1HB       TYR   3   8.832 -10.938  -2.595
   16   2HB   TYR   3          2HB       TYR   3   8.792  -9.202  -2.905
   17    HD1  TYR   3           HD1      TYR   3   8.744  -8.835  -5.723
   18    HD2  TYR   3           HD2      TYR   3   6.913 -11.996  -3.421
   19    HE1  TYR   3           HE1      TYR   3   7.082  -9.199  -7.544
   20    HE2  TYR   3           HE2      TYR   3   5.250 -12.359  -5.242
   21    HH   TYR   3           HH       TYR   3   5.613 -11.066  -8.353
   22    H    SER   4           H        SER   4  12.277  -8.567  -4.067
   23    HA   SER   4           HA       SER   4  13.115  -9.046  -1.233
   24   1HB   SER   4          1HB       SER   4  14.668  -8.895  -3.759
   25   2HB   SER   4          2HB       SER   4  15.364  -8.049  -2.378
   26    HG   SER   4           HG       SER   4  15.868 -10.379  -2.672
   27    H    SER   5           H        SER   5  14.062  -6.606  -3.647
   28    HA   SER   5           HA       SER   5  12.911  -4.514  -1.843
   29   1HB   SER   5          1HB       SER   5  14.904  -3.111  -2.833
   30   2HB   SER   5          2HB       SER   5  15.203  -4.206  -1.483
   31    HG   SER   5           HG       SER   5  15.615  -4.738  -4.236
   32    H    ASP   6           H        ASP   6  11.047  -4.586  -3.304
   33    HA   ASP   6           HA       ASP   6  11.425  -2.817  -5.634
   34   1HB   ASP   6          2HB       ASP   6  10.404  -4.363  -7.226
   35   2HB   ASP   6          1HB       ASP   6  11.807  -5.142  -6.501
   36    H    THR   7           H        THR   7   8.815  -3.438  -6.730
   37    HA   THR   7           HA       THR   7   7.268  -1.872  -4.837
   38    HB   THR   7           HB       THR   7   6.992  -1.380  -7.184
   39    HG1  THR   7           HG1      THR   7   4.979  -1.088  -6.753
   40   1HG2  THR   7          3HG2      THR   7   6.492  -4.346  -7.368
   41   2HG2  THR   7          1HG2      THR   7   5.888  -3.253  -8.613
   42   3HG2  THR   7          2HG2      THR   7   7.620  -3.359  -8.297
   43    H    THR   8           H        THR   8   4.883  -2.634  -4.479
   44    HA   THR   8           HA       THR   8   4.634  -5.564  -4.175
   45    HB   THR   8           HB       THR   8   4.145  -3.782  -1.783
   46    HG1  THR   8           HG1      THR   8   6.300  -3.566  -2.153
   47   1HG2  THR   8          3HG2      THR   8   3.624  -6.482  -2.402
   48   2HG2  THR   8          1HG2      THR   8   5.002  -6.506  -1.302
   49   3HG2  THR   8          2HG2      THR   8   3.502  -5.715  -0.818
   50    HA   PRO   9           HA       PRO   9   0.745  -3.794  -5.683
   51   1HB   PRO   9          1HB       PRO   9  -0.169  -6.518  -6.008
   52   2HB   PRO   9          2HB       PRO   9   0.269  -5.359  -7.269
   53   1HG   PRO   9          1HG       PRO   9   1.770  -7.671  -6.390
   54   2HG   PRO   9          2HG       PRO   9   2.205  -6.520  -7.654
   55   1HD   PRO   9          1HD       PRO   9   3.385  -6.806  -5.071
   56   2HD   PRO   9          2HD       PRO   9   3.785  -5.616  -6.323
   57    H    CYS  10           H        CYS  10  -0.149  -3.055  -3.746
   58    HA   CYS  10           HA       CYS  10  -1.633  -5.088  -2.148
   59   1HB   CYS  10          2HB       CYS  10   0.437  -3.178  -1.248
   60   2HB   CYS  10          1HB       CYS  10  -1.030  -3.200  -0.270
   61    H    CYS  11           H        CYS  11  -3.101  -3.720  -0.535
   62    HA   CYS  11           HA       CYS  11  -4.389  -1.629  -2.214
   63   1HB   CYS  11          1HB       CYS  11  -6.212  -2.919  -2.231
   64   2HB   CYS  11          2HB       CYS  11  -5.436  -4.107  -1.202
   65    H    PHE  12           H        PHE  12  -5.523   0.075  -0.893
   66    HA   PHE  12           HA       PHE  12  -4.091   0.477   1.702
   67   1HB   PHE  12          2HB       PHE  12  -3.674   2.202  -0.042
   68   2HB   PHE  12          1HB       PHE  12  -5.386   2.548  -0.089
   69    HD1  PHE  12           HD1      PHE  12  -2.327   2.685   2.004
   70    HD2  PHE  12           HD2      PHE  12  -6.489   3.791   1.686
   71    HE1  PHE  12           HE1      PHE  12  -2.075   4.203   3.964
   72    HE2  PHE  12           HE2      PHE  12  -6.237   5.307   3.649
   73    HZ   PHE  12           HZ       PHE  12  -4.030   5.511   4.790
   74    H    ALA  13           H        ALA  13  -7.126   1.761   0.314
   75    HA   ALA  13           HA       ALA  13  -8.443   1.082   2.907
   76   1HB   ALA  13          3HB       ALA  13  -8.675   3.348   1.013
   77   2HB   ALA  13          1HB       ALA  13 -10.198   2.755   1.675
   78   3HB   ALA  13          2HB       ALA  13  -8.923   3.313   2.759
   79    H    TYR  14           H        TYR  14 -10.489   0.067   2.864
   80    HA   TYR  14           HA       TYR  14 -10.869  -1.556   0.438
   81   1HB   TYR  14          2HB       TYR  14 -12.631  -1.865   2.837
   82   2HB   TYR  14          1HB       TYR  14 -12.015  -3.096   1.741
   83    HD1  TYR  14           HD1      TYR  14  -9.548  -3.737   1.843
   84    HD2  TYR  14           HD2      TYR  14 -11.459  -1.290   4.843
   85    HE1  TYR  14           HE1      TYR  14  -7.666  -4.193   3.413
   86    HE2  TYR  14           HE2      TYR  14  -9.581  -1.753   6.417
   87    HH   TYR  14           HH       TYR  14  -7.420  -4.205   6.042
   88    H    ILE  15           H        ILE  15 -12.830  -1.573  -0.750
   89    HA   ILE  15           HA       ILE  15 -14.199   0.923  -0.974
   90    HB   ILE  15           HB       ILE  15 -14.072  -0.717  -2.820
   91   1HG1  ILE  15          1HG1      ILE  15 -16.850  -0.821  -2.900
   92   2HG1  ILE  15          2HG1      ILE  15 -16.518   0.559  -1.854
   93   1HG2  ILE  15          1HG2      ILE  15 -14.887  -2.516  -0.817
   94   2HG2  ILE  15          2HG2      ILE  15 -16.243  -2.425  -1.940
   95   3HG2  ILE  15          3HG2      ILE  15 -14.642  -2.878  -2.524
   96   1HD1  ILE  15          3HD1      ILE  15 -14.899   0.305  -4.349
   97   2HD1  ILE  15          1HD1      ILE  15 -16.583   0.799  -4.521
   98   3HD1  ILE  15          2HD1      ILE  15 -15.479   1.755  -3.531
   99    H    ALA  16           H        ALA  16 -16.019   1.681   0.049
  100    HA   ALA  16           HA       ALA  16 -17.072   0.076   2.288
  101   1HB   ALA  16          1HB       ALA  16 -16.512   2.593   2.372
  102   2HB   ALA  16          2HB       ALA  16 -18.009   2.826   1.469
  103   3HB   ALA  16          3HB       ALA  16 -18.051   2.087   3.070
  104    H    ARG  17           H        ARG  17 -17.882  -1.390   0.340
  105    HA   ARG  17           HA       ARG  17 -20.693  -1.371   0.328
  106   1HB   ARG  17          2HB       ARG  17 -19.635   0.588  -1.432
  107   2HB   ARG  17          1HB       ARG  17 -20.266  -0.701  -2.428
  108   1HG   ARG  17          1HG       ARG  17 -21.997   0.021  -0.157
  109   2HG   ARG  17          2HG       ARG  17 -21.791   1.303  -1.349
  110   1HD   ARG  17          1HD       ARG  17 -22.214  -0.686  -3.059
  111   2HD   ARG  17          2HD       ARG  17 -23.026  -1.405  -1.669
  112    HE   ARG  17           HE       ARG  17 -24.167   1.046  -1.689
  113   1HH1  ARG  17          2HH2      ARG  17 -23.146   0.291  -4.886
  114   2HH1  ARG  17          1HH2      ARG  17 -24.508   1.317  -5.187
  115   1HH2  ARG  17          2HH1      ARG  17 -26.117  -0.676  -2.642
  116   2HH2  ARG  17          1HH1      ARG  17 -26.361  -0.128  -4.266
  117    HA   PRO  18           HA       PRO  18 -19.245  -5.373  -1.053
  118   1HB   PRO  18          1HB       PRO  18 -21.938  -6.201  -1.589
  119   2HB   PRO  18          2HB       PRO  18 -20.932  -6.658  -0.245
  120   1HG   PRO  18          2HG       PRO  18 -23.186  -4.854  -0.225
  121   2HG   PRO  18          1HG       PRO  18 -22.196  -5.372   1.146
  122   1HD   PRO  18          1HD       PRO  18 -22.209  -2.798  -0.095
  123   2HD   PRO  18          2HD       PRO  18 -21.151  -3.350   1.191
  124    H    LEU  19           H        LEU  19 -18.298  -4.863  -3.036
  125    HA   LEU  19           HA       LEU  19 -19.598  -3.866  -5.338
  126   1HB   LEU  19          2HB       LEU  19 -17.282  -5.808  -5.271
  127   2HB   LEU  19          1HB       LEU  19 -17.681  -4.732  -6.583
  128    HG   LEU  19           HG       LEU  19 -16.761  -3.960  -3.810
  129   1HD1  LEU  19          3HD1      LEU  19 -15.116  -4.749  -5.638
  130   2HD1  LEU  19          1HD1      LEU  19 -15.513  -3.240  -6.459
  131   3HD1  LEU  19          2HD1      LEU  19 -14.779  -3.204  -4.856
  132   1HD2  LEU  19          1HD2      LEU  19 -18.209  -2.444  -5.896
  133   2HD2  LEU  19          2HD2      LEU  19 -18.060  -2.116  -4.170
  134   3HD2  LEU  19          3HD2      LEU  19 -16.766  -1.646  -5.272
  135    HA   PRO  20           HA       PRO  20 -22.235  -7.435  -6.087
  136   1HB   PRO  20          1HB       PRO  20 -22.693  -6.432  -8.775
  137   2HB   PRO  20          2HB       PRO  20 -23.824  -6.486  -7.417
  138   1HG   PRO  20          1HG       PRO  20 -22.513  -4.172  -8.504
  139   2HG   PRO  20          2HG       PRO  20 -23.583  -4.237  -7.098
  140   1HD   PRO  20          1HD       PRO  20 -20.726  -3.830  -7.131
  141   2HD   PRO  20          2HD       PRO  20 -21.801  -3.896  -5.721
  142    H    ARG  21           H        ARG  21 -21.345  -9.365  -6.675
  143    HA   ARG  21           HA       ARG  21 -18.910  -9.713  -8.014
  144   1HB   ARG  21          2HB       ARG  21 -20.281 -11.448  -6.718
  145   2HB   ARG  21          1HB       ARG  21 -21.176 -11.703  -8.216
  146   1HG   ARG  21          2HG       ARG  21 -18.197 -11.732  -8.381
  147   2HG   ARG  21          1HG       ARG  21 -18.977 -13.119  -7.623
  148   1HD   ARG  21          2HD       ARG  21 -20.420 -12.404 -10.004
  149   2HD   ARG  21          1HD       ARG  21 -18.727 -12.579 -10.396
  150    HE   ARG  21           HE       ARG  21 -19.943 -14.747  -8.799
  151   1HH1  ARG  21          2HH2      ARG  21 -17.443 -14.789 -11.280
  152   2HH1  ARG  21          1HH2      ARG  21 -18.670 -14.206 -12.355
  153   1HH2  ARG  21          1HH1      ARG  21 -20.948 -16.193 -10.947
  154   2HH2  ARG  21          2HH1      ARG  21 -19.431 -17.029 -10.948
  155    H    ALA  22           H        ALA  22 -22.058  -9.086  -9.367
  156    HA   ALA  22           HA       ALA  22 -21.537 -10.057 -12.021
  157   1HB   ALA  22          3HB       ALA  22 -23.587  -8.439 -10.679
  158   2HB   ALA  22          1HB       ALA  22 -23.304  -7.959 -12.353
  159   3HB   ALA  22          2HB       ALA  22 -23.762  -9.620 -11.976
  160    H    HIS  23           H        HIS  23 -21.190  -6.823 -10.540
  161    HA   HIS  23           HA       HIS  23 -20.111  -5.680 -12.991
  162   1HB   HIS  23          2HB       HIS  23 -19.837  -4.562 -10.193
  163   2HB   HIS  23          1HB       HIS  23 -19.771  -3.678 -11.716
  164    HD2  HIS  23           HD2      HIS  23 -22.669  -5.985 -12.181
  165    HE1  HIS  23           HE1      HIS  23 -24.332  -2.570 -10.325
  166    HE2  HIS  23           HE2      HIS  23 -24.868  -4.718 -11.579
  167    H    ILE  24           H        ILE  24 -18.796  -7.525 -10.375
  168    HA   ILE  24           HA       ILE  24 -16.063  -6.524 -10.809
  169    HB   ILE  24           HB       ILE  24 -17.020  -8.864  -9.167
  170   1HG1  ILE  24          2HG1      ILE  24 -16.207  -6.082  -8.296
  171   2HG1  ILE  24          1HG1      ILE  24 -17.873  -6.656  -8.379
  172   1HG2  ILE  24          2HG2      ILE  24 -14.350  -7.513  -9.503
  173   2HG2  ILE  24          3HG2      ILE  24 -14.735  -8.442  -8.058
  174   3HG2  ILE  24          1HG2      ILE  24 -14.730  -9.230  -9.632
  175   1HD1  ILE  24          2HD1      ILE  24 -16.264  -8.549  -6.909
  176   2HD1  ILE  24          3HD1      ILE  24 -16.049  -6.935  -6.228
  177   3HD1  ILE  24          1HD1      ILE  24 -17.664  -7.631  -6.357
  178    H    LYS  25           H        LYS  25 -14.337  -8.018 -11.405
  179    HA   LYS  25           HA       LYS  25 -15.273 -10.058 -13.372
  180   1HB   LYS  25          2HB       LYS  25 -13.731  -7.731 -13.747
  181   2HB   LYS  25          1HB       LYS  25 -12.613  -9.051 -13.852
  182   1HG   LYS  25          1HG       LYS  25 -14.085 -10.156 -15.523
  183   2HG   LYS  25          2HG       LYS  25 -15.191  -8.786 -15.417
  184   1HD   LYS  25          1HD       LYS  25 -13.509  -7.276 -16.278
  185   2HD   LYS  25          2HD       LYS  25 -12.274  -8.533 -16.200
  186   1HE   LYS  25          1HE       LYS  25 -14.768  -8.683 -17.919
  187   2HE   LYS  25          2HE       LYS  25 -13.178  -8.202 -18.509
  188   1HZ   LYS  25          2HZ       LYS  25 -12.591 -10.482 -17.263
  189   2HZ   LYS  25          3HZ       LYS  25 -14.170 -10.827 -17.785
  190   3HZ   LYS  25          1HZ       LYS  25 -12.980 -10.387 -18.914
  191    H    GLU  26           H        GLU  26 -13.050  -9.251 -10.779
  192    HA   GLU  26           HA       GLU  26 -12.522 -12.017 -10.194
  193   1HB   GLU  26          2HB       GLU  26  -9.878 -11.274 -10.547
  194   2HB   GLU  26          1HB       GLU  26 -10.770 -12.319 -11.591
  195   1HG   GLU  26          1HG       GLU  26 -11.139  -9.452 -12.149
  196   2HG   GLU  26          2HG       GLU  26  -9.517 -10.032 -12.374
  197    H    TYR  27           H        TYR  27 -10.056 -11.580  -8.815
  198    HA   TYR  27           HA       TYR  27 -10.201  -9.197  -7.176
  199   1HB   TYR  27          2HB       TYR  27 -10.759 -10.353  -5.072
  200   2HB   TYR  27          1HB       TYR  27 -12.071 -10.511  -6.203
  201    HD1  TYR  27           HD2      TYR  27  -9.300 -12.285  -4.528
  202    HD2  TYR  27           HD1      TYR  27 -12.615 -12.651  -7.270
  203    HE1  TYR  27           HE2      TYR  27  -9.151 -14.768  -4.376
  204    HE2  TYR  27           HE1      TYR  27 -12.469 -15.135  -7.115
  205    HH   TYR  27           HH       TYR  27  -9.872 -16.764  -6.001
  206    H    PHE  28           H        PHE  28  -8.216  -8.953  -6.187
  207    HA   PHE  28           HA       PHE  28  -6.402 -11.289  -6.374
  208   1HB   PHE  28          1HB       PHE  28  -5.652  -9.928  -8.150
  209   2HB   PHE  28          2HB       PHE  28  -5.966  -8.440  -7.261
  210    HD1  PHE  28           HD1      PHE  28  -4.438  -7.664  -5.499
  211    HD2  PHE  28           HD2      PHE  28  -3.590 -11.217  -7.794
  212    HE1  PHE  28           HE1      PHE  28  -2.159  -7.728  -4.533
  213    HE2  PHE  28           HE2      PHE  28  -1.272 -11.255  -6.871
  214    HZ   PHE  28           HZ       PHE  28  -0.550  -9.510  -5.241
  215    H    TYR  29           H        TYR  29  -6.140 -11.846  -4.246
  216    HA   TYR  29           HA       TYR  29  -6.304  -9.955  -2.094
  217   1HB   TYR  29          1HB       TYR  29  -6.702 -12.306  -1.638
  218   2HB   TYR  29          2HB       TYR  29  -5.144 -12.759  -2.314
  219    HD1  TYR  29           HD2      TYR  29  -3.040 -12.327  -1.087
  220    HD2  TYR  29           HD1      TYR  29  -6.904 -11.467   0.632
  221    HE1  TYR  29           HE2      TYR  29  -2.005 -12.208   1.178
  222    HE2  TYR  29           HE1      TYR  29  -5.877 -11.378   2.900
  223    HH   TYR  29           HH       TYR  29  -3.916 -11.287   4.036
  224    H    THR  30           H        THR  30  -4.790  -8.730  -1.192
  225    HA   THR  30           HA       THR  30  -2.556  -7.749  -2.462
  226    HB   THR  30           HB       THR  30  -1.679  -7.180  -0.147
  227    HG1  THR  30           HG1      THR  30  -2.373  -8.487   1.327
  228   1HG2  THR  30          1HG2      THR  30  -3.549  -5.975  -1.539
  229   2HG2  THR  30          2HG2      THR  30  -4.630  -6.620  -0.304
  230   3HG2  THR  30          3HG2      THR  30  -3.317  -5.534   0.152
  231    H    SER  31           H        SER  31  -0.193  -8.009  -1.896
  232    HA   SER  31           HA       SER  31   0.720 -10.632  -2.445
  233   1HB   SER  31          1HB       SER  31   2.152  -8.698  -2.821
  234   2HB   SER  31          2HB       SER  31   2.156  -8.325  -1.098
  235    HG   SER  31           HG       SER  31   4.013  -9.525  -1.899
  236    H    GLY  32           H        GLY  32  -0.127  -9.094   0.575
  237   1HA   GLY  32          2HA       GLY  32  -0.697 -10.384   2.537
  238   2HA   GLY  32          1HA       GLY  32   0.308 -11.684   1.946
  239    H    LYS  33           H        LYS  33   1.102  -8.226   2.312
  240    HA   LYS  33           HA       LYS  33   2.584  -8.449   4.722
  241   1HB   LYS  33          2HB       LYS  33   4.912  -8.445   3.738
  242   2HB   LYS  33          1HB       LYS  33   4.061  -9.982   3.580
  243   1HG   LYS  33          1HG       LYS  33   3.367  -9.309   1.275
  244   2HG   LYS  33          2HG       LYS  33   4.342  -7.848   1.442
  245   1HD   LYS  33          1HD       LYS  33   5.518 -10.596   1.857
  246   2HD   LYS  33          2HD       LYS  33   5.444  -9.863   0.273
  247   1HE   LYS  33          1HE       LYS  33   6.452  -7.921   2.126
  248   2HE   LYS  33          2HE       LYS  33   7.378  -9.411   2.307
  249   1HZ   LYS  33          1HZ       LYS  33   6.788  -8.286  -0.359
  250   2HZ   LYS  33          2HZ       LYS  33   8.125  -7.754   0.544
  251   3HZ   LYS  33          3HZ       LYS  33   8.006  -9.384   0.086
  252    H    CYS  34           H        CYS  34   1.123  -6.402   4.267
  253    HA   CYS  34           HA       CYS  34   2.989  -4.194   3.817
  254   1HB   CYS  34          2HB       CYS  34   1.540  -3.103   2.090
  255   2HB   CYS  34          1HB       CYS  34   2.333  -4.570   1.517
  256    H    SER  35           H        SER  35   1.177  -5.318   5.916
  257    HA   SER  35           HA       SER  35  -0.273  -4.510   7.567
  258   1HB   SER  35          1HB       SER  35   0.239  -1.705   6.659
  259   2HB   SER  35          2HB       SER  35   0.198  -2.364   8.295
  260    HG   SER  35           HG       SER  35   2.276  -2.179   6.515
  261    H    ASN  36           H        ASN  36  -1.467  -5.085   4.960
  262    HA   ASN  36           HA       ASN  36  -4.014  -3.800   5.381
  263   1HB   ASN  36          1HB       ASN  36  -2.119  -2.544   3.518
  264   2HB   ASN  36          2HB       ASN  36  -3.694  -2.880   2.802
  265   1HD2  ASN  36          2HD2      ASN  36  -3.306   0.399   4.554
  266   2HD2  ASN  36          1HD2      ASN  36  -2.112  -0.651   5.150
  267    HA   PRO  37           HA       PRO  37  -3.689  -7.744   2.796
  268   1HB   PRO  37          1HB       PRO  37  -5.231  -9.134   4.775
  269   2HB   PRO  37          2HB       PRO  37  -3.535  -9.405   4.357
  270   1HG   PRO  37          2HG       PRO  37  -4.614  -8.173   6.753
  271   2HG   PRO  37          1HG       PRO  37  -2.924  -8.521   6.370
  272   1HD   PRO  37          1HD       PRO  37  -4.220  -5.956   6.402
  273   2HD   PRO  37          2HD       PRO  37  -2.549  -6.314   5.995
  274    H    ALA  38           H        ALA  38  -5.519  -8.488   1.567
  275    HA   ALA  38           HA       ALA  38  -8.250  -8.156   2.298
  276   1HB   ALA  38          3HB       ALA  38  -7.540  -5.704   2.170
  277   2HB   ALA  38          1HB       ALA  38  -7.291  -5.956   0.444
  278   3HB   ALA  38          2HB       ALA  38  -8.899  -6.147   1.143
  279    H    VAL  39           H        VAL  39  -9.317  -7.451  -0.231
  280    HA   VAL  39           HA       VAL  39  -8.057  -9.301  -2.174
  281    HB   VAL  39           HB       VAL  39 -10.452 -10.055  -2.751
  282   1HG1  VAL  39          3HG1      VAL  39  -8.744 -10.920  -0.494
  283   2HG1  VAL  39          1HG1      VAL  39 -10.380 -11.580  -0.528
  284   3HG1  VAL  39          2HG1      VAL  39  -9.302 -11.822  -1.904
  285   1HG2  VAL  39          3HG2      VAL  39 -10.864  -8.840  -0.016
  286   2HG2  VAL  39          1HG2      VAL  39 -11.768  -8.524  -1.498
  287   3HG2  VAL  39          2HG2      VAL  39 -11.942 -10.073  -0.672
  288    H    VAL  40           H        VAL  40  -7.873  -8.087  -3.982
  289    HA   VAL  40           HA       VAL  40  -9.673  -5.758  -4.068
  290    HB   VAL  40           HB       VAL  40  -7.800  -4.737  -4.152
  291   1HG1  VAL  40          1HG2      VAL  40  -6.513  -6.738  -3.652
  292   2HG1  VAL  40          2HG2      VAL  40  -6.211  -6.886  -5.383
  293   3HG1  VAL  40          3HG2      VAL  40  -5.660  -5.459  -4.508
  294   1HG2  VAL  40          2HG1      VAL  40  -8.734  -4.691  -6.557
  295   2HG2  VAL  40          3HG1      VAL  40  -7.209  -3.914  -6.157
  296   3HG2  VAL  40          1HG1      VAL  40  -7.212  -5.497  -6.926
  297    H    PHE  41           H        PHE  41 -11.413  -6.275  -5.010
  298    HA   PHE  41           HA       PHE  41 -11.742  -8.048  -7.169
  299   1HB   PHE  41          1HB       PHE  41 -13.397  -5.686  -6.255
  300   2HB   PHE  41          2HB       PHE  41 -13.921  -6.781  -7.507
  301    HD1  PHE  41           HD1      PHE  41 -13.602  -9.410  -6.803
  302    HD2  PHE  41           HD2      PHE  41 -14.198  -6.092  -4.108
  303    HE1  PHE  41           HE1      PHE  41 -14.560 -10.963  -5.105
  304    HE2  PHE  41           HE2      PHE  41 -15.139  -7.646  -2.404
  305    HZ   PHE  41           HZ       PHE  41 -15.343 -10.076  -2.911
  306    H    VAL  42           H        VAL  42 -10.965  -7.929  -9.035
  307    HA   VAL  42           HA       VAL  42 -10.280  -5.330 -10.276
  308    HB   VAL  42           HB       VAL  42  -9.830  -7.333 -12.165
  309   1HG1  VAL  42          1HG2      VAL  42  -8.144  -5.926 -10.115
  310   2HG1  VAL  42          2HG2      VAL  42  -7.416  -6.993 -11.318
  311   3HG1  VAL  42          3HG2      VAL  42  -8.300  -5.558 -11.835
  312   1HG2  VAL  42          3HG1      VAL  42 -10.185  -9.053 -10.365
  313   2HG2  VAL  42          1HG1      VAL  42  -8.556  -9.069 -11.037
  314   3HG2  VAL  42          2HG1      VAL  42  -8.860  -8.318  -9.472
  315    H    THR  43           H        THR  43 -12.449  -4.546 -10.576
  316    HA   THR  43           HA       THR  43 -14.559  -6.175 -11.696
  317    HB   THR  43           HB       THR  43 -15.949  -4.294 -11.488
  318    HG1  THR  43           HG1      THR  43 -15.284  -2.448 -12.185
  319   1HG2  THR  43          1HG2      THR  43 -14.727  -5.086  -9.349
  320   2HG2  THR  43          2HG2      THR  43 -13.787  -3.602  -9.498
  321   3HG2  THR  43          3HG2      THR  43 -15.536  -3.521  -9.291
  322    H    ARG  44           H        ARG  44 -15.877  -4.537 -13.455
  323    HA   ARG  44           HA       ARG  44 -15.007  -5.419 -15.927
  324   1HB   ARG  44          2HB       ARG  44 -16.264  -3.336 -16.858
  325   2HB   ARG  44          1HB       ARG  44 -17.176  -4.523 -15.930
  326   1HG   ARG  44          1HG       ARG  44 -16.135  -2.701 -14.033
  327   2HG   ARG  44          2HG       ARG  44 -16.746  -1.724 -15.363
  328   1HD   ARG  44          1HD       ARG  44 -18.888  -3.013 -15.262
  329   2HD   ARG  44          2HD       ARG  44 -18.271  -3.857 -13.841
  330    HE   ARG  44           HE       ARG  44 -18.286  -1.691 -12.650
  331   1HH1  ARG  44          1HH1      ARG  44 -19.158  -0.458 -15.868
  332   2HH1  ARG  44          2HH1      ARG  44 -19.171   0.846 -14.730
  333   1HH2  ARG  44          2HH2      ARG  44 -21.339  -1.772 -13.490
  334   2HH2  ARG  44          1HH2      ARG  44 -21.107  -0.127 -12.998
  335    H    LYS  45           H        LYS  45 -14.500  -2.030 -14.811
  336    HA   LYS  45           HA       LYS  45 -12.539  -1.429 -16.817
  337   1HB   LYS  45          2HB       LYS  45 -13.202  -0.287 -14.112
  338   2HB   LYS  45          1HB       LYS  45 -11.726   0.224 -14.930
  339   1HG   LYS  45          1HG       LYS  45 -13.003   0.943 -16.878
  340   2HG   LYS  45          2HG       LYS  45 -14.493   0.321 -16.167
  341   1HD   LYS  45          1HD       LYS  45 -13.962   1.902 -14.182
  342   2HD   LYS  45          2HD       LYS  45 -12.838   2.687 -15.292
  343   1HE   LYS  45          1HE       LYS  45 -15.488   2.175 -16.463
  344   2HE   LYS  45          2HE       LYS  45 -15.524   3.278 -15.087
  345   1HZ   LYS  45          3HZ       LYS  45 -13.489   3.628 -17.180
  346   2HZ   LYS  45          1HZ       LYS  45 -15.069   4.190 -17.448
  347   3HZ   LYS  45          2HZ       LYS  45 -14.167   4.782 -16.136
  348    H    ASN  46           H        ASN  46 -12.527  -3.107 -13.790
  349    HA   ASN  46           HA       ASN  46 -11.022  -4.586 -12.859
  350   1HB   ASN  46          2HB       ASN  46 -10.239  -4.433 -15.607
  351   2HB   ASN  46          1HB       ASN  46  -8.783  -4.381 -14.648
  352   1HD2  ASN  46          1HD2      ASN  46  -9.064  -7.905 -14.823
  353   2HD2  ASN  46          2HD2      ASN  46  -8.014  -6.576 -14.709
  354    H    ARG  47           H        ARG  47 -10.880  -1.529 -12.675
  355    HA   ARG  47           HA       ARG  47  -8.153  -0.857 -12.057
  356   1HB   ARG  47          2HB       ARG  47 -10.830   0.089 -11.057
  357   2HB   ARG  47          1HB       ARG  47  -9.371   0.597 -10.227
  358   1HG   ARG  47          1HG       ARG  47  -8.513   1.661 -12.196
  359   2HG   ARG  47          2HG       ARG  47  -9.740   0.907 -13.216
  360   1HD   ARG  47          1HD       ARG  47 -11.397   2.158 -11.559
  361   2HD   ARG  47          2HD       ARG  47 -10.002   3.209 -11.316
  362    HE   ARG  47           HE       ARG  47 -10.269   2.954 -14.092
  363   1HH1  ARG  47          1HH2      ARG  47 -13.107   2.997 -12.489
  364   2HH1  ARG  47          2HH2      ARG  47 -13.499   4.672 -12.692
  365   1HH2  ARG  47          2HH1      ARG  47 -10.496   5.613 -13.950
  366   2HH2  ARG  47          1HH1      ARG  47 -12.174   5.784 -14.343
  367    H    GLN  48           H        GLN  48  -6.981  -1.481 -10.159
  368    HA   GLN  48           HA       GLN  48  -8.035  -3.831  -8.929
  369   1HB   GLN  48          1HB       GLN  48  -5.512  -2.326  -8.790
  370   2HB   GLN  48          2HB       GLN  48  -5.932  -3.214  -7.323
  371   1HG   GLN  48          1HG       GLN  48  -6.278  -5.256  -8.620
  372   2HG   GLN  48          2HG       GLN  48  -5.999  -4.387 -10.121
  373   1HE2  GLN  48          2HE2      GLN  48  -2.825  -5.405 -10.161
  374   2HE2  GLN  48          1HE2      GLN  48  -3.551  -3.952 -10.654
  375    H    VAL  49           H        VAL  49  -9.872  -3.438  -7.952
  376    HA   VAL  49           HA       VAL  49 -10.115  -1.235  -6.014
  377    HB   VAL  49           HB       VAL  49 -12.391  -3.016  -6.475
  378   1HG1  VAL  49          1HG1      VAL  49 -11.894  -0.043  -6.461
  379   2HG1  VAL  49          2HG1      VAL  49 -13.477  -0.743  -6.804
  380   3HG1  VAL  49          3HG1      VAL  49 -12.719  -1.003  -5.233
  381   1HG2  VAL  49          1HG2      VAL  49 -11.235  -1.342  -8.721
  382   2HG2  VAL  49          2HG2      VAL  49 -11.557  -3.068  -8.773
  383   3HG2  VAL  49          3HG2      VAL  49 -12.893  -1.928  -8.711
  384    H    CYS  50           H        CYS  50  -9.558  -1.729  -3.957
  385    HA   CYS  50           HA       CYS  50  -9.394  -4.355  -2.901
  386   1HB   CYS  50          2HB       CYS  50  -8.362  -2.028  -2.133
  387   2HB   CYS  50          1HB       CYS  50  -9.814  -1.981  -1.131
  388    H    ALA  51           H        ALA  51 -10.717  -5.085  -0.974
  389    HA   ALA  51           HA       ALA  51 -13.337  -3.807  -0.700
  390   1HB   ALA  51          2HB       ALA  51 -12.946  -6.428  -2.087
  391   2HB   ALA  51          3HB       ALA  51 -14.370  -6.225  -1.067
  392   3HB   ALA  51          1HB       ALA  51 -14.102  -5.141  -2.430
  393    H    ASN  52           H        ASN  52 -10.837  -4.936   0.868
  394    HA   ASN  52           HA       ASN  52 -10.571  -5.494   3.122
  395   1HB   ASN  52          1HB       ASN  52 -12.727  -4.160   3.355
  396   2HB   ASN  52          2HB       ASN  52 -13.576  -5.704   3.273
  397   1HD2  ASN  52          2HD2      ASN  52 -11.404  -4.686   6.592
  398   2HD2  ASN  52          1HD2      ASN  52 -10.689  -4.396   5.080
  399    HA   PRO  53           HA       PRO  53 -10.806  -9.916   2.566
  400   1HB   PRO  53          1HB       PRO  53  -9.455 -10.503   4.967
  401   2HB   PRO  53          2HB       PRO  53  -8.697 -10.258   3.388
  402   1HG   PRO  53          1HG       PRO  53  -8.665  -8.499   5.732
  403   2HG   PRO  53          2HG       PRO  53  -7.698  -8.399   4.258
  404   1HD   PRO  53          1HD       PRO  53  -9.951  -6.767   4.990
  405   2HD   PRO  53          2HD       PRO  53  -9.019  -6.707   3.483
  406    H    GLU  54           H        GLU  54 -11.532  -8.407   5.721
  407    HA   GLU  54           HA       GLU  54 -13.285 -10.724   6.368
  408   1HB   GLU  54          1HB       GLU  54 -11.427  -9.430   7.907
  409   2HB   GLU  54          2HB       GLU  54 -12.919  -8.636   8.412
  410   1HG   GLU  54          1HG       GLU  54 -13.714 -10.513   9.426
  411   2HG   GLU  54          2HG       GLU  54 -13.126 -11.568   8.141
  412    H    LYS  55           H        LYS  55 -14.261  -8.778   4.446
  413    HA   LYS  55           HA       LYS  55 -16.240  -7.222   6.022
  414   1HB   LYS  55          2HB       LYS  55 -15.040  -6.937   3.399
  415   2HB   LYS  55          1HB       LYS  55 -16.799  -6.889   3.292
  416   1HG   LYS  55          1HG       LYS  55 -16.790  -5.204   5.165
  417   2HG   LYS  55          2HG       LYS  55 -15.031  -5.165   5.051
  418   1HD   LYS  55          1HD       LYS  55 -15.141  -4.382   2.758
  419   2HD   LYS  55          2HD       LYS  55 -16.892  -4.586   2.729
  420   1HE   LYS  55          1HE       LYS  55 -16.196  -2.959   4.987
  421   2HE   LYS  55          2HE       LYS  55 -15.415  -2.295   3.552
  422   1HZ   LYS  55          3HZ       LYS  55 -17.562  -2.376   2.415
  423   2HZ   LYS  55          1HZ       LYS  55 -18.298  -2.947   3.835
  424   3HZ   LYS  55          2HZ       LYS  55 -17.621  -1.390   3.796
  425    H    LYS  56           H        LYS  56 -16.131 -10.283   5.523
  426    HA   LYS  56           HA       LYS  56 -17.711 -11.984   5.301
  427   1HB   LYS  56          1HB       LYS  56 -19.322  -9.558   5.879
  428   2HB   LYS  56          2HB       LYS  56 -20.196 -10.930   5.200
  429   1HG   LYS  56          1HG       LYS  56 -19.766 -12.284   7.030
  430   2HG   LYS  56          2HG       LYS  56 -18.266 -11.447   7.429
  431   1HD   LYS  56          1HD       LYS  56 -19.720  -9.429   8.032
  432   2HD   LYS  56          2HD       LYS  56 -21.101 -10.521   7.938
  433   1HE   LYS  56          1HE       LYS  56 -20.635 -11.385   9.966
  434   2HE   LYS  56          2HE       LYS  56 -18.965 -11.709   9.497
  435   1HZ   LYS  56          3HZ       LYS  56 -19.622  -8.925   9.975
  436   2HZ   LYS  56          1HZ       LYS  56 -19.659  -9.926  11.346
  437   3HZ   LYS  56          2HZ       LYS  56 -18.241  -9.809  10.418
  438    H    TRP  57           H        TRP  57 -19.765  -9.698   3.574
  439    HA   TRP  57           HA       TRP  57 -20.357 -11.283   1.390
  440   1HB   TRP  57          1HB       TRP  57 -20.897  -9.214   0.191
  441   2HB   TRP  57          2HB       TRP  57 -21.430  -9.110   1.874
  442    HD1  TRP  57           HD1      TRP  57 -20.428  -7.135   3.248
  443    HE1  TRP  57           HE1      TRP  57 -18.704  -5.293   2.696
  444    HE3  TRP  57           HE3      TRP  57 -18.762  -8.898  -1.184
  445    HZ2  TRP  57           HZ2      TRP  57 -16.776  -4.704   0.612
  446    HZ3  TRP  57           HZ3      TRP  57 -17.089  -7.682  -2.502
  447    HH2  TRP  57           HH2      TRP  57 -16.111  -5.562  -1.635
  448    H    VAL  58           H        VAL  58 -17.341  -9.581   1.912
  449    HA   VAL  58           HA       VAL  58 -16.386  -9.543  -0.764
  450    HB   VAL  58           HB       VAL  58 -14.072 -10.004   0.453
  451   1HG1  VAL  58          3HG1      VAL  58 -15.297  -7.858  -0.488
  452   2HG1  VAL  58          1HG1      VAL  58 -15.350  -7.439   1.223
  453   3HG1  VAL  58          2HG1      VAL  58 -13.804  -7.743   0.428
  454   1HG2  VAL  58          2HG2      VAL  58 -15.736 -10.436   2.573
  455   2HG2  VAL  58          3HG2      VAL  58 -14.040  -9.968   2.701
  456   3HG2  VAL  58          1HG2      VAL  58 -15.303  -8.742   2.781
  457    H    ARG  59           H        ARG  59 -15.898 -12.108   1.693
  458    HA   ARG  59           HA       ARG  59 -14.609 -13.904  -0.124
  459   1HB   ARG  59          2HB       ARG  59 -16.165 -14.465   2.414
  460   2HB   ARG  59          1HB       ARG  59 -15.180 -15.642   1.579
  461   1HG   ARG  59          1HG       ARG  59 -13.187 -14.301   1.930
  462   2HG   ARG  59          2HG       ARG  59 -14.134 -12.998   2.606
  463   1HD   ARG  59          1HD       ARG  59 -14.922 -15.087   4.184
  464   2HD   ARG  59          2HD       ARG  59 -13.242 -15.517   3.856
  465    HE   ARG  59           HE       ARG  59 -14.041 -12.882   5.033
  466   1HH1  ARG  59          2HH1      ARG  59 -11.146 -14.339   4.032
  467   2HH1  ARG  59          1HH1      ARG  59 -10.915 -15.218   5.507
  468   1HH2  ARG  59          2HH2      ARG  59 -13.028 -13.365   7.359
  469   2HH2  ARG  59          1HH2      ARG  59 -11.366 -13.008   7.027
  470    H    GLU  60           H        GLU  60 -17.976 -13.242   0.621
  471    HA   GLU  60           HA       GLU  60 -19.131 -15.561  -0.582
  472   1HB   GLU  60          2HB       GLU  60 -20.061 -12.841   0.151
  473   2HB   GLU  60          1HB       GLU  60 -20.996 -13.655  -1.081
  474   1HG   GLU  60          2HG       GLU  60 -20.357 -15.490   1.054
  475   2HG   GLU  60          1HG       GLU  60 -21.139 -14.069   1.699
  476    H    TYR  61           H        TYR  61 -17.681 -12.695  -1.920
  477    HA   TYR  61           HA       TYR  61 -18.734 -13.298  -4.622
  478   1HB   TYR  61          1HB       TYR  61 -16.892 -11.069  -3.701
  479   2HB   TYR  61          2HB       TYR  61 -17.632 -11.206  -5.293
  480    HD1  TYR  61           HD1      TYR  61 -20.185 -12.473  -3.405
  481    HD2  TYR  61           HD2      TYR  61 -18.095  -8.728  -3.956
  482    HE1  TYR  61           HE1      TYR  61 -22.181 -11.236  -2.581
  483    HE2  TYR  61           HE2      TYR  61 -20.093  -7.498  -3.113
  484    HH   TYR  61           HH       TYR  61 -22.493  -7.825  -2.885
  485    H    ILE  62           H        ILE  62 -15.774 -13.512  -2.722
  486    HA   ILE  62           HA       ILE  62 -13.949 -13.946  -4.873
  487    HB   ILE  62           HB       ILE  62 -13.999 -14.542  -1.943
  488   1HG1  ILE  62          2HG1      ILE  62 -11.753 -13.383  -2.187
  489   2HG1  ILE  62          1HG1      ILE  62 -12.134 -13.156  -3.875
  490   1HG2  ILE  62          2HG2      ILE  62 -12.316 -16.028  -3.934
  491   2HG2  ILE  62          3HG2      ILE  62 -11.586 -15.544  -2.403
  492   3HG2  ILE  62          1HG2      ILE  62 -13.005 -16.591  -2.412
  493   1HD1  ILE  62          1HD1      ILE  62 -14.312 -12.066  -3.088
  494   2HD1  ILE  62          2HD1      ILE  62 -13.594 -12.047  -1.478
  495   3HD1  ILE  62          3HD1      ILE  62 -12.834 -11.152  -2.794
  496    H    ASN  63           H        ASN  63 -15.669 -16.355  -2.842
  497    HA   ASN  63           HA       ASN  63 -14.903 -18.600  -4.455
  498   1HB   ASN  63          1HB       ASN  63 -17.377 -18.329  -2.731
  499   2HB   ASN  63          2HB       ASN  63 -16.616 -19.819  -3.233
  500   1HD2  ASN  63          1HD2      ASN  63 -16.023 -18.584   0.162
  501   2HD2  ASN  63          2HD2      ASN  63 -16.156 -20.138  -0.506
  502    H    SER  64           H        SER  64 -17.797 -16.523  -4.457
  503    HA   SER  64           HA       SER  64 -19.261 -17.923  -6.449
  504   1HB   SER  64          1HB       SER  64 -19.185 -15.038  -5.580
  505   2HB   SER  64          2HB       SER  64 -20.203 -15.547  -6.928
  506    HG   SER  64           HG       SER  64 -21.427 -16.697  -5.610
  507    H    LEU  65           H        LEU  65 -16.426 -15.934  -6.691
  508    HA   LEU  65           HA       LEU  65 -16.753 -15.448  -9.569
  509   1HB   LEU  65          2HB       LEU  65 -14.608 -14.852  -7.538
  510   2HB   LEU  65          1HB       LEU  65 -14.280 -14.680  -9.262
  511    HG   LEU  65           HG       LEU  65 -16.791 -13.458  -8.200
  512   1HD1  LEU  65          3HD1      LEU  65 -14.652 -12.945  -6.710
  513   2HD1  LEU  65          1HD1      LEU  65 -14.259 -11.864  -8.047
  514   3HD1  LEU  65          2HD1      LEU  65 -15.768 -11.654  -7.158
  515   1HD2  LEU  65          2HD2      LEU  65 -15.297 -13.446 -10.599
  516   2HD2  LEU  65          3HD2      LEU  65 -16.731 -12.487 -10.232
  517   3HD2  LEU  65          1HD2      LEU  65 -15.125 -11.832  -9.912
  518    H    GLU  66           H        GLU  66 -15.705 -16.589 -11.206
  519    HA   GLU  66           HA       GLU  66 -14.462 -19.160 -10.361
  520   1HB   GLU  66          1HB       GLU  66 -16.234 -18.373 -12.501
  521   2HB   GLU  66          2HB       GLU  66 -14.771 -19.091 -13.171
  522   1HG   GLU  66          1HG       GLU  66 -15.048 -21.057 -11.730
  523   2HG   GLU  66          2HG       GLU  66 -16.476 -20.333 -10.991
  524    H    MET  67           H        MET  67 -12.294 -19.433 -10.602
  525    HA   MET  67           HA       MET  67 -10.555 -17.333 -11.385
  526   1HB   MET  67          1HB       MET  67 -10.029 -19.482 -10.044
  527   2HB   MET  67          2HB       MET  67  -9.820 -20.253 -11.617
  528   1HG   MET  67          1HG       MET  67  -7.648 -19.480 -10.939
  529   2HG   MET  67          2HG       MET  67  -8.206 -18.374 -12.194
  530   1HE   MET  67          1HE       MET  67  -6.141 -17.544 -11.210
  531   2HE   MET  67          3HE       MET  67  -6.377 -15.908 -10.597
  532   3HE   MET  67          2HE       MET  67  -5.887 -17.199  -9.499
  533    H    SER  68           H        SER  68 -10.896 -16.465 -13.423
  534    HA   SER  68           HA       SER  68 -11.228 -18.246 -15.745
  535   1HB   SER  68          1HB       SER  68 -11.657 -15.413 -15.147
  536   2HB   SER  68          2HB       SER  68 -10.884 -15.665 -16.712
  537    HG   SER  68           HG       SER  68 -12.638 -16.558 -17.447
  538    H    SER   1           H        SER   1  -6.881  11.552  -9.986
  539    HA   SER   1           HA       SER   1  -8.256   9.076 -10.640
  540   1HB   SER   1          1HB       SER   1  -5.260   9.029 -10.175
  541   2HB   SER   1          2HB       SER   1  -6.292   7.601 -10.110
  542    HG   SER   1           HG       SER   1  -6.142   7.529 -12.182
  543    HA   PRO   2           HA       PRO   2  -8.448  10.547  -6.257
  544   1HB   PRO   2          1HB       PRO   2 -11.074   9.330  -6.193
  545   2HB   PRO   2          2HB       PRO   2 -10.664  11.047  -6.088
  546   1HG   PRO   2          1HG       PRO   2 -11.854   9.655  -8.313
  547   2HG   PRO   2          2HG       PRO   2 -11.414  11.364  -8.221
  548   1HD   PRO   2          1HD       PRO   2 -10.109   9.280  -9.729
  549   2HD   PRO   2          2HD       PRO   2  -9.667  10.996  -9.636
  550    H    TYR   3           H        TYR   3  -7.399   9.155  -4.900
  551    HA   TYR   3           HA       TYR   3  -7.697   6.245  -5.268
  552   1HB   TYR   3          1HB       TYR   3  -5.950   7.903  -3.427
  553   2HB   TYR   3          2HB       TYR   3  -5.923   6.141  -3.492
  554    HD1  TYR   3           HD1      TYR   3  -6.063   5.383  -6.228
  555    HD2  TYR   3           HD2      TYR   3  -4.098   8.827  -4.518
  556    HE1  TYR   3           HE1      TYR   3  -4.527   5.480  -8.189
  557    HE2  TYR   3           HE2      TYR   3  -2.561   8.923  -6.480
  558    HH   TYR   3           HH       TYR   3  -3.126   7.209  -9.348
  559    H    SER   4           H        SER   4  -9.475   5.365  -4.318
  560    HA   SER   4           HA       SER   4 -10.124   6.239  -1.529
  561   1HB   SER   4          1HB       SER   4 -11.841   5.744  -3.900
  562   2HB   SER   4          2HB       SER   4 -12.441   5.102  -2.370
  563    HG   SER   4           HG       SER   4 -12.974   7.369  -2.954
  564    H    SER   5           H        SER   5 -11.216   3.490  -3.510
  565    HA   SER   5           HA       SER   5  -9.938   1.668  -1.512
  566   1HB   SER   5          1HB       SER   5 -11.983   0.146  -2.163
  567   2HB   SER   5          2HB       SER   5 -12.197   1.419  -0.962
  568    HG   SER   5           HG       SER   5 -12.798   1.564  -3.728
  569    H    ASP   6           H        ASP   6  -8.175   1.544  -3.098
  570    HA   ASP   6           HA       ASP   6  -8.693  -0.534  -5.126
  571   1HB   ASP   6          2HB       ASP   6  -7.790   0.763  -6.979
  572   2HB   ASP   6          1HB       ASP   6  -9.145   1.644  -6.279
  573    H    THR   7           H        THR   7  -6.172  -0.105  -6.467
  574    HA   THR   7           HA       THR   7  -4.495  -1.392  -4.478
  575    HB   THR   7           HB       THR   7  -4.368  -2.213  -6.744
  576    HG1  THR   7           HG1      THR   7  -2.329  -2.444  -6.412
  577   1HG2  THR   7          3HG2      THR   7  -3.902   0.697  -7.378
  578   2HG2  THR   7          1HG2      THR   7  -3.378  -0.564  -8.494
  579   3HG2  THR   7          2HG2      THR   7  -5.085  -0.408  -8.079
  580    H    THR   8           H        THR   8  -2.096  -0.600  -4.388
  581    HA   THR   8           HA       THR   8  -1.842   2.342  -4.515
  582    HB   THR   8           HB       THR   8  -1.185   0.910  -1.936
  583    HG1  THR   8           HG1      THR   8  -3.359   0.654  -2.127
  584   1HG2  THR   8          3HG2      THR   8  -0.720   3.495  -2.958
  585   2HG2  THR   8          1HG2      THR   8  -2.022   3.678  -1.783
  586   3HG2  THR   8          2HG2      THR   8  -0.489   2.955  -1.296
  587    HA   PRO   9           HA       PRO   9   1.948   0.362  -6.016
  588   1HB   PRO   9          1HB       PRO   9   2.823   3.008  -6.784
  589   2HB   PRO   9          2HB       PRO   9   2.306   1.684  -7.835
  590   1HG   PRO   9          1HG       PRO   9   0.858   4.104  -7.191
  591   2HG   PRO   9          2HG       PRO   9   0.344   2.790  -8.249
  592   1HD   PRO   9          1HD       PRO   9  -0.661   3.442  -5.657
  593   2HD   PRO   9          2HD       PRO   9  -1.139   2.090  -6.701
  594    H    CYS  10           H        CYS  10   2.978  -0.102  -4.062
  595    HA   CYS  10           HA       CYS  10   4.557   2.128  -2.868
  596   1HB   CYS  10          2HB       CYS  10   2.559   0.375  -1.572
  597   2HB   CYS  10          1HB       CYS  10   4.089   0.524  -0.709
  598    H    CYS  11           H        CYS  11   6.141   0.996  -1.184
  599    HA   CYS  11           HA       CYS  11   7.315  -1.321  -2.635
  600   1HB   CYS  11          1HB       CYS  11   9.134  -0.064  -2.958
  601   2HB   CYS  11          2HB       CYS  11   8.435   1.264  -2.056
  602    H    PHE  12           H        PHE  12   8.544  -2.829  -1.165
  603    HA   PHE  12           HA       PHE  12   7.287  -2.855   1.549
  604   1HB   PHE  12          1HB       PHE  12   6.762  -4.806   0.096
  605   2HB   PHE  12          2HB       PHE  12   8.469  -5.163  -0.015
  606    HD1  PHE  12           HD1      PHE  12   5.559  -4.988   2.276
  607    HD2  PHE  12           HD2      PHE  12   9.694  -6.151   1.838
  608    HE1  PHE  12           HE1      PHE  12   5.445  -6.215   4.443
  609    HE2  PHE  12           HE2      PHE  12   9.580  -7.375   4.007
  610    HZ   PHE  12           HZ       PHE  12   7.455  -7.406   5.309
  611    H    ALA  13           H        ALA  13  10.230  -4.332   0.155
  612    HA   ALA  13           HA       ALA  13  11.712  -3.307   2.537
  613   1HB   ALA  13          3HB       ALA  13  11.830  -5.814   0.963
  614   2HB   ALA  13          1HB       ALA  13  13.391  -5.142   1.435
  615   3HB   ALA  13          2HB       ALA  13  12.193  -5.540   2.666
  616    H    TYR  14           H        TYR  14  13.750  -2.319   2.218
  617    HA   TYR  14           HA       TYR  14  13.960  -1.048  -0.427
  618   1HB   TYR  14          2HB       TYR  14  15.876  -0.422   1.786
  619   2HB   TYR  14          1HB       TYR  14  15.189   0.649   0.570
  620    HD1  TYR  14           HD1      TYR  14  12.728   1.310   0.737
  621    HD2  TYR  14           HD2      TYR  14  14.840  -0.698   3.922
  622    HE1  TYR  14           HE1      TYR  14  10.948   1.990   2.346
  623    HE2  TYR  14           HE2      TYR  14  13.066  -0.012   5.533
  624    HH   TYR  14           HH       TYR  14  10.875   2.372   4.959
  625    H    ILE  15           H        ILE  15  15.829  -1.211  -1.741
  626    HA   ILE  15           HA       ILE  15  17.195  -3.718  -1.706
  627    HB   ILE  15           HB       ILE  15  16.935  -2.352  -3.752
  628   1HG1  ILE  15          1HG1      ILE  15  19.701  -2.272  -4.033
  629   2HG1  ILE  15          2HG1      ILE  15  19.448  -3.491  -2.784
  630   1HG2  ILE  15          1HG2      ILE  15  17.871  -0.293  -2.079
  631   2HG2  ILE  15          2HG2      ILE  15  19.152  -0.547  -3.265
  632   3HG2  ILE  15          3HG2      ILE  15  17.514  -0.174  -3.802
  633   1HD1  ILE  15          3HD1      ILE  15  17.663  -3.581  -5.175
  634   2HD1  ILE  15          1HD1      ILE  15  19.335  -4.102  -5.389
  635   3HD1  ILE  15          2HD1      ILE  15  18.305  -4.905  -4.203
  636    H    ALA  16           H        ALA  16  19.082  -4.334  -0.712
  637    HA   ALA  16           HA       ALA  16  20.276  -2.434   1.204
  638   1HB   ALA  16          1HB       ALA  16  19.736  -4.912   1.677
  639   2HB   ALA  16          2HB       ALA  16  21.170  -5.276   0.717
  640   3HB   ALA  16          3HB       ALA  16  21.315  -4.321   2.193
  641    H    ARG  17           H        ARG  17  20.946  -1.258  -0.980
  642    HA   ARG  17           HA       ARG  17  23.751  -1.292  -1.178
  643   1HB   ARG  17          1HB       ARG  17  22.587  -3.473  -2.571
  644   2HB   ARG  17          2HB       ARG  17  23.143  -2.341  -3.779
  645   1HG   ARG  17          1HG       ARG  17  25.025  -2.745  -1.549
  646   2HG   ARG  17          2HG       ARG  17  24.746  -4.181  -2.534
  647   1HD   ARG  17          1HD       ARG  17  25.044  -2.453  -4.530
  648   2HD   ARG  17          2HD       ARG  17  25.945  -1.549  -3.312
  649    HE   ARG  17           HE       ARG  17  27.093  -3.985  -3.066
  650   1HH1  ARG  17          2HH2      ARG  17  25.857  -3.680  -6.262
  651   2HH1  ARG  17          1HH2      ARG  17  27.200  -4.745  -6.505
  652   1HH2  ARG  17          2HH1      ARG  17  28.966  -2.422  -4.377
  653   2HH2  ARG  17          1HH1      ARG  17  29.104  -3.193  -5.922
  654    HA   PRO  18           HA       PRO  18  22.197   2.487  -3.008
  655   1HB   PRO  18          2HB       PRO  18  24.850   3.210  -3.833
  656   2HB   PRO  18          1HB       PRO  18  23.931   3.864  -2.507
  657   1HG   PRO  18          2HG       PRO  18  26.185   2.068  -2.371
  658   2HG   PRO  18          1HG       PRO  18  25.282   2.779  -1.028
  659   1HD   PRO  18          2HD       PRO  18  25.228   0.055  -1.894
  660   2HD   PRO  18          1HD       PRO  18  24.253   0.787  -0.632
  661    H    LEU  19           H        LEU  19  21.120   1.696  -4.833
  662    HA   LEU  19           HA       LEU  19  22.279   0.382  -7.048
  663   1HB   LEU  19          1HB       LEU  19  19.955   2.312  -7.133
  664   2HB   LEU  19          2HB       LEU  19  20.284   1.040  -8.281
  665    HG   LEU  19           HG       LEU  19  19.545   0.709  -5.368
  666   1HD1  LEU  19          3HD1      LEU  19  17.775   1.242  -7.166
  667   2HD1  LEU  19          1HD1      LEU  19  18.115  -0.370  -7.795
  668   3HD1  LEU  19          2HD1      LEU  19  17.496  -0.177  -6.155
  669   1HD2  LEU  19          1HD2      LEU  19  20.846  -1.108  -7.303
  670   2HD2  LEU  19          2HD2      LEU  19  20.809  -1.185  -5.541
  671   3HD2  LEU  19          3HD2      LEU  19  19.444  -1.792  -6.481
  672    HA   PRO  20           HA       PRO  20  24.828   3.803  -8.467
  673   1HB   PRO  20          1HB       PRO  20  25.113   2.435 -11.015
  674   2HB   PRO  20          2HB       PRO  20  26.331   2.674  -9.756
  675   1HG   PRO  20          1HG       PRO  20  24.965   0.236 -10.420
  676   2HG   PRO  20          2HG       PRO  20  26.125   0.492  -9.113
  677   1HD   PRO  20          1HD       PRO  20  23.275   0.095  -8.900
  678   2HD   PRO  20          2HD       PRO  20  24.440   0.350  -7.586
  679    H    ARG  21           H        ARG  21  23.892   5.637  -9.259
  680    HA   ARG  21           HA       ARG  21  21.371   5.805 -10.467
  681   1HB   ARG  21          2HB       ARG  21  22.818   7.699  -9.520
  682   2HB   ARG  21          1HB       ARG  21  23.609   7.737 -11.096
  683   1HG   ARG  21          2HG       ARG  21  20.625   7.756 -11.063
  684   2HG   ARG  21          1HG       ARG  21  21.448   9.233 -10.561
  685   1HD   ARG  21          1HD       ARG  21  22.732   8.185 -12.909
  686   2HD   ARG  21          2HD       ARG  21  21.015   8.309 -13.208
  687    HE   ARG  21           HE       ARG  21  22.324  10.675 -12.015
  688   1HH1  ARG  21          2HH2      ARG  21  19.664  10.379 -14.306
  689   2HH1  ARG  21          1HH2      ARG  21  20.820   9.648 -15.367
  690   1HH2  ARG  21          1HH1      ARG  21  23.176  11.802 -14.407
  691   2HH2  ARG  21          2HH1      ARG  21  21.658  12.635 -14.425
  692    H    ALA  22           H        ALA  22  24.426   4.982 -11.926
  693    HA   ALA  22           HA       ALA  22  23.723   5.575 -14.649
  694   1HB   ALA  22          3HB       ALA  22  25.868   4.154 -13.235
  695   2HB   ALA  22          1HB       ALA  22  25.477   3.444 -14.802
  696   3HB   ALA  22          2HB       ALA  22  25.948   5.140 -14.695
  697    H    HIS  23           H        HIS  23  23.494   2.580 -12.713
  698    HA   HIS  23           HA       HIS  23  22.261   1.112 -14.905
  699   1HB   HIS  23          2HB       HIS  23  22.180   0.392 -11.966
  700   2HB   HIS  23          1HB       HIS  23  22.020  -0.693 -13.344
  701    HD2  HIS  23           HD2      HIS  23  24.866   1.517 -14.314
  702    HE1  HIS  23           HE1      HIS  23  26.668  -1.614 -12.118
  703    HE2  HIS  23           HE2      HIS  23  27.108   0.337 -13.690
  704    H    ILE  24           H        ILE  24  21.112   3.308 -12.491
  705    HA   ILE  24           HA       ILE  24  18.380   2.240 -12.571
  706    HB   ILE  24           HB       ILE  24  19.402   4.811 -11.376
  707   1HG1  ILE  24          2HG1      ILE  24  18.756   2.155 -10.071
  708   2HG1  ILE  24          1HG1      ILE  24  20.382   2.782 -10.338
  709   1HG2  ILE  24          2HG2      ILE  24  16.745   3.405 -11.340
  710   2HG2  ILE  24          3HG2      ILE  24  17.209   4.485 -10.029
  711   3HG2  ILE  24          1HG2      ILE  24  17.087   5.102 -11.675
  712   1HD1  ILE  24          2HD1      ILE  24  18.813   4.811  -9.043
  713   2HD1  ILE  24          3HD1      ILE  24  18.642   3.302  -8.143
  714   3HD1  ILE  24          1HD1      ILE  24  20.244   3.979  -8.435
  715    H    LYS  25           H        LYS  25  16.568   3.674 -13.269
  716    HA   LYS  25           HA       LYS  25  17.371   5.413 -15.567
  717   1HB   LYS  25          1HB       LYS  25  15.661   3.119 -15.471
  718   2HB   LYS  25          2HB       LYS  25  14.674   4.508 -15.821
  719   1HG   LYS  25          1HG       LYS  25  16.178   5.147 -17.664
  720   2HG   LYS  25          2HG       LYS  25  17.184   3.738 -17.325
  721   1HD   LYS  25          1HD       LYS  25  15.441   2.228 -17.948
  722   2HD   LYS  25          2HD       LYS  25  14.230   3.509 -17.938
  723   1HE   LYS  25          1HE       LYS  25  16.594   3.418 -19.835
  724   2HE   LYS  25          2HE       LYS  25  14.972   2.860 -20.247
  725   1HZ   LYS  25          2HZ       LYS  25  14.448   5.283 -19.271
  726   2HZ   LYS  25          3HZ       LYS  25  15.983   5.560 -19.946
  727   3HZ   LYS  25          1HZ       LYS  25  14.720   4.971 -20.918
  728    H    GLU  26           H        GLU  26  15.317   4.997 -12.753
  729    HA   GLU  26           HA       GLU  26  14.830   7.835 -12.549
  730   1HB   GLU  26          1HB       GLU  26  12.180   7.016 -12.601
  731   2HB   GLU  26          2HB       GLU  26  12.964   7.910 -13.856
  732   1HG   GLU  26          2HG       GLU  26  13.374   5.000 -14.015
  733   2HG   GLU  26          1HG       GLU  26  11.720   5.504 -14.178
  734    H    TYR  27           H        TYR  27  12.487   7.633 -10.939
  735    HA   TYR  27           HA       TYR  27  12.774   5.507  -9.011
  736   1HB   TYR  27          1HB       TYR  27  13.399   6.940  -7.106
  737   2HB   TYR  27          2HB       TYR  27  14.665   6.915  -8.304
  738    HD1  TYR  27           HD1      TYR  27  15.127   8.879  -9.726
  739    HD2  TYR  27           HD2      TYR  27  12.004   8.923  -6.745
  740    HE1  TYR  27           HE1      TYR  27  14.981  11.360  -9.917
  741    HE2  TYR  27           HE2      TYR  27  11.856  11.403  -6.937
  742    HH   TYR  27           HH       TYR  27  12.453  13.144  -8.862
  743    H    PHE  28           H        PHE  28  10.840   5.389  -7.832
  744    HA   PHE  28           HA       PHE  28   8.982   7.664  -8.247
  745   1HB   PHE  28          1HB       PHE  28   8.141   6.038  -9.741
  746   2HB   PHE  28          2HB       PHE  28   8.514   4.710  -8.647
  747    HD1  PHE  28           HD1      PHE  28   7.084   4.212  -6.711
  748    HD2  PHE  28           HD2      PHE  28   6.109   7.401  -9.450
  749    HE1  PHE  28           HE1      PHE  28   4.862   4.450  -5.631
  750    HE2  PHE  28           HE2      PHE  28   3.851   7.601  -8.408
  751    HZ   PHE  28           HZ       PHE  28   3.224   6.123  -6.499
  752    H    TYR  29           H        TYR  29   8.886   8.536  -6.203
  753    HA   TYR  29           HA       TYR  29   9.190   7.030  -3.797
  754   1HB   TYR  29          1HB       TYR  29   9.548   9.414  -3.749
  755   2HB   TYR  29          2HB       TYR  29   7.925   9.721  -4.352
  756    HD1  TYR  29           HD2      TYR  29   5.955   9.480  -2.910
  757    HD2  TYR  29           HD1      TYR  29   9.945   8.812  -1.407
  758    HE1  TYR  29           HE2      TYR  29   5.102   9.653  -0.576
  759    HE2  TYR  29           HE1      TYR  29   9.098   9.009   0.930
  760    HH   TYR  29           HH       TYR  29   7.243   9.113   2.221
  761    H    THR  30           H        THR  30   7.753   5.903  -2.632
  762    HA   THR  30           HA       THR  30   5.458   4.731  -3.624
  763    HB   THR  30           HB       THR  30   4.727   4.487  -1.200
  764    HG1  THR  30           HG1      THR  30   5.508   5.975   0.038
  765   1HG2  THR  30          1HG2      THR  30   6.501   3.090  -2.529
  766   2HG2  THR  30          2HG2      THR  30   7.663   3.894  -1.473
  767   3HG2  THR  30          3HG2      THR  30   6.388   2.891  -0.780
  768    H    SER  31           H        SER  31   3.126   5.063  -2.928
  769    HA   SER  31           HA       SER  31   2.156   7.585  -3.779
  770   1HB   SER  31          1HB       SER  31   0.715   5.621  -3.784
  771   2HB   SER  31          2HB       SER  31   0.829   5.493  -2.028
  772    HG   SER  31           HG       SER  31  -1.085   6.577  -2.865
  773    H    GLY  32           H        GLY  32   3.210   6.481  -0.636
  774   1HA   GLY  32          1HA       GLY  32   3.902   8.033   1.083
  775   2HA   GLY  32          2HA       GLY  32   2.853   9.240   0.384
  776    H    LYS  33           H        LYS  33   2.102   5.870   1.284
  777    HA   LYS  33           HA       LYS  33   0.783   6.436   3.732
  778   1HB   LYS  33          2HB       LYS  33  -1.603   6.306   2.917
  779   2HB   LYS  33          1HB       LYS  33  -0.773   7.800   2.487
  780   1HG   LYS  33          1HG       LYS  33  -0.231   6.805   0.259
  781   2HG   LYS  33          2HG       LYS  33  -1.186   5.388   0.695
  782   1HD   LYS  33          2HD       LYS  33  -2.343   8.172   0.795
  783   2HD   LYS  33          1HD       LYS  33  -2.371   7.221  -0.670
  784   1HE   LYS  33          1HE       LYS  33  -3.244   5.565   1.500
  785   2HE   LYS  33          2HE       LYS  33  -4.163   7.071   1.533
  786   1HZ   LYS  33          1HZ       LYS  33  -3.749   5.582  -0.983
  787   2HZ   LYS  33          2HZ       LYS  33  -5.020   5.186   0.072
  788   3HZ   LYS  33          3HZ       LYS  33  -4.940   6.737  -0.616
  789    H    CYS  34           H        CYS  34   2.222   4.340   3.467
  790    HA   CYS  34           HA       CYS  34   0.343   2.097   3.457
  791   1HB   CYS  34          2HB       CYS  34   1.678   0.771   1.806
  792   2HB   CYS  34          1HB       CYS  34   0.845   2.149   1.088
  793    H    SER  35           H        SER  35   2.285   3.498   5.252
  794    HA   SER  35           HA       SER  35   3.847   2.922   6.901
  795   1HB   SER  35          1HB       SER  35   3.288   0.020   6.430
  796   2HB   SER  35          2HB       SER  35   3.436   0.901   7.951
  797    HG   SER  35           HG       SER  35   1.244   0.476   6.360
  798    H    ASN  36           H        ASN  36   4.861   3.121   4.165
  799    HA   ASN  36           HA       ASN  36   7.436   1.895   4.590
  800   1HB   ASN  36          1HB       ASN  36   5.426   0.398   3.051
  801   2HB   ASN  36          2HB       ASN  36   6.950   0.623   2.193
  802   1HD2  ASN  36          2HD2      ASN  36   6.694  -2.375   4.409
  803   2HD2  ASN  36          1HD2      ASN  36   5.538  -1.248   4.930
  804    HA   PRO  37           HA       PRO  37   6.923   5.438   1.504
  805   1HB   PRO  37          1HB       PRO  37   8.587   7.085   3.161
  806   2HB   PRO  37          2HB       PRO  37   6.865   7.302   2.823
  807   1HG   PRO  37          2HG       PRO  37   8.106   6.416   5.290
  808   2HG   PRO  37          1HG       PRO  37   6.393   6.715   4.977
  809   1HD   PRO  37          2HD       PRO  37   7.701   4.173   5.283
  810   2HD   PRO  37          1HD       PRO  37   6.005   4.477   4.943
  811    H    ALA  38           H        ALA  38   8.666   5.987   0.061
  812    HA   ALA  38           HA       ALA  38  11.442   5.756   0.647
  813   1HB   ALA  38          3HB       ALA  38  10.737   3.313   0.931
  814   2HB   ALA  38          1HB       ALA  38  10.378   3.306  -0.793
  815   3HB   ALA  38          2HB       ALA  38  12.026   3.594  -0.234
  816    H    VAL  39           H        VAL  39  12.340   4.666  -1.821
  817    HA   VAL  39           HA       VAL  39  10.933   6.244  -3.902
  818    HB   VAL  39           HB       VAL  39  13.288   6.865  -4.771
  819   1HG1  VAL  39          3HG1      VAL  39  11.739   8.061  -2.545
  820   2HG1  VAL  39          1HG1      VAL  39  13.367   8.695  -2.783
  821   3HG1  VAL  39          2HG1      VAL  39  12.197   8.753  -4.103
  822   1HG2  VAL  39          3HG2      VAL  39  13.892   6.058  -1.922
  823   2HG2  VAL  39          1HG2      VAL  39  14.697   5.528  -3.400
  824   3HG2  VAL  39          2HG2      VAL  39  14.914   7.181  -2.820
  825    H    VAL  40           H        VAL  40  10.602   4.910  -5.543
  826    HA   VAL  40           HA       VAL  40  12.000   2.330  -5.499
  827    HB   VAL  40           HB       VAL  40   9.778   3.226  -7.305
  828   1HG1  VAL  40          2HG1      VAL  40  11.322   0.906  -7.198
  829   2HG1  VAL  40          3HG1      VAL  40   9.768   0.471  -6.487
  830   3HG1  VAL  40          1HG1      VAL  40   9.838   1.158  -8.106
  831   1HG2  VAL  40          1HG2      VAL  40   9.701   2.989  -4.517
  832   2HG2  VAL  40          2HG2      VAL  40   8.359   3.213  -5.633
  833   3HG2  VAL  40          3HG2      VAL  40   8.862   1.587  -5.178
  834    H    PHE  41           H        PHE  41  14.026   2.792  -6.472
  835    HA   PHE  41           HA       PHE  41  14.285   4.302  -8.850
  836   1HB   PHE  41          2HB       PHE  41  15.967   2.083  -7.669
  837   2HB   PHE  41          1HB       PHE  41  16.438   2.901  -9.132
  838    HD1  PHE  41           HD1      PHE  41  16.147   5.658  -8.874
  839    HD2  PHE  41           HD2      PHE  41  16.975   2.822  -5.732
  840    HE1  PHE  41           HE1      PHE  41  17.197   7.469  -7.515
  841    HE2  PHE  41           HE2      PHE  41  18.003   4.631  -4.366
  842    HZ   PHE  41           HZ       PHE  41  18.131   6.952  -5.261
  843    H    VAL  42           H        VAL  42  13.388   3.948 -10.651
  844    HA   VAL  42           HA       VAL  42  12.633   1.217 -11.507
  845    HB   VAL  42           HB       VAL  42  12.089   2.990 -13.609
  846   1HG1  VAL  42          1HG2      VAL  42  10.505   1.845 -11.319
  847   2HG1  VAL  42          2HG2      VAL  42   9.721   2.729 -12.632
  848   3HG1  VAL  42          3HG2      VAL  42  10.599   1.239 -12.977
  849   1HG2  VAL  42          3HG1      VAL  42  12.515   4.904 -12.077
  850   2HG2  VAL  42          1HG1      VAL  42  10.840   4.823 -12.615
  851   3HG2  VAL  42          2HG1      VAL  42  11.277   4.276 -10.997
  852    H    THR  43           H        THR  43  14.773   0.365 -11.848
  853    HA   THR  43           HA       THR  43  16.808   1.811 -13.318
  854    HB   THR  43           HB       THR  43  18.212  -0.031 -12.939
  855    HG1  THR  43           HG1      THR  43  17.507  -1.952 -13.325
  856   1HG2  THR  43          1HG2      THR  43  17.133   1.060 -10.856
  857   2HG2  THR  43          2HG2      THR  43  16.187  -0.424 -10.733
  858   3HG2  THR  43          3HG2      THR  43  17.948  -0.489 -10.634
  859    H    ARG  44           H        ARG  44  18.007  -0.065 -14.914
  860    HA   ARG  44           HA       ARG  44  16.969   0.464 -17.422
  861   1HB   ARG  44          2HB       ARG  44  18.170  -1.736 -18.130
  862   2HB   ARG  44          1HB       ARG  44  19.136  -0.434 -17.443
  863   1HG   ARG  44          1HG       ARG  44  18.234  -1.964 -15.242
  864   2HG   ARG  44          2HG       ARG  44  18.757  -3.124 -16.459
  865   1HD   ARG  44          1HD       ARG  44  20.896  -1.842 -16.686
  866   2HD   ARG  44          2HD       ARG  44  20.373  -0.805 -15.359
  867    HE   ARG  44           HE       ARG  44  20.478  -2.784 -13.880
  868   1HH1  ARG  44          1HH1      ARG  44  21.138  -4.457 -16.947
  869   2HH1  ARG  44          2HH1      ARG  44  21.233  -5.591 -15.640
  870   1HH2  ARG  44          2HH2      ARG  44  23.467  -2.834 -14.928
  871   2HH2  ARG  44          1HH2      ARG  44  23.276  -4.393 -14.196
  872    H    LYS  45           H        LYS  45  16.554  -2.734 -15.811
  873    HA   LYS  45           HA       LYS  45  14.465  -3.600 -17.576
  874   1HB   LYS  45          2HB       LYS  45  15.313  -4.354 -14.788
  875   2HB   LYS  45          1HB       LYS  45  13.788  -4.968 -15.426
  876   1HG   LYS  45          1HG       LYS  45  14.937  -5.959 -17.334
  877   2HG   LYS  45          2HG       LYS  45  16.467  -5.250 -16.819
  878   1HD   LYS  45          1HD       LYS  45  16.077  -6.535 -14.601
  879   2HD   LYS  45          2HD       LYS  45  14.886  -7.463 -15.514
  880   1HE   LYS  45          1HE       LYS  45  17.448  -7.132 -16.919
  881   2HE   LYS  45          2HE       LYS  45  17.583  -8.031 -15.408
  882   1HZ   LYS  45          3HZ       LYS  45  15.414  -8.662 -17.291
  883   2HZ   LYS  45          1HZ       LYS  45  16.975  -9.264 -17.583
  884   3HZ   LYS  45          2HZ       LYS  45  16.166  -9.663 -16.143
  885    H    ASN  46           H        ASN  46  14.647  -1.511 -14.823
  886    HA   ASN  46           HA       ASN  46  13.203   0.091 -14.012
  887   1HB   ASN  46          1HB       ASN  46  12.237  -0.444 -16.651
  888   2HB   ASN  46          2HB       ASN  46  10.849  -0.355 -15.599
  889   1HD2  ASN  46          1HD2      ASN  46  11.097   3.109 -16.283
  890   2HD2  ASN  46          2HD2      ASN  46  10.064   1.813 -15.913
  891    H    ARG  47           H        ARG  47  13.080  -2.918 -13.400
  892    HA   ARG  47           HA       ARG  47  10.406  -3.479 -12.504
  893   1HB   ARG  47          2HB       ARG  47  13.151  -4.285 -11.564
  894   2HB   ARG  47          1HB       ARG  47  11.752  -4.666 -10.575
  895   1HG   ARG  47          1HG       ARG  47  10.773  -5.995 -12.315
  896   2HG   ARG  47          2HG       ARG  47  11.927  -5.397 -13.508
  897   1HD   ARG  47          1HD       ARG  47  13.695  -6.409 -11.804
  898   2HD   ARG  47          2HD       ARG  47  12.324  -7.408 -11.324
  899    HE   ARG  47           HE       ARG  47  12.405  -7.547 -14.121
  900   1HH1  ARG  47          1HH2      ARG  47  15.343  -7.378 -12.721
  901   2HH1  ARG  47          2HH2      ARG  47  15.729  -9.067 -12.712
  902   1HH2  ARG  47          2HH1      ARG  47  12.652 -10.162 -13.623
  903   2HH2  ARG  47          1HH1      ARG  47  14.301 -10.393 -14.100
  904    H    GLN  48           H        GLN  48   9.366  -2.595 -10.626
  905    HA   GLN  48           HA       GLN  48  10.497  -0.098  -9.813
  906   1HB   GLN  48          1HB       GLN  48   7.994  -1.551  -9.254
  907   2HB   GLN  48          2HB       GLN  48   8.528  -0.427  -7.998
  908   1HG   GLN  48          1HG       GLN  48   8.742   1.364  -9.645
  909   2HG   GLN  48          2HG       GLN  48   8.365   0.256 -10.954
  910   1HE2  GLN  48          2HE2      GLN  48   5.198   1.305 -10.919
  911   2HE2  GLN  48          1HE2      GLN  48   5.893  -0.206 -11.257
  912    H    VAL  49           H        VAL  49  12.392  -0.395  -8.934
  913    HA   VAL  49           HA       VAL  49  12.790  -2.324  -6.752
  914    HB   VAL  49           HB       VAL  49  14.976  -0.549  -7.584
  915   1HG1  VAL  49          1HG1      VAL  49  14.593  -3.498  -7.120
  916   2HG1  VAL  49          2HG1      VAL  49  16.122  -2.809  -7.672
  917   3HG1  VAL  49          3HG1      VAL  49  15.464  -2.345  -6.103
  918   1HG2  VAL  49          1HG2      VAL  49  13.732  -2.551  -9.495
  919   2HG2  VAL  49          2HG2      VAL  49  14.026  -0.847  -9.817
  920   3HG2  VAL  49          3HG2      VAL  49  15.380  -1.960  -9.669
  921    H    CYS  50           H        CYS  50  12.614  -1.653  -4.663
  922    HA   CYS  50           HA       CYS  50  12.304   1.157  -4.042
  923   1HB   CYS  50          2HB       CYS  50  11.309  -0.996  -2.875
  924   2HB   CYS  50          1HB       CYS  50  12.812  -0.932  -1.957
  925    H    ALA  51           H        ALA  51  13.711   2.207  -2.326
  926    HA   ALA  51           HA       ALA  51  16.369   1.007  -2.016
  927   1HB   ALA  51          2HB       ALA  51  15.836   3.389  -3.744
  928   2HB   ALA  51          3HB       ALA  51  17.325   3.350  -2.801
  929   3HB   ALA  51          1HB       ALA  51  16.992   2.075  -3.967
  930    H    ASN  52           H        ASN  52  13.944   2.345  -0.479
  931    HA   ASN  52           HA       ASN  52  13.814   3.228   1.683
  932   1HB   ASN  52          1HB       ASN  52  15.987   1.931   1.968
  933   2HB   ASN  52          2HB       ASN  52  16.821   3.445   1.616
  934   1HD2  ASN  52          2HD2      ASN  52  14.876   2.907   5.177
  935   2HD2  ASN  52          1HD2      ASN  52  14.065   2.411   3.771
  936    HA   PRO  53           HA       PRO  53  13.996   7.524   0.498
  937   1HB   PRO  53          1HB       PRO  53  12.804   8.452   2.876
  938   2HB   PRO  53          2HB       PRO  53  11.944   7.991   1.402
  939   1HG   PRO  53          1HG       PRO  53  12.074   6.580   3.967
  940   2HG   PRO  53          2HG       PRO  53  11.013   6.277   2.588
  941   1HD   PRO  53          1HD       PRO  53  13.319   4.756   3.396
  942   2HD   PRO  53          2HD       PRO  53  12.289   4.483   1.978
  943    H    GLU  54           H        GLU  54  14.936   6.469   3.778
  944    HA   GLU  54           HA       GLU  54  16.719   8.848   3.976
  945   1HB   GLU  54          1HB       GLU  54  14.972   7.789   5.801
  946   2HB   GLU  54          2HB       GLU  54  16.498   7.068   6.312
  947   1HG   GLU  54          1HG       GLU  54  17.351   9.063   6.998
  948   2HG   GLU  54          2HG       GLU  54  16.673   9.931   5.620
  949    H    LYS  55           H        LYS  55  17.572   6.646   2.285
  950    HA   LYS  55           HA       LYS  55  19.661   5.317   3.927
  951   1HB   LYS  55          2HB       LYS  55  18.287   4.672   1.456
  952   2HB   LYS  55          1HB       LYS  55  20.034   4.602   1.238
  953   1HG   LYS  55          1HG       LYS  55  20.161   3.197   3.326
  954   2HG   LYS  55          2HG       LYS  55  18.399   3.149   3.337
  955   1HD   LYS  55          1HD       LYS  55  18.358   2.053   1.173
  956   2HD   LYS  55          2HD       LYS  55  20.102   2.242   0.999
  957   1HE   LYS  55          1HE       LYS  55  19.567   0.951   3.504
  958   2HE   LYS  55          2HE       LYS  55  18.695   0.096   2.231
  959   1HZ   LYS  55          3HZ       LYS  55  20.761   0.009   0.953
  960   2HZ   LYS  55          1HZ       LYS  55  21.588   0.770   2.227
  961   3HZ   LYS  55          2HZ       LYS  55  20.917  -0.775   2.451
  962    H    LYS  56           H        LYS  56  19.503   8.278   3.011
  963    HA   LYS  56           HA       LYS  56  21.057   9.924   2.448
  964   1HB   LYS  56          1HB       LYS  56  22.714   7.595   3.252
  965   2HB   LYS  56          2HB       LYS  56  23.534   8.855   2.330
  966   1HG   LYS  56          1HG       LYS  56  23.219  10.454   3.976
  967   2HG   LYS  56          2HG       LYS  56  21.753   9.686   4.587
  968   1HD   LYS  56          1HD       LYS  56  23.255   7.768   5.369
  969   2HD   LYS  56          2HD       LYS  56  24.622   8.829   5.030
  970   1HE   LYS  56          1HE       LYS  56  24.288   9.972   6.945
  971   2HE   LYS  56          2HE       LYS  56  22.589  10.235   6.547
  972   1HZ   LYS  56          3HZ       LYS  56  23.290   7.542   7.365
  973   2HZ   LYS  56          1HZ       LYS  56  23.414   8.724   8.577
  974   3HZ   LYS  56          2HZ       LYS  56  21.938   8.486   7.772
  975    H    TRP  57           H        TRP  57  23.001   7.408   0.925
  976    HA   TRP  57           HA       TRP  57  23.437   8.669  -1.496
  977   1HB   TRP  57          1HB       TRP  57  23.905   6.452  -2.428
  978   2HB   TRP  57          2HB       TRP  57  24.550   6.581  -0.787
  979    HD1  TRP  57           HD1      TRP  57  23.654   4.823   0.914
  980    HE1  TRP  57           HE1      TRP  57  21.904   2.931   0.746
  981    HE3  TRP  57           HE3      TRP  57  21.680   5.953  -3.598
  982    HZ2  TRP  57           HZ2      TRP  57  19.842   2.064  -1.098
  983    HZ3  TRP  57           HZ3      TRP  57  19.933   4.568  -4.616
  984    HH2  TRP  57           HH2      TRP  57  19.019   2.600  -3.391
  985    H    VAL  58           H        VAL  58  20.472   7.074  -0.536
  986    HA   VAL  58           HA       VAL  58  19.338   6.660  -3.109
  987    HB   VAL  58           HB       VAL  58  17.109   7.298  -1.815
  988   1HG1  VAL  58          3HG1      VAL  58  18.290   5.036  -2.513
  989   2HG1  VAL  58          1HG1      VAL  58  18.445   4.868  -0.766
  990   3HG1  VAL  58          2HG1      VAL  58  16.854   5.059  -1.505
  991   1HG2  VAL  58          2HG2      VAL  58  18.911   8.020   0.105
  992   2HG2  VAL  58          3HG2      VAL  58  17.230   7.587   0.410
  993   3HG2  VAL  58          1HG2      VAL  58  18.498   6.376   0.580
  994    H    ARG  59           H        ARG  59  19.004   9.548  -1.011
  995    HA   ARG  59           HA       ARG  59  17.584  11.073  -2.972
  996   1HB   ARG  59          1HB       ARG  59  19.304  11.985  -0.650
  997   2HB   ARG  59          2HB       ARG  59  18.257  13.033  -1.574
  998   1HG   ARG  59          2HG       ARG  59  16.301  11.763  -0.901
  999   2HG   ARG  59          1HG       ARG  59  17.300  10.566  -0.115
 1000   1HD   ARG  59          1HD       ARG  59  18.182  12.853   1.095
 1001   2HD   ARG  59          2HD       ARG  59  16.483  13.239   0.825
 1002    HE   ARG  59           HE       ARG  59  17.371  10.793   2.304
 1003   1HH1  ARG  59          2HH1      ARG  59  14.409  12.109   1.305
 1004   2HH1  ARG  59          1HH1      ARG  59  14.272  13.186   2.655
 1005   1HH2  ARG  59          2HH2      ARG  59  16.514  11.601   4.603
 1006   2HH2  ARG  59          1HH2      ARG  59  14.835  11.207   4.435
 1007    H    GLU  60           H        GLU  60  20.999  10.512  -2.367
 1008    HA   GLU  60           HA       GLU  60  22.058  12.634  -3.959
 1009   1HB   GLU  60          1HB       GLU  60  23.049  10.041  -2.916
 1010   2HB   GLU  60          2HB       GLU  60  23.896  10.670  -4.309
 1011   1HG   GLU  60          1HG       GLU  60  23.391  12.791  -2.417
 1012   2HG   GLU  60          2HG       GLU  60  24.222  11.470  -1.630
 1013    H    TYR  61           H        TYR  61  20.537   9.616  -4.783
 1014    HA   TYR  61           HA       TYR  61  21.405   9.831  -7.608
 1015   1HB   TYR  61          1HB       TYR  61  19.641   7.760  -6.263
 1016   2HB   TYR  61          2HB       TYR  61  20.272   7.671  -7.904
 1017    HD1  TYR  61           HD1      TYR  61  22.939   9.178  -6.388
 1018    HD2  TYR  61           HD2      TYR  61  20.835   5.402  -6.263
 1019    HE1  TYR  61           HE1      TYR  61  24.993   8.060  -5.535
 1020    HE2  TYR  61           HE2      TYR  61  22.891   4.294  -5.395
 1021    HH   TYR  61           HH       TYR  61  25.301   4.638  -5.376
 1022    H    ILE  62           H        ILE  62  18.584  10.327  -5.559
 1023    HA   ILE  62           HA       ILE  62  16.613  10.459  -7.624
 1024    HB   ILE  62           HB       ILE  62  16.850  11.457  -4.814
 1025   1HG1  ILE  62          1HG1      ILE  62  14.593  10.288  -4.752
 1026   2HG1  ILE  62          2HG1      ILE  62  14.875   9.823  -6.411
 1027   1HG2  ILE  62          2HG2      ILE  62  15.034  12.660  -6.878
 1028   2HG2  ILE  62          3HG2      ILE  62  14.411  12.400  -5.249
 1029   3HG2  ILE  62          1HG2      ILE  62  15.822  13.428  -5.500
 1030   1HD1  ILE  62          1HD1      ILE  62  17.100   8.846  -5.618
 1031   2HD1  ILE  62          2HD1      ILE  62  16.488   9.060  -3.979
 1032   3HD1  ILE  62          3HD1      ILE  62  15.648   7.990  -5.101
 1033    H    ASN  63           H        ASN  63  18.452  13.122  -6.070
 1034    HA   ASN  63           HA       ASN  63  17.567  15.122  -7.927
 1035   1HB   ASN  63          2HB       ASN  63  20.153  15.085  -6.353
 1036   2HB   ASN  63          1HB       ASN  63  19.352  16.494  -7.006
 1037   1HD2  ASN  63          1HD2      ASN  63  18.995  15.747  -3.440
 1038   2HD2  ASN  63          2HD2      ASN  63  19.076  17.193  -4.326
 1039    H    SER  64           H        SER  64  20.465  13.052  -7.832
 1040    HA   SER  64           HA       SER  64  21.786  14.153 -10.094
 1041   1HB   SER  64          1HB       SER  64  21.782  11.419  -8.826
 1042   2HB   SER  64          2HB       SER  64  22.705  11.728 -10.298
 1043    HG   SER  64           HG       SER  64  24.008  13.047  -9.239
 1044    H    LEU  65           H        LEU  65  18.951  12.159  -9.864
 1045    HA   LEU  65           HA       LEU  65  19.087  11.276 -12.662
 1046   1HB   LEU  65          2HB       LEU  65  17.085  10.979 -10.429
 1047   2HB   LEU  65          1HB       LEU  65  16.644  10.569 -12.087
 1048    HG   LEU  65           HG       LEU  65  19.226   9.496 -11.033
 1049   1HD1  LEU  65          3HD1      LEU  65  17.194   9.208  -9.347
 1050   2HD1  LEU  65          1HD1      LEU  65  16.718   7.951 -10.490
 1051   3HD1  LEU  65          2HD1      LEU  65  18.284   7.862  -9.683
 1052   1HD2  LEU  65          2HD2      LEU  65  17.575   9.156 -13.302
 1053   2HD2  LEU  65          3HD2      LEU  65  19.035   8.252 -12.901
 1054   3HD2  LEU  65          1HD2      LEU  65  17.457   7.654 -12.386
 1055    H    GLU  66           H        GLU  66  17.926  12.181 -14.369
 1056    HA   GLU  66           HA       GLU  66  16.730  14.851 -13.811
 1057   1HB   GLU  66          1HB       GLU  66  18.359  13.765 -15.933
 1058   2HB   GLU  66          2HB       GLU  66  16.850  14.388 -16.598
 1059   1HG   GLU  66          1HG       GLU  66  17.212  16.535 -15.468
 1060   2HG   GLU  66          2HG       GLU  66  18.691  15.915 -14.732
 1061    H    MET  67           H        MET  67  14.549  15.098 -13.943
 1062    HA   MET  67           HA       MET  67  12.772  12.917 -14.304
 1063   1HB   MET  67          1HB       MET  67  12.325  15.234 -13.245
 1064   2HB   MET  67          2HB       MET  67  12.008  15.778 -14.893
 1065   1HG   MET  67          1HG       MET  67   9.891  15.118 -13.970
 1066   2HG   MET  67          2HG       MET  67  10.368  13.845 -15.093
 1067   1HE   MET  67          1HE       MET  67   8.378  13.171 -13.866
 1068   2HE   MET  67          3HE       MET  67   8.664  11.635 -13.047
 1069   3HE   MET  67          2HE       MET  67   8.242  13.069 -12.110
 1070    H    SER  68           H        SER  68  12.980  11.771 -16.219
 1071    HA   SER  68           HA       SER  68  13.147  13.207 -18.784
 1072   1HB   SER  68          1HB       SER  68  13.628  10.484 -17.826
 1073   2HB   SER  68          2HB       SER  68  12.751  10.518 -19.355
 1074    HG   SER  68           HG       SER  68  14.448  11.291 -20.323
   
  No H/Q in entry =        1074
  Start of MODEL    2
    1    H    SER   1           H        SER   1  11.216 -13.425  -0.924
    2    HA   SER   1           HA       SER   1  12.509 -13.118   1.682
    3   1HB   SER   1          1HB       SER   1  13.903 -14.657  -0.532
    4   2HB   SER   1          2HB       SER   1  14.659 -14.126   0.971
    5    HG   SER   1           HG       SER   1  13.886 -15.847   1.844
    6    HA   PRO   2           HA       PRO   2  13.724  -9.339  -0.191
    7   1HB   PRO   2          1HB       PRO   2  16.293  -9.225   1.112
    8   2HB   PRO   2          2HB       PRO   2  14.812  -8.374   1.562
    9   1HG   PRO   2          1HG       PRO   2  16.051 -10.603   2.916
   10   2HG   PRO   2          2HG       PRO   2  14.571  -9.748   3.369
   11   1HD   PRO   2          1HD       PRO   2  14.815 -12.394   2.242
   12   2HD   PRO   2          2HD       PRO   2  13.331 -11.538   2.703
   13    H    TYR   3           H        TYR   3  14.380  -9.346  -2.304
   14    HA   TYR   3           HA       TYR   3  17.126 -10.281  -2.922
   15   1HB   TYR   3          1HB       TYR   3  15.155 -12.042  -3.351
   16   2HB   TYR   3          2HB       TYR   3  14.987 -11.104  -4.834
   17    HD1  TYR   3           HD1      TYR   3  17.726 -10.299  -5.471
   18    HD2  TYR   3           HD2      TYR   3  16.258 -14.048  -3.911
   19    HE1  TYR   3           HE1      TYR   3  19.697 -11.474  -6.441
   20    HE2  TYR   3           HE2      TYR   3  18.229 -15.224  -4.883
   21    HH   TYR   3           HH       TYR   3  20.390 -14.829  -5.704
   22    H    SER   4           H        SER   4  14.259  -9.312  -4.840
   23    HA   SER   4           HA       SER   4  15.964  -7.336  -6.239
   24   1HB   SER   4          1HB       SER   4  13.992  -7.093  -7.744
   25   2HB   SER   4          2HB       SER   4  14.543  -8.765  -7.628
   26    HG   SER   4           HG       SER   4  12.150  -7.806  -7.085
   27    H    SER   5           H        SER   5  13.184  -7.500  -4.073
   28    HA   SER   5           HA       SER   5  12.047  -5.807  -2.911
   29   1HB   SER   5          1HB       SER   5  14.768  -4.530  -3.292
   30   2HB   SER   5          2HB       SER   5  13.498  -3.827  -2.291
   31    HG   SER   5           HG       SER   5  13.680  -5.429  -0.879
   32    H    ASP   6           H        ASP   6  10.470  -5.279  -4.477
   33    HA   ASP   6           HA       ASP   6  10.991  -2.719  -5.909
   34   1HB   ASP   6          2HB       ASP   6   9.996  -3.579  -7.963
   35   2HB   ASP   6          1HB       ASP   6  11.327  -4.613  -7.514
   36    H    THR   7           H        THR   7   8.380  -2.847  -7.232
   37    HA   THR   7           HA       THR   7   6.822  -1.886  -4.994
   38    HB   THR   7           HB       THR   7   6.669  -0.865  -7.248
   39    HG1  THR   7           HG1      THR   7   4.675  -0.388  -6.823
   40   1HG2  THR   7          2HG2      THR   7   6.838  -3.198  -8.366
   41   2HG2  THR   7          3HG2      THR   7   5.097  -3.297  -8.096
   42   3HG2  THR   7          1HG2      THR   7   5.761  -2.012  -9.105
   43    H    THR   8           H        THR   8   4.784  -2.766  -4.268
   44    HA   THR   8           HA       THR   8   4.442  -5.673  -4.893
   45    HB   THR   8           HB       THR   8   3.908  -4.316  -2.233
   46    HG1  THR   8           HG1      THR   8   6.095  -5.787  -3.240
   47   1HG2  THR   8          2HG2      THR   8   2.551  -6.351  -2.796
   48   2HG2  THR   8          3HG2      THR   8   4.055  -7.252  -2.982
   49   3HG2  THR   8          1HG2      THR   8   3.615  -6.585  -1.410
   50    HA   PRO   9           HA       PRO   9   0.494  -3.986  -6.230
   51   1HB   PRO   9          1HB       PRO   9  -0.376  -6.663  -6.827
   52   2HB   PRO   9          2HB       PRO   9   0.145  -5.417  -7.968
   53   1HG   PRO   9          1HG       PRO   9   1.576  -7.799  -7.178
   54   2HG   PRO   9          2HG       PRO   9   2.081  -6.580  -8.325
   55   1HD   PRO   9          1HD       PRO   9   3.100  -7.040  -5.697
   56   2HD   PRO   9          2HD       PRO   9   3.606  -5.816  -6.852
   57    H    CYS  10           H        CYS  10  -1.020  -3.519  -4.709
   58    HA   CYS  10           HA       CYS  10  -2.727  -5.385  -3.465
   59   1HB   CYS  10          1HB       CYS  10  -1.905  -5.322  -1.125
   60   2HB   CYS  10          2HB       CYS  10  -0.773  -6.128  -2.177
   61    H    CYS  11           H        CYS  11  -4.391  -4.303  -2.366
   62    HA   CYS  11           HA       CYS  11  -4.100  -1.368  -2.499
   63   1HB   CYS  11          2HB       CYS  11  -6.531  -1.241  -2.411
   64   2HB   CYS  11          1HB       CYS  11  -5.996  -2.289  -3.713
   65    H    PHE  12           H        PHE  12  -4.664  -0.030  -0.709
   66    HA   PHE  12           HA       PHE  12  -4.303  -1.423   1.886
   67   1HB   PHE  12          1HB       PHE  12  -3.477   0.663   2.748
   68   2HB   PHE  12          2HB       PHE  12  -2.724   0.425   1.174
   69    HD1  PHE  12           HD1      PHE  12  -3.697   1.628  -0.864
   70    HD2  PHE  12           HD2      PHE  12  -4.852   2.559   3.191
   71    HE1  PHE  12           HE1      PHE  12  -4.727   3.757  -1.645
   72    HE2  PHE  12           HE2      PHE  12  -5.880   4.689   2.409
   73    HZ   PHE  12           HZ       PHE  12  -5.821   5.287  -0.009
   74    H    ALA  13           H        ALA  13  -6.363   1.123   0.429
   75    HA   ALA  13           HA       ALA  13  -8.152   0.939   2.782
   76   1HB   ALA  13          2HB       ALA  13  -8.049   2.802   0.403
   77   2HB   ALA  13          3HB       ALA  13  -9.371   2.824   1.570
   78   3HB   ALA  13          1HB       ALA  13  -7.726   3.193   2.092
   79    H    TYR  14           H        TYR  14  -9.973  -0.208   2.777
   80    HA   TYR  14           HA       TYR  14 -10.661  -1.769   0.443
   81   1HB   TYR  14          2HB       TYR  14 -12.548  -1.485   2.749
   82   2HB   TYR  14          1HB       TYR  14 -12.176  -2.902   1.804
   83    HD1  TYR  14           HD1      TYR  14  -9.450  -3.453   1.885
   84    HD2  TYR  14           HD2      TYR  14 -11.809  -1.561   4.964
   85    HE1  TYR  14           HE1      TYR  14  -7.774  -4.148   3.596
   86    HE2  TYR  14           HE2      TYR  14 -10.137  -2.258   6.676
   87    HH   TYR  14           HH       TYR  14  -8.353  -3.643   7.053
   88    H    ILE  15           H        ILE  15 -12.828  -1.665  -0.608
   89    HA   ILE  15           HA       ILE  15 -13.520   1.062  -1.282
   90    HB   ILE  15           HB       ILE  15 -13.733  -0.788  -2.907
   91   1HG1  ILE  15          2HG1      ILE  15 -15.978  -0.207  -3.744
   92   2HG1  ILE  15          1HG1      ILE  15 -16.391   0.481  -2.173
   93   1HG2  ILE  15          2HG2      ILE  15 -14.892  -2.132  -0.754
   94   2HG2  ILE  15          3HG2      ILE  15 -16.245  -1.832  -1.846
   95   3HG2  ILE  15          1HG2      ILE  15 -14.824  -2.706  -2.421
   96   1HD1  ILE  15          2HD1      ILE  15 -14.023   1.434  -3.797
   97   2HD1  ILE  15          3HD1      ILE  15 -15.626   2.152  -3.943
   98   3HD1  ILE  15          1HD1      ILE  15 -14.767   2.222  -2.406
   99    H    ALA  16           H        ALA  16 -14.593  -1.148   1.157
  100    HA   ALA  16           HA       ALA  16 -16.299  -0.976   2.764
  101   1HB   ALA  16          1HB       ALA  16 -16.006   1.950   2.016
  102   2HB   ALA  16          2HB       ALA  16 -16.912   1.360   3.408
  103   3HB   ALA  16          3HB       ALA  16 -15.168   1.114   3.323
  104    H    ARG  17           H        ARG  17 -17.429  -2.027   0.701
  105    HA   ARG  17           HA       ARG  17 -20.124  -1.202   0.649
  106   1HB   ARG  17          2HB       ARG  17 -18.432   0.409  -1.028
  107   2HB   ARG  17          1HB       ARG  17 -19.531  -0.526  -2.041
  108   1HG   ARG  17          1HG       ARG  17 -21.406   0.230  -0.493
  109   2HG   ARG  17          2HG       ARG  17 -20.250   1.356   0.218
  110   1HD   ARG  17          1HD       ARG  17 -21.360   2.613  -1.466
  111   2HD   ARG  17          2HD       ARG  17 -19.816   2.161  -2.188
  112    HE   ARG  17           HE       ARG  17 -22.152   0.406  -2.716
  113   1HH1  ARG  17          1HH2      ARG  17 -19.378   2.166  -4.091
  114   2HH1  ARG  17          2HH2      ARG  17 -19.649   0.992  -5.337
  115   1HH2  ARG  17          1HH1      ARG  17 -23.145   1.393  -4.730
  116   2HH2  ARG  17          2HH1      ARG  17 -22.007   1.867  -5.947
  117    HA   PRO  18           HA       PRO  18 -19.384  -5.403  -0.917
  118   1HB   PRO  18          2HB       PRO  18 -22.222  -5.834  -0.735
  119   2HB   PRO  18          1HB       PRO  18 -20.971  -6.523   0.256
  120   1HG   PRO  18          1HG       PRO  18 -22.844  -4.470   0.991
  121   2HG   PRO  18          2HG       PRO  18 -21.565  -5.169   1.990
  122   1HD   PRO  18          2HD       PRO  18 -21.647  -2.540   0.824
  123   2HD   PRO  18          1HD       PRO  18 -20.339  -3.259   1.782
  124    H    LEU  19           H        LEU  19 -18.917  -4.583  -3.055
  125    HA   LEU  19           HA       LEU  19 -21.128  -3.805  -4.806
  126   1HB   LEU  19          1HB       LEU  19 -19.260  -3.975  -6.601
  127   2HB   LEU  19          2HB       LEU  19 -19.132  -2.705  -5.386
  128    HG   LEU  19           HG       LEU  19 -17.898  -5.295  -4.646
  129   1HD1  LEU  19          3HD1      LEU  19 -17.459  -4.575  -7.222
  130   2HD1  LEU  19          1HD1      LEU  19 -16.220  -3.609  -6.421
  131   3HD1  LEU  19          2HD1      LEU  19 -16.239  -5.361  -6.221
  132   1HD2  LEU  19          3HD2      LEU  19 -17.671  -2.447  -4.086
  133   2HD2  LEU  19          1HD2      LEU  19 -17.104  -3.817  -3.133
  134   3HD2  LEU  19          2HD2      LEU  19 -16.095  -3.163  -4.423
  135    HA   PRO  20           HA       PRO  20 -22.298  -7.961  -5.798
  136   1HB   PRO  20          1HB       PRO  20 -23.186  -7.148  -8.437
  137   2HB   PRO  20          2HB       PRO  20 -24.168  -7.575  -7.031
  138   1HG   PRO  20          1HG       PRO  20 -23.729  -4.954  -8.131
  139   2HG   PRO  20          2HG       PRO  20 -24.669  -5.375  -6.694
  140   1HD   PRO  20          1HD       PRO  20 -22.113  -4.049  -6.807
  141   2HD   PRO  20          2HD       PRO  20 -23.049  -4.485  -5.364
  142    H    ARG  21           H        ARG  21 -21.100  -9.601  -6.650
  143    HA   ARG  21           HA       ARG  21 -18.658  -9.214  -7.982
  144   1HB   ARG  21          2HB       ARG  21 -18.601 -11.573  -8.342
  145   2HB   ARG  21          1HB       ARG  21 -19.462 -11.339  -6.844
  146   1HG   ARG  21          2HG       ARG  21 -20.845 -11.680  -9.517
  147   2HG   ARG  21          1HG       ARG  21 -20.532 -13.009  -8.404
  148   1HD   ARG  21          2HD       ARG  21 -21.722 -11.479  -6.647
  149   2HD   ARG  21          1HD       ARG  21 -22.374 -10.657  -8.064
  150    HE   ARG  21           HE       ARG  21 -22.896 -13.313  -8.590
  151   1HH1  ARG  21          2HH1      ARG  21 -23.426 -13.795  -5.404
  152   2HH1  ARG  21          1HH1      ARG  21 -24.719 -14.485  -6.327
  153   1HH2  ARG  21          1HH2      ARG  21 -24.686 -10.891  -6.854
  154   2HH2  ARG  21          2HH2      ARG  21 -25.868 -12.109  -7.204
  155    H    ALA  22           H        ALA  22 -21.880  -9.226  -9.280
  156    HA   ALA  22           HA       ALA  22 -21.427  -9.904 -11.973
  157   1HB   ALA  22          2HB       ALA  22 -23.442  -8.441 -10.471
  158   2HB   ALA  22          3HB       ALA  22 -23.183  -7.720 -12.061
  159   3HB   ALA  22          1HB       ALA  22 -23.631  -9.420 -11.926
  160    H    HIS  23           H        HIS  23 -21.216  -6.654 -10.492
  161    HA   HIS  23           HA       HIS  23 -20.137  -5.425 -12.865
  162   1HB   HIS  23          2HB       HIS  23 -19.689  -4.495 -10.018
  163   2HB   HIS  23          1HB       HIS  23 -19.717  -3.513 -11.482
  164    HD2  HIS  23           HD2      HIS  23 -22.643  -5.356 -12.356
  165    HE1  HIS  23           HE1      HIS  23 -24.170  -2.821  -9.337
  166    HE2  HIS  23           HE2      HIS  23 -24.793  -4.359 -11.267
  167    H    ILE  24           H        ILE  24 -18.762  -7.305 -10.265
  168    HA   ILE  24           HA       ILE  24 -16.019  -6.464 -10.908
  169    HB   ILE  24           HB       ILE  24 -16.751  -8.819  -9.202
  170   1HG1  ILE  24          2HG1      ILE  24 -16.550  -5.969  -8.223
  171   2HG1  ILE  24          1HG1      ILE  24 -18.085  -6.780  -8.521
  172   1HG2  ILE  24          1HG2      ILE  24 -14.365  -7.241  -9.797
  173   2HG2  ILE  24          2HG2      ILE  24 -14.652  -7.420  -8.066
  174   3HG2  ILE  24          3HG2      ILE  24 -14.499  -8.849  -9.087
  175   1HD1  ILE  24          2HD1      ILE  24 -17.080  -8.657  -6.988
  176   2HD1  ILE  24          3HD1      ILE  24 -15.992  -7.381  -6.441
  177   3HD1  ILE  24          1HD1      ILE  24 -17.737  -7.201  -6.239
  178    H    LYS  25           H        LYS  25 -14.386  -8.137 -11.513
  179    HA   LYS  25           HA       LYS  25 -15.595 -10.312 -13.173
  180   1HB   LYS  25          1HB       LYS  25 -13.257  -8.494 -13.787
  181   2HB   LYS  25          2HB       LYS  25 -13.545 -10.000 -14.657
  182   1HG   LYS  25          1HG       LYS  25 -15.718  -9.226 -15.398
  183   2HG   LYS  25          2HG       LYS  25 -15.600  -7.788 -14.383
  184   1HD   LYS  25          1HD       LYS  25 -14.210  -6.715 -15.845
  185   2HD   LYS  25          2HD       LYS  25 -13.353  -8.196 -16.270
  186   1HE   LYS  25          1HE       LYS  25 -16.113  -7.399 -17.247
  187   2HE   LYS  25          2HE       LYS  25 -14.629  -7.367 -18.200
  188   1HZ   LYS  25          3HZ       LYS  25 -14.527  -9.852 -17.402
  189   2HZ   LYS  25          1HZ       LYS  25 -16.211  -9.654 -17.293
  190   3HZ   LYS  25          2HZ       LYS  25 -15.420  -9.401 -18.775
  191    H    GLU  26           H        GLU  26 -13.392  -9.489 -10.667
  192    HA   GLU  26           HA       GLU  26 -12.762 -12.187 -10.046
  193   1HB   GLU  26          1HB       GLU  26 -10.160 -11.686 -10.561
  194   2HB   GLU  26          2HB       GLU  26 -11.202 -12.488 -11.712
  195   1HG   GLU  26          1HG       GLU  26 -11.318  -9.561 -11.906
  196   2HG   GLU  26          2HG       GLU  26  -9.717 -10.217 -12.207
  197    H    TYR  27           H        TYR  27 -10.243 -11.713  -8.762
  198    HA   TYR  27           HA       TYR  27 -10.472  -9.227  -7.240
  199   1HB   TYR  27          1HB       TYR  27 -10.786 -10.272  -5.085
  200   2HB   TYR  27          2HB       TYR  27 -12.061 -10.866  -6.120
  201    HD1  TYR  27           HD1      TYR  27 -11.826 -13.161  -7.210
  202    HD2  TYR  27           HD2      TYR  27  -9.144 -11.737  -4.140
  203    HE1  TYR  27           HE1      TYR  27 -11.004 -15.487  -6.848
  204    HE2  TYR  27           HE2      TYR  27  -8.329 -14.063  -3.772
  205    HH   TYR  27           HH       TYR  27  -8.283 -16.163  -4.688
  206    H    PHE  28           H        PHE  28  -8.601  -9.438  -5.414
  207    HA   PHE  28           HA       PHE  28  -6.461 -11.171  -6.400
  208   1HB   PHE  28          1HB       PHE  28  -5.918  -9.415  -7.829
  209   2HB   PHE  28          2HB       PHE  28  -6.457  -8.197  -6.708
  210    HD1  PHE  28           HD1      PHE  28  -4.119 -11.082  -6.191
  211    HD2  PHE  28           HD2      PHE  28  -4.596  -6.793  -6.295
  212    HE1  PHE  28           HE1      PHE  28  -1.847 -10.805  -5.211
  213    HE2  PHE  28           HE2      PHE  28  -2.321  -6.517  -5.325
  214    HZ   PHE  28           HZ       PHE  28  -0.935  -8.522  -4.798
  215    H    TYR  29           H        TYR  29  -6.806 -12.092  -4.248
  216    HA   TYR  29           HA       TYR  29  -6.643 -10.666  -1.828
  217   1HB   TYR  29          1HB       TYR  29  -7.223 -13.048  -1.921
  218   2HB   TYR  29          2HB       TYR  29  -5.579 -13.437  -2.419
  219    HD1  TYR  29           HD2      TYR  29  -7.499 -11.723   0.318
  220    HD2  TYR  29           HD1      TYR  29  -3.931 -13.882  -0.796
  221    HE1  TYR  29           HE2      TYR  29  -6.784 -11.772   2.704
  222    HE2  TYR  29           HE1      TYR  29  -3.214 -13.930   1.590
  223    HH   TYR  29           HH       TYR  29  -3.634 -12.613   3.668
  224    H    THR  30           H        THR  30  -5.006  -9.717  -0.752
  225    HA   THR  30           HA       THR  30  -2.470  -9.285  -2.077
  226    HB   THR  30           HB       THR  30  -3.243  -8.691   0.796
  227    HG1  THR  30           HG1      THR  30  -4.610  -7.494  -0.317
  228   1HG2  THR  30          2HG2      THR  30  -1.032  -7.713  -1.027
  229   2HG2  THR  30          3HG2      THR  30  -1.488  -6.880   0.459
  230   3HG2  THR  30          1HG2      THR  30  -0.863  -8.527   0.528
  231    H    SER  31           H        SER  31  -0.355  -9.888  -1.171
  232    HA   SER  31           HA       SER  31  -0.257 -12.674  -0.412
  233   1HB   SER  31          1HB       SER  31   1.803 -10.486  -0.673
  234   2HB   SER  31          2HB       SER  31   2.238 -12.068  -0.025
  235    HG   SER  31           HG       SER  31   1.275 -11.390  -2.580
  236    H    GLY  32           H        GLY  32   1.223  -9.936   1.353
  237   1HA   GLY  32          2HA       GLY  32  -0.090  -9.981   3.756
  238   2HA   GLY  32          1HA       GLY  32   0.947 -11.403   3.873
  239    H    LYS  33           H        LYS  33   1.476  -8.142   2.486
  240    HA   LYS  33           HA       LYS  33   3.474  -7.546   4.556
  241   1HB   LYS  33          1HB       LYS  33   5.288  -7.188   2.852
  242   2HB   LYS  33          2HB       LYS  33   4.837  -8.881   3.060
  243   1HG   LYS  33          1HG       LYS  33   3.892  -9.013   0.975
  244   2HG   LYS  33          2HG       LYS  33   3.321  -7.363   1.011
  245   1HD   LYS  33          1HD       LYS  33   5.333  -6.500   0.247
  246   2HD   LYS  33          2HD       LYS  33   6.269  -7.841   0.908
  247   1HE   LYS  33          1HE       LYS  33   4.293  -8.425  -1.263
  248   2HE   LYS  33          2HE       LYS  33   5.817  -7.654  -1.704
  249   1HZ   LYS  33          1HZ       LYS  33   6.858  -9.487  -0.271
  250   2HZ   LYS  33          2HZ       LYS  33   5.370 -10.285  -0.452
  251   3HZ   LYS  33          3HZ       LYS  33   6.298  -9.898  -1.820
  252    H    CYS  34           H        CYS  34   0.948  -6.432   3.235
  253    HA   CYS  34           HA       CYS  34   2.081  -3.789   2.412
  254   1HB   CYS  34          1HB       CYS  34  -0.565  -5.104   1.763
  255   2HB   CYS  34          2HB       CYS  34  -0.216  -3.431   1.403
  256    H    SER  35           H        SER  35   1.098  -5.161   5.147
  257    HA   SER  35           HA       SER  35   0.096  -4.386   7.117
  258   1HB   SER  35          1HB       SER  35   1.662  -2.350   6.109
  259   2HB   SER  35          2HB       SER  35   0.101  -1.557   6.321
  260    HG   SER  35           HG       SER  35   1.816  -1.960   8.172
  261    H    ASN  36           H        ASN  36  -1.538  -4.734   4.533
  262    HA   ASN  36           HA       ASN  36  -4.082  -3.919   5.644
  263   1HB   ASN  36          1HB       ASN  36  -2.800  -2.245   3.516
  264   2HB   ASN  36          2HB       ASN  36  -4.538  -2.533   3.426
  265   1HD2  ASN  36          2HD2      ASN  36  -4.578  -1.436   7.034
  266   2HD2  ASN  36          1HD2      ASN  36  -5.663  -2.050   5.882
  267    HA   PRO  37           HA       PRO  37  -3.719  -7.479   2.596
  268   1HB   PRO  37          1HB       PRO  37  -5.476  -8.884   4.436
  269   2HB   PRO  37          2HB       PRO  37  -3.829  -9.308   3.955
  270   1HG   PRO  37          2HG       PRO  37  -4.681  -8.231   6.475
  271   2HG   PRO  37          1HG       PRO  37  -3.042  -8.587   5.972
  272   1HD   PRO  37          1HD       PRO  37  -4.249  -5.999   6.325
  273   2HD   PRO  37          2HD       PRO  37  -2.594  -6.360   5.801
  274    H    ALA  38           H        ALA  38  -5.522  -8.234   1.270
  275    HA   ALA  38           HA       ALA  38  -8.250  -7.523   1.863
  276   1HB   ALA  38          2HB       ALA  38  -7.071  -5.267   1.334
  277   2HB   ALA  38          3HB       ALA  38  -7.029  -5.839  -0.334
  278   3HB   ALA  38          1HB       ALA  38  -8.575  -5.620   0.486
  279    H    VAL  39           H        VAL  39  -9.143  -7.126  -0.752
  280    HA   VAL  39           HA       VAL  39  -8.109  -9.408  -2.331
  281    HB   VAL  39           HB       VAL  39 -10.667  -9.856  -2.828
  282   1HG1  VAL  39          3HG1      VAL  39  -9.245 -10.754  -0.316
  283   2HG1  VAL  39          1HG1      VAL  39 -10.660 -11.552  -1.002
  284   3HG1  VAL  39          2HG1      VAL  39  -9.146 -11.511  -1.907
  285   1HG2  VAL  39          3HG2      VAL  39 -11.467  -7.992  -1.376
  286   2HG2  VAL  39          1HG2      VAL  39 -12.099  -9.563  -0.870
  287   3HG2  VAL  39          2HG2      VAL  39 -10.769  -8.819   0.024
  288    H    VAL  40           H        VAL  40  -7.264  -7.780  -3.592
  289    HA   VAL  40           HA       VAL  40  -8.590  -5.463  -4.413
  290    HB   VAL  40           HB       VAL  40  -6.222  -6.999  -5.259
  291   1HG1  VAL  40          2HG1      VAL  40  -7.328  -6.620  -7.452
  292   2HG1  VAL  40          3HG1      VAL  40  -7.420  -4.901  -7.084
  293   3HG1  VAL  40          1HG1      VAL  40  -5.850  -5.680  -7.283
  294   1HG2  VAL  40          3HG2      VAL  40  -7.009  -4.211  -4.494
  295   2HG2  VAL  40          1HG2      VAL  40  -5.803  -5.267  -3.759
  296   3HG2  VAL  40          2HG2      VAL  40  -5.464  -4.479  -5.302
  297    H    PHE  41           H        PHE  41 -10.486  -5.366  -5.403
  298    HA   PHE  41           HA       PHE  41 -11.420  -7.534  -7.084
  299   1HB   PHE  41          1HB       PHE  41 -12.511  -4.867  -6.222
  300   2HB   PHE  41          2HB       PHE  41 -13.238  -5.675  -7.606
  301    HD1  PHE  41           HD2      PHE  41 -13.012  -8.552  -6.783
  302    HD2  PHE  41           HD1      PHE  41 -14.145  -5.047  -4.535
  303    HE1  PHE  41           HE2      PHE  41 -14.425  -9.964  -5.295
  304    HE2  PHE  41           HE1      PHE  41 -15.572  -6.457  -3.060
  305    HZ   PHE  41           HZ       PHE  41 -15.726  -8.912  -3.443
  306    H    VAL  42           H        VAL  42 -11.450  -7.646  -9.181
  307    HA   VAL  42           HA       VAL  42 -10.186  -5.415 -10.729
  308    HB   VAL  42           HB       VAL  42 -10.025  -7.781 -12.243
  309   1HG1  VAL  42          1HG2      VAL  42  -8.419  -5.850 -12.025
  310   2HG1  VAL  42          2HG2      VAL  42  -7.913  -6.534 -10.476
  311   3HG1  VAL  42          3HG2      VAL  42  -7.633  -7.430 -11.973
  312   1HG2  VAL  42          2HG1      VAL  42  -9.122  -8.275  -9.395
  313   2HG2  VAL  42          3HG1      VAL  42 -10.429  -9.110 -10.219
  314   3HG2  VAL  42          1HG1      VAL  42  -8.775  -9.318 -10.775
  315    H    THR  43           H        THR  43 -12.419  -4.599 -10.844
  316    HA   THR  43           HA       THR  43 -14.554  -6.264 -11.933
  317    HB   THR  43           HB       THR  43 -15.976  -4.394 -11.536
  318    HG1  THR  43           HG1      THR  43 -13.686  -2.777 -11.219
  319   1HG2  THR  43          2HG2      THR  43 -15.023  -5.449  -9.492
  320   2HG2  THR  43          3HG2      THR  43 -13.743  -4.237  -9.493
  321   3HG2  THR  43          1HG2      THR  43 -15.420  -3.750  -9.250
  322    H    ARG  44           H        ARG  44 -15.980  -4.408 -13.461
  323    HA   ARG  44           HA       ARG  44 -15.233  -5.045 -16.047
  324   1HB   ARG  44          1HB       ARG  44 -16.499  -2.847 -16.682
  325   2HB   ARG  44          2HB       ARG  44 -17.384  -4.140 -15.883
  326   1HG   ARG  44          1HG       ARG  44 -17.934  -2.718 -14.231
  327   2HG   ARG  44          2HG       ARG  44 -16.229  -2.522 -13.836
  328   1HD   ARG  44          1HD       ARG  44 -16.873  -0.328 -14.335
  329   2HD   ARG  44          2HD       ARG  44 -16.212  -0.879 -15.875
  330    HE   ARG  44           HE       ARG  44 -19.035  -1.439 -15.741
  331   1HH1  ARG  44          1HH2      ARG  44 -17.439   0.034 -18.129
  332   2HH1  ARG  44          2HH2      ARG  44 -17.312   1.612 -17.427
  333   1HH2  ARG  44          1HH1      ARG  44 -19.481   1.781 -15.474
  334   2HH2  ARG  44          2HH1      ARG  44 -20.408   0.967 -16.691
  335    H    LYS  45           H        LYS  45 -14.625  -1.807 -14.580
  336    HA   LYS  45           HA       LYS  45 -12.745  -0.980 -16.580
  337   1HB   LYS  45          1HB       LYS  45 -13.691   0.575 -14.873
  338   2HB   LYS  45          2HB       LYS  45 -12.774  -0.266 -13.624
  339   1HG   LYS  45          1HG       LYS  45 -11.526   1.709 -14.304
  340   2HG   LYS  45          2HG       LYS  45 -10.672   0.279 -14.885
  341   1HD   LYS  45          1HD       LYS  45 -11.473   0.589 -17.113
  342   2HD   LYS  45          2HD       LYS  45 -12.667   1.778 -16.594
  343   1HE   LYS  45          1HE       LYS  45 -10.904   3.355 -16.007
  344   2HE   LYS  45          2HE       LYS  45  -9.665   2.155 -16.377
  345   1HZ   LYS  45          1HZ       LYS  45 -11.620   2.795 -18.456
  346   2HZ   LYS  45          2HZ       LYS  45 -10.411   3.942 -18.129
  347   3HZ   LYS  45          3HZ       LYS  45  -9.983   2.368 -18.601
  348    H    ASN  46           H        ASN  46 -12.618  -3.004 -13.772
  349    HA   ASN  46           HA       ASN  46 -11.138  -4.616 -13.080
  350   1HB   ASN  46          1HB       ASN  46 -10.596  -4.247 -15.896
  351   2HB   ASN  46          2HB       ASN  46  -9.067  -4.487 -15.057
  352   1HD2  ASN  46          1HD2      ASN  46  -9.620  -7.861 -15.489
  353   2HD2  ASN  46          2HD2      ASN  46  -9.726  -6.665 -16.689
  354    H    ARG  47           H        ARG  47 -10.659  -1.567 -12.774
  355    HA   ARG  47           HA       ARG  47  -7.826  -1.260 -12.378
  356   1HB   ARG  47          2HB       ARG  47 -10.292   0.034 -11.313
  357   2HB   ARG  47          1HB       ARG  47  -8.852   0.196 -10.343
  358   1HG   ARG  47          1HG       ARG  47  -8.952   0.837 -13.301
  359   2HG   ARG  47          2HG       ARG  47  -9.190   2.047 -12.040
  360   1HD   ARG  47          1HD       ARG  47  -6.796   0.378 -11.651
  361   2HD   ARG  47          2HD       ARG  47  -6.750   1.359 -13.116
  362    HE   ARG  47           HE       ARG  47  -7.298   2.573 -10.437
  363   1HH1  ARG  47          2HH1      ARG  47  -4.573   2.159 -12.283
  364   2HH1  ARG  47          1HH1      ARG  47  -4.677   3.632 -13.189
  365   1HH2  ARG  47          2HH2      ARG  47  -7.205   4.917 -11.173
  366   2HH2  ARG  47          1HH2      ARG  47  -5.635   5.328 -11.777
  367    H    GLN  48           H        GLN  48  -6.782  -1.550 -10.111
  368    HA   GLN  48           HA       GLN  48  -7.876  -4.065  -9.090
  369   1HB   GLN  48          1HB       GLN  48  -5.249  -2.706  -8.925
  370   2HB   GLN  48          2HB       GLN  48  -5.678  -3.798  -7.604
  371   1HG   GLN  48          1HG       GLN  48  -6.192  -5.572  -9.220
  372   2HG   GLN  48          2HG       GLN  48  -5.881  -4.481 -10.559
  373   1HE2  GLN  48          1HE2      GLN  48  -2.892  -6.159  -8.343
  374   2HE2  GLN  48          2HE2      GLN  48  -3.863  -5.032  -7.527
  375    H    VAL  49           H        VAL  49  -9.692  -2.817  -8.452
  376    HA   VAL  49           HA       VAL  49  -9.881  -0.884  -6.472
  377    HB   VAL  49           HB       VAL  49 -11.916  -3.035  -6.386
  378   1HG1  VAL  49          3HG1      VAL  49 -11.689  -0.094  -6.270
  379   2HG1  VAL  49          1HG1      VAL  49 -13.178  -0.719  -6.979
  380   3HG1  VAL  49          2HG1      VAL  49 -12.722  -1.180  -5.338
  381   1HG2  VAL  49          3HG2      VAL  49 -11.145  -1.642  -8.948
  382   2HG2  VAL  49          1HG2      VAL  49 -11.759  -3.278  -8.739
  383   3HG2  VAL  49          2HG2      VAL  49 -12.853  -1.902  -8.620
  384    H    CYS  50           H        CYS  50 -11.153  -1.635  -4.290
  385    HA   CYS  50           HA       CYS  50  -9.539  -3.742  -2.926
  386   1HB   CYS  50          1HB       CYS  50  -9.112  -1.063  -2.597
  387   2HB   CYS  50          2HB       CYS  50 -10.338  -1.325  -1.393
  388    H    ALA  51           H        ALA  51 -10.730  -4.756  -1.113
  389    HA   ALA  51           HA       ALA  51 -13.413  -3.745  -0.511
  390   1HB   ALA  51          1HB       ALA  51 -13.091  -6.429  -1.886
  391   2HB   ALA  51          2HB       ALA  51 -14.592  -5.796  -1.214
  392   3HB   ALA  51          3HB       ALA  51 -13.839  -4.995  -2.590
  393    H    ASN  52           H        ASN  52 -10.817  -4.585   0.811
  394    HA   ASN  52           HA       ASN  52 -10.279  -5.520   2.884
  395   1HB   ASN  52          1HB       ASN  52 -12.437  -4.353   3.479
  396   2HB   ASN  52          2HB       ASN  52 -13.275  -5.872   3.171
  397   1HD2  ASN  52          2HD2      ASN  52 -11.546  -4.541   6.262
  398   2HD2  ASN  52          1HD2      ASN  52 -10.212  -5.309   5.547
  399    HA   PRO  53           HA       PRO  53 -10.361  -9.821   1.877
  400   1HB   PRO  53          2HB       PRO  53  -8.964 -10.716   4.104
  401   2HB   PRO  53          1HB       PRO  53  -8.203 -10.031   2.666
  402   1HG   PRO  53          2HG       PRO  53  -8.489  -8.844   5.354
  403   2HG   PRO  53          1HG       PRO  53  -7.422  -8.358   4.032
  404   1HD   PRO  53          1HD       PRO  53  -9.876  -7.105   4.845
  405   2HD   PRO  53          2HD       PRO  53  -8.849  -6.657   3.492
  406    H    GLU  54           H        GLU  54 -10.794  -9.136   5.372
  407    HA   GLU  54           HA       GLU  54 -12.771 -11.356   5.499
  408   1HB   GLU  54          1HB       GLU  54 -12.501 -11.072   7.984
  409   2HB   GLU  54          2HB       GLU  54 -11.009 -11.508   7.151
  410   1HG   GLU  54          1HG       GLU  54 -10.017  -9.534   7.668
  411   2HG   GLU  54          2HG       GLU  54 -11.468  -8.608   7.284
  412    H    LYS  55           H        LYS  55 -14.117  -9.550   4.247
  413    HA   LYS  55           HA       LYS  55 -15.541  -7.913   6.301
  414   1HB   LYS  55          2HB       LYS  55 -14.564  -7.218   3.703
  415   2HB   LYS  55          1HB       LYS  55 -16.324  -7.111   3.695
  416   1HG   LYS  55          1HG       LYS  55 -14.958  -5.997   6.087
  417   2HG   LYS  55          2HG       LYS  55 -14.735  -5.106   4.581
  418   1HD   LYS  55          1HD       LYS  55 -17.001  -4.618   4.379
  419   2HD   LYS  55          2HD       LYS  55 -17.494  -6.015   5.334
  420   1HE   LYS  55          1HE       LYS  55 -16.503  -4.903   7.355
  421   2HE   LYS  55          2HE       LYS  55 -16.198  -3.475   6.366
  422   1HZ   LYS  55          3HZ       LYS  55 -18.896  -4.604   6.356
  423   2HZ   LYS  55          1HZ       LYS  55 -18.404  -3.744   7.736
  424   3HZ   LYS  55          2HZ       LYS  55 -18.397  -2.987   6.216
  425    H    LYS  56           H        LYS  56 -15.877 -10.794   5.556
  426    HA   LYS  56           HA       LYS  56 -17.645 -12.293   5.299
  427   1HB   LYS  56          1HB       LYS  56 -19.003  -9.745   6.081
  428   2HB   LYS  56          2HB       LYS  56 -19.997 -11.084   5.511
  429   1HG   LYS  56          1HG       LYS  56 -19.051 -12.560   7.208
  430   2HG   LYS  56          2HG       LYS  56 -17.937 -11.296   7.728
  431   1HD   LYS  56          1HD       LYS  56 -19.958  -9.865   8.254
  432   2HD   LYS  56          2HD       LYS  56 -20.959 -11.284   7.949
  433   1HE   LYS  56          1HE       LYS  56 -20.609 -11.350  10.282
  434   2HE   LYS  56          2HE       LYS  56 -19.407 -12.478   9.655
  435   1HZ   LYS  56          2HZ       LYS  56 -17.884 -10.449   9.596
  436   2HZ   LYS  56          3HZ       LYS  56 -19.018  -9.719  10.628
  437   3HZ   LYS  56          1HZ       LYS  56 -18.221 -11.139  11.110
  438    H    TRP  57           H        TRP  57 -19.525  -9.659   3.901
  439    HA   TRP  57           HA       TRP  57 -20.398 -11.012   1.648
  440   1HB   TRP  57          1HB       TRP  57 -20.935  -8.863   0.694
  441   2HB   TRP  57          2HB       TRP  57 -21.214  -8.792   2.436
  442    HD1  TRP  57           HD1      TRP  57 -19.850  -6.983   3.734
  443    HE1  TRP  57           HE1      TRP  57 -18.202  -5.154   2.957
  444    HE3  TRP  57           HE3      TRP  57 -18.969  -8.627  -0.969
  445    HZ2  TRP  57           HZ2      TRP  57 -16.719  -4.462   0.568
  446    HZ3  TRP  57           HZ3      TRP  57 -17.545  -7.372  -2.514
  447    HH2  TRP  57           HH2      TRP  57 -16.394  -5.294  -1.757
  448    H    VAL  58           H        VAL  58 -17.197  -9.713   2.103
  449    HA   VAL  58           HA       VAL  58 -16.599  -9.819  -0.779
  450    HB   VAL  58           HB       VAL  58 -14.122  -9.769   0.286
  451   1HG1  VAL  58          3HG1      VAL  58 -15.579  -8.079  -1.125
  452   2HG1  VAL  58          1HG1      VAL  58 -15.653  -7.215   0.413
  453   3HG1  VAL  58          2HG1      VAL  58 -14.095  -7.559  -0.339
  454   1HG2  VAL  58          1HG2      VAL  58 -15.048  -9.936   2.588
  455   2HG2  VAL  58          2HG2      VAL  58 -14.074  -8.489   2.321
  456   3HG2  VAL  58          3HG2      VAL  58 -15.834  -8.381   2.328
  457    H    ARG  59           H        ARG  59 -15.658 -11.747   2.090
  458    HA   ARG  59           HA       ARG  59 -14.171 -13.673   0.593
  459   1HB   ARG  59          1HB       ARG  59 -15.750 -14.230   3.127
  460   2HB   ARG  59          2HB       ARG  59 -14.316 -15.081   2.553
  461   1HG   ARG  59          1HG       ARG  59 -13.095 -12.851   2.715
  462   2HG   ARG  59          2HG       ARG  59 -14.490 -12.241   3.572
  463   1HD   ARG  59          1HD       ARG  59 -13.201 -14.801   4.466
  464   2HD   ARG  59          2HD       ARG  59 -12.496 -13.255   4.937
  465    HE   ARG  59           HE       ARG  59 -15.383 -13.599   5.471
  466   1HH1  ARG  59          2HH2      ARG  59 -12.973 -15.102   7.483
  467   2HH1  ARG  59          1HH2      ARG  59 -12.158 -13.577   7.564
  468   1HH2  ARG  59          2HH1      ARG  59 -14.765 -11.805   7.734
  469   2HH2  ARG  59          1HH1      ARG  59 -15.336 -13.262   8.477
  470    H    GLU  60           H        GLU  60 -17.580 -13.147   0.951
  471    HA   GLU  60           HA       GLU  60 -18.277 -15.841  -0.044
  472   1HB   GLU  60          1HB       GLU  60 -19.623 -13.751   1.418
  473   2HB   GLU  60          2HB       GLU  60 -20.547 -14.146  -0.010
  474   1HG   GLU  60          2HG       GLU  60 -19.680 -16.608   1.045
  475   2HG   GLU  60          1HG       GLU  60 -20.235 -15.674   2.412
  476    H    TYR  61           H        TYR  61 -17.679 -12.667  -1.244
  477    HA   TYR  61           HA       TYR  61 -19.225 -13.025  -3.716
  478   1HB   TYR  61          2HB       TYR  61 -17.531 -10.895  -2.482
  479   2HB   TYR  61          1HB       TYR  61 -17.706 -10.864  -4.213
  480    HD1  TYR  61           HD1      TYR  61 -20.247 -12.105  -1.787
  481    HD2  TYR  61           HD2      TYR  61 -19.109  -8.900  -4.455
  482    HE1  TYR  61           HE1      TYR  61 -22.462 -11.029  -1.436
  483    HE2  TYR  61           HE2      TYR  61 -21.339  -7.836  -4.105
  484    HH   TYR  61           HH       TYR  61 -23.143  -7.974  -2.031
  485    H    ILE  62           H        ILE  62 -15.794 -12.543  -2.920
  486    HA   ILE  62           HA       ILE  62 -14.600 -13.174  -5.349
  487    HB   ILE  62           HB       ILE  62 -13.790 -13.620  -2.470
  488   1HG1  ILE  62          2HG1      ILE  62 -11.967 -11.959  -3.586
  489   2HG1  ILE  62          1HG1      ILE  62 -13.358 -11.612  -4.613
  490   1HG2  ILE  62          2HG2      ILE  62 -12.571 -14.817  -4.851
  491   2HG2  ILE  62          3HG2      ILE  62 -11.446 -13.829  -3.921
  492   3HG2  ILE  62          1HG2      ILE  62 -12.291 -15.168  -3.146
  493   1HD1  ILE  62          3HD1      ILE  62 -13.579 -11.668  -1.600
  494   2HD1  ILE  62          1HD1      ILE  62 -13.117 -10.205  -2.471
  495   3HD1  ILE  62          2HD1      ILE  62 -14.692 -10.946  -2.762
  496    H    ASN  63           H        ASN  63 -15.411 -15.491  -2.730
  497    HA   ASN  63           HA       ASN  63 -14.599 -17.853  -4.028
  498   1HB   ASN  63          1HB       ASN  63 -15.970 -17.228  -1.681
  499   2HB   ASN  63          2HB       ASN  63 -17.103 -18.209  -2.579
  500   1HD2  ASN  63          1HD2      ASN  63 -14.228 -19.918  -0.564
  501   2HD2  ASN  63          2HD2      ASN  63 -13.851 -18.329  -1.024
  502    H    SER  64           H        SER  64 -17.729 -16.154  -4.242
  503    HA   SER  64           HA       SER  64 -19.087 -18.012  -5.883
  504   1HB   SER  64          2HB       SER  64 -19.239 -15.003  -5.705
  505   2HB   SER  64          1HB       SER  64 -20.282 -15.915  -6.767
  506    HG   SER  64           HG       SER  64 -21.461 -16.071  -5.036
  507    H    LEU  65           H        LEU  65 -16.761 -15.477  -6.740
  508    HA   LEU  65           HA       LEU  65 -17.042 -15.708  -9.582
  509   1HB   LEU  65          2HB       LEU  65 -14.593 -14.923  -7.980
  510   2HB   LEU  65          1HB       LEU  65 -14.850 -14.598  -9.677
  511    HG   LEU  65           HG       LEU  65 -16.779 -13.647  -7.558
  512   1HD1  LEU  65          3HD1      LEU  65 -14.212 -12.832  -7.536
  513   2HD1  LEU  65          1HD1      LEU  65 -14.835 -11.758  -8.790
  514   3HD1  LEU  65          2HD1      LEU  65 -15.552 -11.741  -7.179
  515   1HD2  LEU  65          3HD2      LEU  65 -16.550 -13.493 -10.465
  516   2HD2  LEU  65          1HD2      LEU  65 -17.933 -13.132  -9.432
  517   3HD2  LEU  65          2HD2      LEU  65 -16.707 -11.900  -9.727
  518    H    GLU  66           H        GLU  66 -15.286 -16.651 -11.017
  519    HA   GLU  66           HA       GLU  66 -14.197 -19.171  -9.824
  520   1HB   GLU  66          1HB       GLU  66 -14.616 -20.260 -12.015
  521   2HB   GLU  66          2HB       GLU  66 -16.111 -19.686 -11.277
  522   1HG   GLU  66          1HG       GLU  66 -15.092 -17.519 -12.785
  523   2HG   GLU  66          2HG       GLU  66 -14.948 -18.944 -13.813
  524    H    MET  67           H        MET  67 -12.202 -19.925 -10.814
  525    HA   MET  67           HA       MET  67 -10.280 -17.912 -11.300
  526   1HB   MET  67          1HB       MET  67 -10.276 -20.706 -11.076
  527   2HB   MET  67          2HB       MET  67  -9.621 -20.386 -12.682
  528   1HG   MET  67          1HG       MET  67  -8.587 -18.585 -10.595
  529   2HG   MET  67          2HG       MET  67  -8.167 -20.280 -10.346
  530   1HE   MET  67          1HE       MET  67  -7.930 -21.647 -12.891
  531   2HE   MET  67          3HE       MET  67  -6.278 -21.355 -13.437
  532   3HE   MET  67          2HE       MET  67  -6.603 -21.652 -11.730
  533    H    SER  68           H        SER  68  -9.937 -16.648 -13.061
  534    HA   SER  68           HA       SER  68 -10.104 -15.833 -15.256
  535   1HB   SER  68          1HB       SER  68  -9.963 -18.820 -15.709
  536   2HB   SER  68          2HB       SER  68 -10.025 -17.670 -17.044
  537    HG   SER  68           HG       SER  68  -8.181 -16.643 -16.047
  538    H    SER   1           H        SER   1  -8.240  10.605  -1.977
  539    HA   SER   1           HA       SER   1  -9.354  10.673   0.726
  540   1HB   SER   1          1HB       SER   1 -10.901  11.891  -1.584
  541   2HB   SER   1          2HB       SER   1 -11.551  11.579   0.025
  542    HG   SER   1           HG       SER   1 -10.732  13.403   0.594
  543    HA   PRO   2           HA       PRO   2 -10.671   6.674  -0.513
  544   1HB   PRO   2          1HB       PRO   2 -13.146   6.753   0.961
  545   2HB   PRO   2          2HB       PRO   2 -11.634   5.968   1.427
  546   1HG   PRO   2          1HG       PRO   2 -12.792   8.370   2.534
  547   2HG   PRO   2          2HG       PRO   2 -11.282   7.581   3.003
  548   1HD   PRO   2          1HD       PRO   2 -11.614  10.044   1.535
  549   2HD   PRO   2          2HD       PRO   2 -10.097   9.256   2.011
  550    H    TYR   3           H        TYR   3 -11.467   6.387  -2.558
  551    HA   TYR   3           HA       TYR   3 -14.253   7.236  -3.116
  552   1HB   TYR   3          1HB       TYR   3 -12.324   8.911  -3.919
  553   2HB   TYR   3          2HB       TYR   3 -12.250   7.774  -5.263
  554    HD1  TYR   3           HD1      TYR   3 -15.019   6.898  -5.596
  555    HD2  TYR   3           HD2      TYR   3 -13.472  10.823  -4.680
  556    HE1  TYR   3           HE1      TYR   3 -17.058   7.932  -6.589
  557    HE2  TYR   3           HE2      TYR   3 -15.511  11.858  -5.675
  558    HH   TYR   3           HH       TYR   3 -17.719  11.360  -6.286
  559    H    SER   4           H        SER   4 -11.514   5.996  -5.067
  560    HA   SER   4           HA       SER   4 -13.298   3.849  -6.056
  561   1HB   SER   4          1HB       SER   4 -11.429   3.390  -7.640
  562   2HB   SER   4          2HB       SER   4 -11.980   5.063  -7.724
  563    HG   SER   4           HG       SER   4  -9.551   4.179  -7.212
  564    H    SER   5           H        SER   5 -10.382   4.308  -4.124
  565    HA   SER   5           HA       SER   5  -9.159   2.792  -2.814
  566   1HB   SER   5          1HB       SER   5 -11.892   1.483  -2.831
  567   2HB   SER   5          2HB       SER   5 -10.554   0.922  -1.828
  568    HG   SER   5           HG       SER   5 -10.651   2.707  -0.645
  569    H    ASP   6           H        ASP   6  -7.683   2.040  -4.388
  570    HA   ASP   6           HA       ASP   6  -8.286  -0.690  -5.408
  571   1HB   ASP   6          1HB       ASP   6  -7.439  -0.137  -7.626
  572   2HB   ASP   6          2HB       ASP   6  -8.740   0.958  -7.238
  573    H    THR   7           H        THR   7  -5.772  -0.764  -6.910
  574    HA   THR   7           HA       THR   7  -4.062  -1.408  -4.669
  575    HB   THR   7           HB       THR   7  -4.056  -2.736  -6.763
  576    HG1  THR   7           HG1      THR   7  -2.037  -3.159  -6.409
  577   1HG2  THR   7          2HG2      THR   7  -4.311  -0.583  -8.184
  578   2HG2  THR   7          3HG2      THR   7  -2.558  -0.453  -8.048
  579   3HG2  THR   7          1HG2      THR   7  -3.279  -1.865  -8.819
  580    H    THR   8           H        THR   8  -1.987  -0.443  -4.211
  581    HA   THR   8           HA       THR   8  -1.702   2.346  -5.262
  582    HB   THR   8           HB       THR   8  -0.984   1.374  -2.479
  583    HG1  THR   8           HG1      THR   8  -3.242   2.696  -3.534
  584   1HG2  THR   8          2HG2      THR   8   0.321   3.305  -3.411
  585   2HG2  THR   8          3HG2      THR   8  -1.198   4.177  -3.621
  586   3HG2  THR   8          1HG2      THR   8  -0.650   3.735  -2.003
  587    HA   PRO   9           HA       PRO   9   2.158   0.470  -6.608
  588   1HB   PRO   9          1HB       PRO   9   2.971   3.035  -7.631
  589   2HB   PRO   9          2HB       PRO   9   2.383   1.643  -8.549
  590   1HG   PRO   9          2HG       PRO   9   0.993   4.117  -8.007
  591   2HG   PRO   9          1HG       PRO   9   0.421   2.752  -8.937
  592   1HD   PRO   9          2HD       PRO   9  -0.423   3.578  -6.337
  593   2HD   PRO   9          1HD       PRO   9  -1.000   2.207  -7.272
  594    H    CYS  10           H        CYS  10   3.770   0.215  -5.139
  595    HA   CYS  10           HA       CYS  10   5.548   2.231  -4.286
  596   1HB   CYS  10          2HB       CYS  10   4.883   2.501  -1.913
  597   2HB   CYS  10          1HB       CYS  10   3.678   3.157  -2.989
  598    H    CYS  11           H        CYS  11   7.286   1.307  -3.162
  599    HA   CYS  11           HA       CYS  11   7.004  -1.616  -2.861
  600   1HB   CYS  11          2HB       CYS  11   9.434  -1.739  -2.920
  601   2HB   CYS  11          1HB       CYS  11   8.807  -0.880  -4.316
  602    H    PHE  12           H        PHE  12   7.687  -2.694  -0.940
  603    HA   PHE  12           HA       PHE  12   7.497  -0.945   1.449
  604   1HB   PHE  12          1HB       PHE  12   6.746  -2.886   2.652
  605   2HB   PHE  12          2HB       PHE  12   5.886  -2.869   1.115
  606    HD1  PHE  12           HD1      PHE  12   6.709  -4.356  -0.791
  607    HD2  PHE  12           HD2      PHE  12   8.189  -4.690   3.251
  608    HE1  PHE  12           HE1      PHE  12   7.696  -6.579  -1.336
  609    HE2  PHE  12           HE2      PHE  12   9.158  -6.922   2.713
  610    HZ   PHE  12           HZ       PHE  12   8.917  -7.864   0.417
  611    H    ALA  13           H        ALA  13   9.469  -3.679   0.231
  612    HA   ALA  13           HA       ALA  13  11.410  -3.173   2.408
  613   1HB   ALA  13          2HB       ALA  13  11.160  -5.353   0.328
  614   2HB   ALA  13          3HB       ALA  13  12.555  -5.214   1.397
  615   3HB   ALA  13          1HB       ALA  13  10.952  -5.499   2.073
  616    H    TYR  14           H        TYR  14  13.221  -2.044   2.124
  617    HA   TYR  14           HA       TYR  14  13.745  -0.830  -0.447
  618   1HB   TYR  14          1HB       TYR  14  15.781  -0.796   1.745
  619   2HB   TYR  14          2HB       TYR  14  15.341   0.476   0.637
  620    HD1  TYR  14           HD1      TYR  14  12.622   1.045   0.821
  621    HD2  TYR  14           HD2      TYR  14  15.190  -0.406   3.973
  622    HE1  TYR  14           HE1      TYR  14  11.060   1.978   2.525
  623    HE2  TYR  14           HE2      TYR  14  13.632   0.531   5.676
  624    HH   TYR  14           HH       TYR  14  11.870   1.963   5.972
  625    H    ILE  15           H        ILE  15  15.836  -1.090  -1.615
  626    HA   ILE  15           HA       ILE  15  16.494  -3.888  -1.945
  627    HB   ILE  15           HB       ILE  15  16.591  -2.286  -3.824
  628   1HG1  ILE  15          2HG1      ILE  15  18.778  -2.988  -4.718
  629   2HG1  ILE  15          1HG1      ILE  15  19.298  -3.449  -3.098
  630   1HG2  ILE  15          2HG2      ILE  15  17.882  -0.658  -1.963
  631   2HG2  ILE  15          3HG2      ILE  15  19.162  -1.113  -3.089
  632   3HG2  ILE  15          1HG2      ILE  15  17.701  -0.323  -3.685
  633   1HD1  ILE  15          2HD1      ILE  15  16.832  -4.612  -4.410
  634   2HD1  ILE  15          3HD1      ILE  15  18.426  -5.350  -4.561
  635   3HD1  ILE  15          1HD1      ILE  15  17.670  -5.199  -2.974
  636    H    ALA  16           H        ALA  16  17.717  -1.362   0.084
  637    HA   ALA  16           HA       ALA  16  19.527  -1.314   1.580
  638   1HB   ALA  16          1HB       ALA  16  19.201  -4.315   1.272
  639   2HB   ALA  16          2HB       ALA  16  20.194  -3.538   2.505
  640   3HB   ALA  16          3HB       ALA  16  18.447  -3.300   2.503
  641    H    ARG  17           H        ARG  17  20.511  -0.569  -0.679
  642    HA   ARG  17           HA       ARG  17  23.201  -1.402  -0.795
  643   1HB   ARG  17          2HB       ARG  17  21.410  -3.228  -2.111
  644   2HB   ARG  17          1HB       ARG  17  22.434  -2.447  -3.318
  645   1HG   ARG  17          1HG       ARG  17  24.413  -2.985  -1.808
  646   2HG   ARG  17          2HG       ARG  17  23.314  -3.996  -0.870
  647   1HD   ARG  17          1HD       ARG  17  24.315  -5.482  -2.430
  648   2HD   ARG  17          2HD       ARG  17  22.724  -5.129  -3.105
  649    HE   ARG  17           HE       ARG  17  25.009  -3.475  -4.028
  650   1HH1  ARG  17          1HH2      ARG  17  22.159  -5.399  -4.956
  651   2HH1  ARG  17          2HH2      ARG  17  22.341  -4.414  -6.368
  652   1HH2  ARG  17          1HH1      ARG  17  25.872  -4.739  -5.945
  653   2HH2  ARG  17          2HH1      ARG  17  24.659  -5.374  -7.006
  654    HA   PRO  18           HA       PRO  18  22.330   2.536  -2.884
  655   1HB   PRO  18          1HB       PRO  18  25.165   2.985  -2.956
  656   2HB   PRO  18          2HB       PRO  18  23.982   3.807  -1.986
  657   1HG   PRO  18          1HG       PRO  18  25.919   1.873  -1.106
  658   2HG   PRO  18          2HG       PRO  18  24.708   2.710  -0.128
  659   1HD   PRO  18          2HD       PRO  18  24.726  -0.058  -0.913
  660   2HD   PRO  18          1HD       PRO  18  23.480   0.794   0.020
  661    H    LEU  19           H        LEU  19  21.732   1.428  -4.848
  662    HA   LEU  19           HA       LEU  19  23.826   0.405  -6.615
  663   1HB   LEU  19          1HB       LEU  19  21.843   0.333  -8.290
  664   2HB   LEU  19          2HB       LEU  19  21.802  -0.756  -6.905
  665    HG   LEU  19           HG       LEU  19  20.607   1.917  -6.451
  666   1HD1  LEU  19          3HD1      LEU  19  20.000   0.844  -8.868
  667   2HD1  LEU  19          1HD1      LEU  19  18.818   0.011  -7.856
  668   3HD1  LEU  19          2HD1      LEU  19  18.848   1.773  -7.909
  669   1HD2  LEU  19          3HD2      LEU  19  20.433  -0.825  -5.487
  670   2HD2  LEU  19          1HD2      LEU  19  19.922   0.667  -4.698
  671   3HD2  LEU  19          2HD2      LEU  19  18.833  -0.157  -5.814
  672    HA   PRO  20           HA       PRO  20  24.906   4.376  -8.257
  673   1HB   PRO  20          1HB       PRO  20  25.622   3.199 -10.809
  674   2HB   PRO  20          2HB       PRO  20  26.693   3.813  -9.545
  675   1HG   PRO  20          1HG       PRO  20  26.194   1.066 -10.237
  676   2HG   PRO  20          2HG       PRO  20  27.224   1.678  -8.939
  677   1HD   PRO  20          1HD       PRO  20  24.672   0.362  -8.697
  678   2HD   PRO  20          2HD       PRO  20  25.699   0.988  -7.394
  679    H    ARG  21           H        ARG  21  23.646   5.886  -9.251
  680    HA   ARG  21           HA       ARG  21  21.123   5.325 -10.350
  681   1HB   ARG  21          1HB       ARG  21  21.030   7.611 -11.031
  682   2HB   ARG  21          2HB       ARG  21  21.990   7.585  -9.576
  683   1HG   ARG  21          2HG       ARG  21  23.189   7.544 -12.357
  684   2HG   ARG  21          1HG       ARG  21  22.944   9.017 -11.422
  685   1HD   ARG  21          2HD       ARG  21  24.257   7.742  -9.553
  686   2HD   ARG  21          1HD       ARG  21  24.817   6.728 -10.881
  687    HE   ARG  21           HE       ARG  21  25.290   9.280 -11.808
  688   1HH1  ARG  21          2HH1      ARG  21  26.026  10.203  -8.762
  689   2HH1  ARG  21          1HH1      ARG  21  27.251  10.752  -9.858
  690   1HH2  ARG  21          1HH2      ARG  21  27.203   7.119  -9.872
  691   2HH2  ARG  21          2HH2      ARG  21  28.352   8.271 -10.467
  692    H    ALA  22           H        ALA  22  24.252   5.143 -11.848
  693    HA   ALA  22           HA       ALA  22  23.615   5.436 -14.573
  694   1HB   ALA  22          2HB       ALA  22  25.735   4.190 -13.020
  695   2HB   ALA  22          3HB       ALA  22  25.373   3.255 -14.471
  696   3HB   ALA  22          1HB       ALA  22  25.822   4.955 -14.607
  697    H    HIS  23           H        HIS  23  23.516   2.432 -12.633
  698    HA   HIS  23           HA       HIS  23  22.288   0.885 -14.733
  699   1HB   HIS  23          2HB       HIS  23  22.040   0.365 -11.760
  700   2HB   HIS  23          1HB       HIS  23  21.972  -0.812 -13.070
  701    HD2  HIS  23           HD2      HIS  23  24.822   0.875 -14.392
  702    HE1  HIS  23           HE1      HIS  23  26.564  -1.219 -11.158
  703    HE2  HIS  23           HE2      HIS  23  27.047   0.030 -13.322
  704    H    ILE  24           H        ILE  24  21.079   3.115 -12.328
  705    HA   ILE  24           HA       ILE  24  18.306   2.204 -12.672
  706    HB   ILE  24           HB       ILE  24  19.137   4.769 -11.357
  707   1HG1  ILE  24          2HG1      ILE  24  18.928   2.114  -9.948
  708   2HG1  ILE  24          1HG1      ILE  24  20.472   2.782 -10.481
  709   1HG2  ILE  24          1HG2      ILE  24  16.714   3.146 -11.587
  710   2HG2  ILE  24          2HG2      ILE  24  17.098   3.585  -9.924
  711   3HG2  ILE  24          3HG2      ILE  24  16.890   4.843 -11.142
  712   1HD1  ILE  24          2HD1      ILE  24  19.610   4.932  -9.202
  713   2HD1  ILE  24          3HD1      ILE  24  18.588   3.769  -8.359
  714   3HD1  ILE  24          1HD1      ILE  24  20.343   3.606  -8.300
  715    H    LYS  25           H        LYS  25  16.629   3.780 -13.404
  716    HA   LYS  25           HA       LYS  25  17.718   5.693 -15.428
  717   1HB   LYS  25          1HB       LYS  25  15.354   3.816 -15.623
  718   2HB   LYS  25          2HB       LYS  25  15.575   5.183 -16.715
  719   1HG   LYS  25          1HG       LYS  25  17.699   4.304 -17.481
  720   2HG   LYS  25          2HG       LYS  25  17.655   3.024 -16.270
  721   1HD   LYS  25          1HD       LYS  25  16.177   1.763 -17.469
  722   2HD   LYS  25          2HD       LYS  25  15.284   3.173 -18.038
  723   1HE   LYS  25          1HE       LYS  25  17.975   2.235 -19.079
  724   2HE   LYS  25          2HE       LYS  25  16.431   2.076 -19.916
  725   1HZ   LYS  25          3HZ       LYS  25  16.371   4.649 -19.471
  726   2HZ   LYS  25          1HZ       LYS  25  18.058   4.461 -19.447
  727   3HZ   LYS  25          2HZ       LYS  25  17.172   4.006 -20.822
  728    H    GLU  26           H        GLU  26  15.687   5.240 -12.694
  729    HA   GLU  26           HA       GLU  26  15.086   8.001 -12.420
  730   1HB   GLU  26          1HB       GLU  26  12.457   7.441 -12.682
  731   2HB   GLU  26          2HB       GLU  26  13.414   8.070 -14.001
  732   1HG   GLU  26          1HG       GLU  26  13.536   5.145 -13.786
  733   2HG   GLU  26          2HG       GLU  26  11.914   5.758 -14.071
  734    H    TYR  27           H        TYR  27  12.654   7.709 -10.918
  735    HA   TYR  27           HA       TYR  27  13.006   5.469  -9.078
  736   1HB   TYR  27          2HB       TYR  27  13.507   6.792  -7.131
  737   2HB   TYR  27          1HB       TYR  27  14.669   7.252  -8.344
  738    HD1  TYR  27           HD1      TYR  27  14.346   9.374  -9.684
  739    HD2  TYR  27           HD2      TYR  27  11.887   8.377  -6.276
  740    HE1  TYR  27           HE1      TYR  27  13.521  11.724  -9.591
  741    HE2  TYR  27           HE2      TYR  27  11.072  10.732  -6.176
  742    HH   TYR  27           HH       TYR  27  10.943  12.688  -7.371
  743    H    PHE  28           H        PHE  28  11.262   5.940  -7.175
  744    HA   PHE  28           HA       PHE  28   9.054   7.535  -8.246
  745   1HB   PHE  28          2HB       PHE  28   8.423   5.600  -9.376
  746   2HB   PHE  28          1HB       PHE  28   9.041   4.547  -8.135
  747    HD1  PHE  28           HD1      PHE  28   6.727   7.485  -7.872
  748    HD2  PHE  28           HD2      PHE  28   7.219   3.223  -7.405
  749    HE1  PHE  28           HE1      PHE  28   4.525   7.358  -6.716
  750    HE2  PHE  28           HE2      PHE  28   5.013   3.094  -6.259
  751    HZ   PHE  28           HZ       PHE  28   3.656   5.158  -5.928
  752    H    TYR  29           H        TYR  29   9.530   8.747  -6.274
  753    HA   TYR  29           HA       TYR  29   9.536   7.675  -3.672
  754   1HB   TYR  29          1HB       TYR  29  10.096  10.019  -4.138
  755   2HB   TYR  29          2HB       TYR  29   8.419  10.340  -4.575
  756    HD1  TYR  29           HD2      TYR  29  10.526   9.020  -1.758
  757    HD2  TYR  29           HD1      TYR  29   6.880  11.015  -2.925
  758    HE1  TYR  29           HE2      TYR  29   9.971   9.406   0.639
  759    HE2  TYR  29           HE1      TYR  29   6.323  11.401  -0.527
  760    HH   TYR  29           HH       TYR  29   6.888  10.387   1.683
  761    H    THR  30           H        THR  30   7.979   6.894  -2.368
  762    HA   THR  30           HA       THR  30   5.362   6.290  -3.447
  763    HB   THR  30           HB       THR  30   6.328   6.101  -0.578
  764    HG1  THR  30           HG1      THR  30   7.624   4.754  -1.600
  765   1HG2  THR  30          2HG2      THR  30   4.006   4.886  -2.094
  766   2HG2  THR  30          3HG2      THR  30   4.564   4.268  -0.539
  767   3HG2  THR  30          1HG2      THR  30   3.936   5.911  -0.661
  768    H    SER  31           H        SER  31   3.310   7.020  -2.493
  769    HA   SER  31           HA       SER  31   3.247   9.887  -2.128
  770   1HB   SER  31          1HB       SER  31   1.186   7.693  -1.944
  771   2HB   SER  31          2HB       SER  31   0.786   9.351  -1.497
  772    HG   SER  31           HG       SER  31   1.580   8.317  -3.990
  773    H    GLY  32           H        GLY  32   1.898   7.430   0.097
  774   1HA   GLY  32          2HA       GLY  32   3.367   7.804   2.380
  775   2HA   GLY  32          1HA       GLY  32   2.334   9.233   2.364
  776    H    LYS  33           H        LYS  33   1.732   5.811   1.489
  777    HA   LYS  33           HA       LYS  33  -0.129   5.514   3.744
  778   1HB   LYS  33          1HB       LYS  33  -2.043   4.934   2.225
  779   2HB   LYS  33          2HB       LYS  33  -1.589   6.637   2.171
  780   1HG   LYS  33          2HG       LYS  33  -0.782   6.483   0.031
  781   2HG   LYS  33          1HG       LYS  33  -0.196   4.852   0.255
  782   1HD   LYS  33          1HD       LYS  33  -2.249   3.894  -0.244
  783   2HD   LYS  33          2HD       LYS  33  -3.148   5.317   0.281
  784   1HE   LYS  33          1HE       LYS  33  -1.324   5.581  -2.077
  785   2HE   LYS  33          2HE       LYS  33  -2.869   4.761  -2.301
  786   1HZ   LYS  33          1HZ       LYS  33  -3.824   6.782  -1.076
  787   2HZ   LYS  33          2HZ       LYS  33  -2.356   7.542  -1.466
  788   3HZ   LYS  33          3HZ       LYS  33  -3.369   6.969  -2.702
  789    H    CYS  34           H        CYS  34   2.315   4.221   2.435
  790    HA   CYS  34           HA       CYS  34   1.149   1.493   2.062
  791   1HB   CYS  34          2HB       CYS  34   3.736   2.698   1.062
  792   2HB   CYS  34          1HB       CYS  34   3.377   0.992   0.962
  793    H    SER  35           H        SER  35   2.304   3.235   4.505
  794    HA   SER  35           HA       SER  35   3.439   2.740   6.493
  795   1HB   SER  35          1HB       SER  35   1.821   0.588   5.889
  796   2HB   SER  35          2HB       SER  35   3.398  -0.172   6.106
  797    HG   SER  35           HG       SER  35   1.807   0.493   7.992
  798    H    ASN  36           H        ASN  36   4.896   2.715   3.782
  799    HA   ASN  36           HA       ASN  36   7.512   2.055   4.826
  800   1HB   ASN  36          1HB       ASN  36   6.102   0.103   3.044
  801   2HB   ASN  36          2HB       ASN  36   7.828   0.368   2.800
  802   1HD2  ASN  36          2HD2      ASN  36   8.114  -0.210   6.515
  803   2HD2  ASN  36          1HD2      ASN  36   9.116   0.231   5.218
  804    HA   PRO  37           HA       PRO  37   6.929   5.152   1.340
  805   1HB   PRO  37          1HB       PRO  37   8.797   6.796   2.841
  806   2HB   PRO  37          2HB       PRO  37   7.119   7.153   2.416
  807   1HG   PRO  37          1HG       PRO  37   8.143   6.439   5.000
  808   2HG   PRO  37          2HG       PRO  37   6.471   6.727   4.564
  809   1HD   PRO  37          1HD       PRO  37   7.715   4.210   5.195
  810   2HD   PRO  37          2HD       PRO  37   6.025   4.499   4.737
  811    H    ALA  38           H        ALA  38   8.636   5.706  -0.197
  812    HA   ALA  38           HA       ALA  38  11.402   5.074   0.306
  813   1HB   ALA  38          2HB       ALA  38  10.202   2.770   0.180
  814   2HB   ALA  38          3HB       ALA  38  10.045   3.104  -1.546
  815   3HB   ALA  38          1HB       ALA  38  11.644   2.996  -0.808
  816    H    VAL  39           H        VAL  39  12.121   4.310  -2.281
  817    HA   VAL  39           HA       VAL  39  10.973   6.352  -4.093
  818    HB   VAL  39           HB       VAL  39  13.490   6.715  -4.817
  819   1HG1  VAL  39          3HG1      VAL  39  12.232   7.963  -2.368
  820   2HG1  VAL  39          1HG1      VAL  39  13.593   8.651  -3.251
  821   3HG1  VAL  39          2HG1      VAL  39  12.024   8.489  -4.039
  822   1HG2  VAL  39          3HG2      VAL  39  14.392   5.071  -3.172
  823   2HG2  VAL  39          1HG2      VAL  39  15.049   6.694  -2.936
  824   3HG2  VAL  39          2HG2      VAL  39  13.784   6.090  -1.861
  825    H    VAL  40           H        VAL  40  10.054   4.565  -5.053
  826    HA   VAL  40           HA       VAL  40  11.335   2.150  -5.627
  827    HB   VAL  40           HB       VAL  40   8.909   3.564  -6.519
  828   1HG1  VAL  40          2HG1      VAL  40   9.867   2.876  -8.707
  829   2HG1  VAL  40          3HG1      VAL  40   9.991   1.225  -8.108
  830   3HG1  VAL  40          1HG1      VAL  40   8.409   1.976  -8.309
  831   1HG2  VAL  40          3HG2      VAL  40   9.759   0.907  -5.425
  832   2HG2  VAL  40          1HG2      VAL  40   8.598   2.061  -4.767
  833   3HG2  VAL  40          2HG2      VAL  40   8.161   1.066  -6.157
  834    H    PHE  41           H        PHE  41  13.165   1.909  -6.717
  835    HA   PHE  41           HA       PHE  41  13.971   3.816  -8.743
  836   1HB   PHE  41          1HB       PHE  41  15.130   1.291  -7.592
  837   2HB   PHE  41          2HB       PHE  41  15.760   1.895  -9.121
  838    HD1  PHE  41           HD2      PHE  41  15.573   4.860  -8.694
  839    HD2  PHE  41           HD1      PHE  41  16.872   1.700  -6.058
  840    HE1  PHE  41           HE2      PHE  41  17.072   6.462  -7.514
  841    HE2  PHE  41           HE1      PHE  41  18.385   3.296  -4.891
  842    HZ   PHE  41           HZ       PHE  41  18.499   5.672  -5.623
  843    H    VAL  42           H        VAL  42  13.866   3.634 -10.834
  844    HA   VAL  42           HA       VAL  42  12.511   1.215 -11.968
  845    HB   VAL  42           HB       VAL  42  12.231   3.346 -13.781
  846   1HG1  VAL  42          1HG2      VAL  42  10.660   1.468 -13.188
  847   2HG1  VAL  42          2HG2      VAL  42  10.252   2.362 -11.720
  848   3HG1  VAL  42          3HG2      VAL  42   9.866   3.040 -13.304
  849   1HG2  VAL  42          2HG1      VAL  42  11.517   4.236 -10.976
  850   2HG2  VAL  42          3HG1      VAL  42  12.763   4.943 -11.993
  851   3HG2  VAL  42          1HG1      VAL  42  11.074   5.077 -12.462
  852    H    THR  43           H        THR  43  14.752   0.407 -12.102
  853    HA   THR  43           HA       THR  43  16.791   1.873 -13.571
  854    HB   THR  43           HB       THR  43  18.240   0.069 -13.006
  855    HG1  THR  43           HG1      THR  43  15.981  -1.472 -12.309
  856   1HG2  THR  43          2HG2      THR  43  17.408   1.413 -11.073
  857   2HG2  THR  43          3HG2      THR  43  16.156   0.201 -10.810
  858   3HG2  THR  43          1HG2      THR  43  17.854  -0.231 -10.621
  859    H    ARG  44           H        ARG  44  18.114  -0.186 -14.911
  860    HA   ARG  44           HA       ARG  44  17.186   0.076 -17.502
  861   1HB   ARG  44          1HB       ARG  44  18.420  -2.193 -17.904
  862   2HB   ARG  44          2HB       ARG  44  19.350  -0.804 -17.357
  863   1HG   ARG  44          1HG       ARG  44  20.018  -1.979 -15.563
  864   2HG   ARG  44          2HG       ARG  44  18.345  -2.110 -15.029
  865   1HD   ARG  44          1HD       ARG  44  18.965  -4.357 -15.257
  866   2HD   ARG  44          2HD       ARG  44  18.201  -4.025 -16.811
  867    HE   ARG  44           HE       ARG  44  21.022  -3.464 -16.945
  868   1HH1  ARG  44          1HH2      ARG  44  19.279  -5.252 -18.991
  869   2HH1  ARG  44          2HH2      ARG  44  19.208  -6.715 -18.067
  870   1HH2  ARG  44          1HH1      ARG  44  21.502  -6.616 -16.259
  871   2HH2  ARG  44          2HH1      ARG  44  22.341  -5.986 -17.637
  872    H    LYS  45           H        LYS  45  16.699  -2.919 -15.555
  873    HA   LYS  45           HA       LYS  45  14.694  -4.013 -17.289
  874   1HB   LYS  45          1HB       LYS  45  15.761  -5.318 -15.450
  875   2HB   LYS  45          2HB       LYS  45  14.925  -4.308 -14.272
  876   1HG   LYS  45          1HG       LYS  45  13.646  -6.353 -14.583
  877   2HG   LYS  45          2HG       LYS  45  12.748  -5.014 -15.299
  878   1HD   LYS  45          1HD       LYS  45  13.398  -5.635 -17.511
  879   2HD   LYS  45          2HD       LYS  45  14.631  -6.745 -16.913
  880   1HE   LYS  45          1HE       LYS  45  12.917  -8.218 -15.994
  881   2HE   LYS  45          2HE       LYS  45  11.652  -7.076 -16.444
  882   1HZ   LYS  45          1HZ       LYS  45  13.467  -8.009 -18.538
  883   2HZ   LYS  45          2HZ       LYS  45  12.289  -9.094 -17.976
  884   3HZ   LYS  45          3HZ       LYS  45  11.822  -7.599 -18.633
  885    H    ASN  46           H        ASN  46  14.742  -1.613 -14.791
  886    HA   ASN  46           HA       ASN  46  13.300   0.082 -14.235
  887   1HB   ASN  46          1HB       ASN  46  12.569  -0.685 -16.928
  888   2HB   ASN  46          2HB       ASN  46  11.101  -0.321 -16.029
  889   1HD2  ASN  46          1HD2      ASN  46  11.604   2.955 -16.976
  890   2HD2  ASN  46          2HD2      ASN  46  11.638   1.600 -17.999
  891    H    ARG  47           H        ARG  47  12.857  -2.901 -13.471
  892    HA   ARG  47           HA       ARG  47  10.056  -3.124 -12.848
  893   1HB   ARG  47          1HB       ARG  47  12.581  -4.283 -11.745
  894   2HB   ARG  47          2HB       ARG  47  11.176  -4.316 -10.708
  895   1HG   ARG  47          1HG       ARG  47  11.136  -5.320 -13.559
  896   2HG   ARG  47          2HG       ARG  47  11.464  -6.364 -12.175
  897   1HD   ARG  47          1HD       ARG  47   9.077  -4.658 -11.871
  898   2HD   ARG  47          2HD       ARG  47   8.957  -5.846 -13.168
  899    HE   ARG  47           HE       ARG  47   9.688  -6.648 -10.379
  900   1HH1  ARG  47          2HH1      ARG  47   6.834  -6.495 -12.060
  901   2HH1  ARG  47          1HH1      ARG  47   6.886  -8.081 -12.755
  902   1HH2  ARG  47          2HH2      ARG  47   9.553  -9.073 -10.750
  903   2HH2  ARG  47          1HH2      ARG  47   7.949  -9.562 -11.184
  904    H    GLN  48           H        GLN  48   9.164  -2.514 -10.580
  905    HA   GLN  48           HA       GLN  48  10.319   0.111 -10.000
  906   1HB   GLN  48          1HB       GLN  48   7.715  -1.196  -9.470
  907   2HB   GLN  48          2HB       GLN  48   8.225   0.070  -8.348
  908   1HG   GLN  48          1HG       GLN  48   8.622   1.595 -10.230
  909   2HG   GLN  48          2HG       GLN  48   8.229   0.327 -11.377
  910   1HE2  GLN  48          1HE2      GLN  48   5.384   2.313  -9.227
  911   2HE2  GLN  48          2HE2      GLN  48   6.414   1.307  -8.326
  912    H    VAL  49           H        VAL  49  12.178  -1.035  -9.313
  913    HA   VAL  49           HA       VAL  49  12.507  -2.677  -7.100
  914    HB   VAL  49           HB       VAL  49  14.534  -0.545  -7.453
  915   1HG1  VAL  49          3HG1      VAL  49  14.330  -3.440  -6.912
  916   2HG1  VAL  49          1HG1      VAL  49  15.765  -2.926  -7.800
  917   3HG1  VAL  49          2HG1      VAL  49  15.417  -2.239  -6.212
  918   1HG2  VAL  49          3HG2      VAL  49  13.599  -2.278  -9.738
  919   2HG2  VAL  49          1HG2      VAL  49  14.219  -0.632  -9.800
  920   3HG2  VAL  49          2HG2      VAL  49  15.325  -1.983  -9.565
  921    H    CYS  50           H        CYS  50  13.919  -1.634  -5.135
  922    HA   CYS  50           HA       CYS  50  12.390   0.652  -3.977
  923   1HB   CYS  50          2HB       CYS  50  12.000  -1.954  -3.246
  924   2HB   CYS  50          1HB       CYS  50  13.302  -1.527  -2.175
  925    H    ALA  51           H        ALA  51  13.693   1.907  -2.408
  926    HA   ALA  51           HA       ALA  51  16.416   0.979  -1.850
  927   1HB   ALA  51          3HB       ALA  51  16.695   1.924  -4.109
  928   2HB   ALA  51          1HB       ALA  51  15.989   3.445  -3.563
  929   3HB   ALA  51          2HB       ALA  51  17.537   2.906  -2.912
  930    H    ASN  52           H        ASN  52  13.908   2.008  -0.491
  931    HA   ASN  52           HA       ASN  52  13.504   3.227   1.463
  932   1HB   ASN  52          1HB       ASN  52  15.702   2.145   2.071
  933   2HB   ASN  52          2HB       ASN  52  16.511   3.601   1.497
  934   1HD2  ASN  52          2HD2      ASN  52  14.997   2.727   4.854
  935   2HD2  ASN  52          1HD2      ASN  52  13.615   3.393   4.128
  936    HA   PRO  53           HA       PRO  53  13.497   7.344  -0.140
  937   1HB   PRO  53          2HB       PRO  53  12.245   8.547   2.026
  938   2HB   PRO  53          1HB       PRO  53  11.395   7.670   0.752
  939   1HG   PRO  53          2HG       PRO  53  11.864   6.871   3.554
  940   2HG   PRO  53          1HG       PRO  53  10.715   6.209   2.389
  941   1HD   PRO  53          2HD       PRO  53  13.223   5.072   3.205
  942   2HD   PRO  53          1HD       PRO  53  12.111   4.444   1.998
  943    H    GLU  54           H        GLU  54  14.164   7.154   3.381
  944    HA   GLU  54           HA       GLU  54  16.132   9.363   3.064
  945   1HB   GLU  54          1HB       GLU  54  16.026   9.433   5.577
  946   2HB   GLU  54          2HB       GLU  54  14.480   9.752   4.789
  947   1HG   GLU  54          1HG       GLU  54  13.537   7.875   5.645
  948   2HG   GLU  54          2HG       GLU  54  14.963   6.898   5.299
  949    H    LYS  55           H        LYS  55  17.400   7.392   1.996
  950    HA   LYS  55           HA       LYS  55  18.969   6.055   4.158
  951   1HB   LYS  55          2HB       LYS  55  17.824   5.005   1.757
  952   2HB   LYS  55          1HB       LYS  55  19.579   4.890   1.645
  953   1HG   LYS  55          1HG       LYS  55  18.386   4.129   4.256
  954   2HG   LYS  55          2HG       LYS  55  18.065   3.037   2.908
  955   1HD   LYS  55          1HD       LYS  55  20.316   2.518   2.620
  956   2HD   LYS  55          2HD       LYS  55  20.863   4.033   3.338
  957   1HE   LYS  55          1HE       LYS  55  20.016   3.214   5.556
  958   2HE   LYS  55          2HE       LYS  55  19.655   1.664   4.796
  959   1HZ   LYS  55          3HZ       LYS  55  22.340   2.772   4.447
  960   2HZ   LYS  55          1HZ       LYS  55  21.947   2.117   5.964
  961   3HZ   LYS  55          2HZ       LYS  55  21.842   1.153   4.568
  962    H    LYS  56           H        LYS  56  19.236   8.802   2.993
  963    HA   LYS  56           HA       LYS  56  20.973  10.243   2.410
  964   1HB   LYS  56          1HB       LYS  56  22.398   7.826   3.446
  965   2HB   LYS  56          2HB       LYS  56  23.342   9.069   2.627
  966   1HG   LYS  56          1HG       LYS  56  22.507  10.770   4.161
  967   2HG   LYS  56          2HG       LYS  56  21.436   9.597   4.927
  968   1HD   LYS  56          1HD       LYS  56  23.494   8.244   5.511
  969   2HD   LYS  56          2HD       LYS  56  24.466   9.603   4.945
  970   1HE   LYS  56          1HE       LYS  56  24.272   9.997   7.263
  971   2HE   LYS  56          2HE       LYS  56  23.025  11.031   6.567
  972   1HZ   LYS  56          2HZ       LYS  56  21.512   9.020   6.894
  973   2HZ   LYS  56          3HZ       LYS  56  22.716   8.437   7.941
  974   3HZ   LYS  56          1HZ       LYS  56  21.945   9.914   8.271
  975    H    TRP  57           H        TRP  57  22.772   7.434   1.268
  976    HA   TRP  57           HA       TRP  57  23.480   8.462  -1.205
  977   1HB   TRP  57          1HB       TRP  57  23.968   6.200  -1.885
  978   2HB   TRP  57          2HB       TRP  57  24.366   6.375  -0.174
  979    HD1  TRP  57           HD1      TRP  57  23.104   4.767   1.460
  980    HE1  TRP  57           HE1      TRP  57  21.420   2.851   1.060
  981    HE3  TRP  57           HE3      TRP  57  21.901   5.736  -3.358
  982    HZ2  TRP  57           HZ2      TRP  57  19.789   1.833  -1.105
  983    HZ3  TRP  57           HZ3      TRP  57  20.385   4.279  -4.614
  984    HH2  TRP  57           HH2      TRP  57  19.316   2.323  -3.500
  985    H    VAL  58           H        VAL  58  20.329   7.238  -0.355
  986    HA   VAL  58           HA       VAL  58  19.536   6.935  -3.173
  987    HB   VAL  58           HB       VAL  58  17.139   7.051  -1.948
  988   1HG1  VAL  58          3HG1      VAL  58  18.511   5.171  -3.195
  989   2HG1  VAL  58          1HG1      VAL  58  18.683   4.533  -1.558
  990   3HG1  VAL  58          2HG1      VAL  58  17.080   4.777  -2.255
  991   1HG2  VAL  58          1HG2      VAL  58  18.205   7.543   0.245
  992   2HG2  VAL  58          2HG2      VAL  58  17.229   6.073   0.251
  993   3HG2  VAL  58          3HG2      VAL  58  18.987   5.967   0.162
  994    H    ARG  59           H        ARG  59  18.779   9.257  -0.556
  995    HA   ARG  59           HA       ARG  59  17.192  10.959  -2.211
  996   1HB   ARG  59          1HB       ARG  59  18.929  11.861   0.111
  997   2HB   ARG  59          2HB       ARG  59  17.454  12.626  -0.482
  998   1HG   ARG  59          2HG       ARG  59  16.262  10.448   0.077
  999   2HG   ARG  59          1HG       ARG  59  17.713   9.960   0.916
 1000   1HD   ARG  59          1HD       ARG  59  16.475  12.627   1.524
 1001   2HD   ARG  59          2HD       ARG  59  15.810  11.166   2.255
 1002    HE   ARG  59           HE       ARG  59  18.724  11.569   2.541
 1003   1HH1  ARG  59          2HH2      ARG  59  16.446  13.349   4.478
 1004   2HH1  ARG  59          1HH2      ARG  59  15.647  11.853   4.827
 1005   1HH2  ARG  59          2HH1      ARG  59  18.268  10.113   5.070
 1006   2HH2  ARG  59          1HH1      ARG  59  18.879  11.658   5.561
 1007    H    GLU  60           H        GLU  60  20.614  10.454  -2.015
 1008    HA   GLU  60           HA       GLU  60  21.238  12.983  -3.409
 1009   1HB   GLU  60          2HB       GLU  60  22.676  11.123  -1.748
 1010   2HB   GLU  60          1HB       GLU  60  23.511  11.286  -3.273
 1011   1HG   GLU  60          1HG       GLU  60  22.705  13.889  -2.543
 1012   2HG   GLU  60          2HG       GLU  60  23.359  13.164  -1.095
 1013    H    TYR  61           H        TYR  61  20.575   9.673  -4.134
 1014    HA   TYR  61           HA       TYR  61  21.956   9.722  -6.734
 1015   1HB   TYR  61          1HB       TYR  61  20.315   7.732  -5.201
 1016   2HB   TYR  61          2HB       TYR  61  20.485   7.523  -6.925
 1017    HD1  TYR  61           HD1      TYR  61  23.087   9.054  -4.753
 1018    HD2  TYR  61           HD2      TYR  61  21.831   5.502  -6.873
 1019    HE1  TYR  61           HE1      TYR  61  25.323   8.032  -4.368
 1020    HE2  TYR  61           HE2      TYR  61  24.080   4.492  -6.491
 1021    HH   TYR  61           HH       TYR  61  25.990   4.906  -4.585
 1022    H    ILE  62           H        ILE  62  18.595   9.340  -5.637
 1023    HA   ILE  62           HA       ILE  62  17.225   9.638  -8.036
 1024    HB   ILE  62           HB       ILE  62  16.613  10.481  -5.198
 1025   1HG1  ILE  62          2HG1      ILE  62  14.728   8.686  -5.950
 1026   2HG1  ILE  62          1HG1      ILE  62  16.053   8.195  -7.005
 1027   1HG2  ILE  62          2HG2      ILE  62  15.225  11.339  -7.633
 1028   2HG2  ILE  62          3HG2      ILE  62  14.173  10.491  -6.501
 1029   3HG2  ILE  62          1HG2      ILE  62  15.059  11.923  -5.978
 1030   1HD1  ILE  62          3HD1      ILE  62  16.462   8.671  -4.049
 1031   2HD1  ILE  62          1HD1      ILE  62  15.957   7.103  -4.677
 1032   3HD1  ILE  62          2HD1      ILE  62  17.505   7.791  -5.167
 1033    H    ASN  63           H        ASN  63  18.201  12.293  -5.828
 1034    HA   ASN  63           HA       ASN  63  17.289  14.453  -7.386
 1035   1HB   ASN  63          2HB       ASN  63  18.816  14.158  -5.072
 1036   2HB   ASN  63          1HB       ASN  63  19.880  15.000  -6.171
 1037   1HD2  ASN  63          1HD2      ASN  63  17.136  16.984  -4.229
 1038   2HD2  ASN  63          2HD2      ASN  63  16.738  15.347  -4.436
 1039    H    SER  64           H        SER  64  20.404  12.725  -7.570
 1040    HA   SER  64           HA       SER  64  21.641  14.329  -9.542
 1041   1HB   SER  64          1HB       SER  64  21.822  11.375  -8.950
 1042   2HB   SER  64          2HB       SER  64  22.786  12.125 -10.199
 1043    HG   SER  64           HG       SER  64  24.078  12.516  -8.589
 1044    H    LEU  65           H        LEU  65  19.274  11.711  -9.874
 1045    HA   LEU  65           HA       LEU  65  19.367  11.536 -12.732
 1046   1HB   LEU  65          1HB       LEU  65  17.034  10.992 -10.877
 1047   2HB   LEU  65          2HB       LEU  65  17.179  10.432 -12.524
 1048    HG   LEU  65           HG       LEU  65  19.251   9.780 -10.429
 1049   1HD1  LEU  65          3HD1      LEU  65  16.697   8.985 -10.121
 1050   2HD1  LEU  65          1HD1      LEU  65  17.240   7.743 -11.250
 1051   3HD1  LEU  65          2HD1      LEU  65  18.063   7.950  -9.704
 1052   1HD2  LEU  65          3HD2      LEU  65  18.828   9.220 -13.264
 1053   2HD2  LEU  65          1HD2      LEU  65  20.279   9.002 -12.286
 1054   3HD2  LEU  65          2HD2      LEU  65  19.042   7.745 -12.321
 1055    H    GLU  66           H        GLU  66  17.515  12.275 -14.167
 1056    HA   GLU  66           HA       GLU  66  16.494  14.940 -13.270
 1057   1HB   GLU  66          1HB       GLU  66  16.760  15.709 -15.615
 1058   2HB   GLU  66          2HB       GLU  66  18.304  15.238 -14.905
 1059   1HG   GLU  66          1HG       GLU  66  17.198  12.886 -16.023
 1060   2HG   GLU  66          2HG       GLU  66  16.978  14.154 -17.229
 1061    H    MET  67           H        MET  67  14.433  15.556 -14.221
 1062    HA   MET  67           HA       MET  67  12.493  13.503 -14.290
 1063   1HB   MET  67          1HB       MET  67  12.489  16.300 -14.461
 1064   2HB   MET  67          2HB       MET  67  11.732  15.760 -15.960
 1065   1HG   MET  67          1HG       MET  67  10.848  14.275 -13.576
 1066   2HG   MET  67          2HG       MET  67  10.437  15.989 -13.540
 1067   1HE   MET  67          1HE       MET  67  10.023  16.986 -16.231
 1068   2HE   MET  67          3HE       MET  67   8.341  16.628 -16.620
 1069   3HE   MET  67          2HE       MET  67   8.777  17.160 -14.995
 1070    H    SER  68           H        SER  68  12.041  12.005 -15.829
 1071    HA   SER  68           HA       SER  68  12.067  10.889 -17.894
 1072   1HB   SER  68          1HB       SER  68  11.880  13.783 -18.752
 1073   2HB   SER  68          2HB       SER  68  11.859  12.456 -19.913
 1074    HG   SER  68           HG       SER  68  10.091  11.587 -18.661
   
  No H/Q in entry =        1074
  Start of MODEL    3
    1    H    SER   1           H        SER   1  17.549 -15.283   1.216
    2    HA   SER   1           HA       SER   1  15.726 -17.405   0.198
    3   1HB   SER   1          1HB       SER   1  13.951 -15.456   0.940
    4   2HB   SER   1          2HB       SER   1  14.314 -16.886   1.907
    5    HG   SER   1           HG       SER   1  14.666 -15.194   3.239
    6    HA   PRO   2           HA       PRO   2  15.443 -15.039  -3.473
    7   1HB   PRO   2          1HB       PRO   2  12.567 -14.871  -3.621
    8   2HB   PRO   2          2HB       PRO   2  13.635 -15.974  -4.495
    9   1HG   PRO   2          1HG       PRO   2  11.856 -16.598  -2.310
   10   2HG   PRO   2          2HG       PRO   2  12.924 -17.701  -3.183
   11   1HD   PRO   2          1HD       PRO   2  13.235 -16.690  -0.499
   12   2HD   PRO   2          2HD       PRO   2  14.306 -17.799  -1.376
   13    H    TYR   3           H        TYR   3  15.949 -12.888  -3.383
   14    HA   TYR   3           HA       TYR   3  14.577 -11.070  -1.564
   15   1HB   TYR   3          1HB       TYR   3  16.995 -11.063  -3.149
   16   2HB   TYR   3          2HB       TYR   3  16.092  -9.572  -3.415
   17    HD1  TYR   3           HD1      TYR   3  14.772  -9.036  -0.887
   18    HD2  TYR   3           HD2      TYR   3  18.720 -10.629  -1.611
   19    HE1  TYR   3           HE1      TYR   3  15.520  -8.189   1.335
   20    HE2  TYR   3           HE2      TYR   3  19.468  -9.782   0.612
   21    HH   TYR   3           HH       TYR   3  18.907  -8.319   2.312
   22    H    SER   4           H        SER   4  13.880  -8.846  -2.606
   23    HA   SER   4           HA       SER   4  12.807  -8.836  -5.267
   24   1HB   SER   4          1HB       SER   4  11.289 -10.532  -4.175
   25   2HB   SER   4          2HB       SER   4  10.750  -9.258  -3.082
   26    HG   SER   4           HG       SER   4  10.381  -9.512  -5.852
   27    H    SER   5           H        SER   5  14.258  -7.069  -3.506
   28    HA   SER   5           HA       SER   5  12.670  -5.059  -2.296
   29   1HB   SER   5          1HB       SER   5  15.348  -4.834  -3.703
   30   2HB   SER   5          2HB       SER   5  14.640  -3.561  -2.710
   31    HG   SER   5           HG       SER   5  15.242  -6.199  -1.863
   32    H    ASP   6           H        ASP   6  10.863  -4.507  -3.561
   33    HA   ASP   6           HA       ASP   6  11.305  -2.524  -5.623
   34   1HB   ASP   6          1HB       ASP   6  10.347  -3.728  -7.507
   35   2HB   ASP   6          2HB       ASP   6  11.716  -4.649  -6.893
   36    H    THR   7           H        THR   7   8.684  -3.017  -6.880
   37    HA   THR   7           HA       THR   7   7.122  -1.643  -4.895
   38    HB   THR   7           HB       THR   7   6.742  -1.117  -7.219
   39    HG1  THR   7           HG1      THR   7   4.777  -0.888  -6.548
   40   1HG2  THR   7          3HG2      THR   7   6.325  -4.096  -7.452
   41   2HG2  THR   7          1HG2      THR   7   5.674  -2.988  -8.661
   42   3HG2  THR   7          2HG2      THR   7   7.415  -3.064  -8.379
   43    H    THR   8           H        THR   8   4.819  -2.463  -4.408
   44    HA   THR   8           HA       THR   8   4.738  -5.419  -4.086
   45    HB   THR   8           HB       THR   8   3.846  -3.689  -1.802
   46    HG1  THR   8           HG1      THR   8   6.488  -4.648  -2.055
   47   1HG2  THR   8          1HG2      THR   8   4.200  -6.484  -2.389
   48   2HG2  THR   8          2HG2      THR   8   5.235  -6.042  -1.031
   49   3HG2  THR   8          3HG2      THR   8   3.498  -5.744  -0.951
   50    HA   PRO   9           HA       PRO   9   0.826  -4.057  -5.915
   51   1HB   PRO   9          1HB       PRO   9   0.144  -6.860  -6.119
   52   2HB   PRO   9          2HB       PRO   9   0.570  -5.746  -7.423
   53   1HG   PRO   9          2HG       PRO   9   2.186  -7.867  -6.318
   54   2HG   PRO   9          1HG       PRO   9   2.603  -6.775  -7.616
   55   1HD   PRO   9          2HD       PRO   9   3.652  -6.801  -4.969
   56   2HD   PRO   9          1HD       PRO   9   4.023  -5.656  -6.271
   57    H    CYS  10           H        CYS  10   0.015  -3.282  -3.863
   58    HA   CYS  10           HA       CYS  10  -1.844  -5.178  -2.585
   59   1HB   CYS  10          2HB       CYS  10  -1.059  -4.675  -0.315
   60   2HB   CYS  10          1HB       CYS  10   0.235  -5.403  -1.261
   61    H    CYS  11           H        CYS  11  -3.618  -4.188  -1.721
   62    HA   CYS  11           HA       CYS  11  -4.064  -1.456  -2.589
   63   1HB   CYS  11          1HB       CYS  11  -6.113  -2.361  -2.777
   64   2HB   CYS  11          2HB       CYS  11  -5.668  -3.740  -1.788
   65    H    PHE  12           H        PHE  12  -4.975   0.188  -1.011
   66    HA   PHE  12           HA       PHE  12  -3.542   0.010   1.611
   67   1HB   PHE  12          2HB       PHE  12  -2.581   1.761   0.199
   68   2HB   PHE  12          1HB       PHE  12  -4.164   2.441  -0.090
   69    HD1  PHE  12           HD1      PHE  12  -2.609   1.139   3.068
   70    HD2  PHE  12           HD2      PHE  12  -4.218   4.551   0.969
   71    HE1  PHE  12           HE1      PHE  12  -2.437   2.500   5.149
   72    HE2  PHE  12           HE2      PHE  12  -4.042   5.914   3.050
   73    HZ   PHE  12           HZ       PHE  12  -3.153   4.888   5.140
   74    H    ALA  13           H        ALA  13  -6.109   2.115   0.282
   75    HA   ALA  13           HA       ALA  13  -7.671   1.648   2.767
   76   1HB   ALA  13          2HB       ALA  13  -7.513   3.804   0.735
   77   2HB   ALA  13          3HB       ALA  13  -9.122   3.477   1.380
   78   3HB   ALA  13          1HB       ALA  13  -7.807   3.917   2.470
   79    H    TYR  14           H        TYR  14  -9.827   0.888   2.694
   80    HA   TYR  14           HA       TYR  14 -10.463  -0.450   0.130
   81   1HB   TYR  14          2HB       TYR  14 -12.025  -1.831   1.824
   82   2HB   TYR  14          1HB       TYR  14 -10.362  -2.291   1.472
   83    HD1  TYR  14           HD2      TYR  14  -8.498  -1.414   2.993
   84    HD2  TYR  14           HD1      TYR  14 -12.686  -1.210   4.015
   85    HE1  TYR  14           HE2      TYR  14  -7.896  -1.039   5.372
   86    HE2  TYR  14           HE1      TYR  14 -12.083  -0.837   6.403
   87    HH   TYR  14           HH       TYR  14  -9.947  -1.453   7.886
   88    H    ILE  15           H        ILE  15 -12.697  -0.531  -0.543
   89    HA   ILE  15           HA       ILE  15 -14.134   1.934   0.066
   90    HB   ILE  15           HB       ILE  15 -14.127   0.981  -2.213
   91   1HG1  ILE  15          2HG1      ILE  15 -16.894   0.802  -1.006
   92   2HG1  ILE  15          1HG1      ILE  15 -16.089   2.314  -1.343
   93   1HG2  ILE  15          3HG2      ILE  15 -14.499  -1.435  -0.857
   94   2HG2  ILE  15          1HG2      ILE  15 -16.034  -1.157  -1.680
   95   3HG2  ILE  15          2HG2      ILE  15 -14.534  -1.206  -2.605
   96   1HD1  ILE  15          3HD1      ILE  15 -15.764   1.023  -3.725
   97   2HD1  ILE  15          1HD1      ILE  15 -17.322   0.384  -3.206
   98   3HD1  ILE  15          2HD1      ILE  15 -17.097   2.124  -3.380
   99    H    ALA  16           H        ALA  16 -16.488   1.852   0.710
  100    HA   ALA  16           HA       ALA  16 -16.901  -0.299   2.744
  101   1HB   ALA  16          2HB       ALA  16 -16.788   2.366   3.219
  102   2HB   ALA  16          3HB       ALA  16 -18.511   2.192   2.885
  103   3HB   ALA  16          1HB       ALA  16 -17.766   1.260   4.183
  104    H    ARG  17           H        ARG  17 -17.743  -1.493   0.726
  105    HA   ARG  17           HA       ARG  17 -20.562  -1.665   0.806
  106   1HB   ARG  17          2HB       ARG  17 -19.626   0.523  -0.785
  107   2HB   ARG  17          1HB       ARG  17 -20.328  -0.687  -1.860
  108   1HG   ARG  17          1HG       ARG  17 -22.430  -0.565  -0.836
  109   2HG   ARG  17          2HG       ARG  17 -21.770   0.086   0.664
  110   1HD   ARG  17          1HD       ARG  17 -22.196   2.170  -0.071
  111   2HD   ARG  17          2HD       ARG  17 -21.101   1.905  -1.427
  112    HE   ARG  17           HE       ARG  17 -24.047   1.572  -1.494
  113   1HH1  ARG  17          2HH2      ARG  17 -24.329   0.025  -3.458
  114   2HH1  ARG  17          1HH2      ARG  17 -23.128   0.190  -4.696
  115   1HH2  ARG  17          1HH1      ARG  17 -21.741   3.029  -3.216
  116   2HH2  ARG  17          2HH1      ARG  17 -21.991   2.202  -4.717
  117    HA   PRO  18           HA       PRO  18 -18.927  -5.376  -1.079
  118   1HB   PRO  18          1HB       PRO  18 -21.575  -6.372  -1.543
  119   2HB   PRO  18          2HB       PRO  18 -20.445  -6.859  -0.286
  120   1HG   PRO  18          2HG       PRO  18 -22.834  -5.244  -0.010
  121   2HG   PRO  18          1HG       PRO  18 -21.751  -5.817   1.263
  122   1HD   PRO  18          1HD       PRO  18 -22.000  -3.143   0.289
  123   2HD   PRO  18          2HD       PRO  18 -20.845  -3.737   1.468
  124    H    LEU  19           H        LEU  19 -18.218  -5.347  -3.122
  125    HA   LEU  19           HA       LEU  19 -19.517  -3.859  -5.222
  126   1HB   LEU  19          2HB       LEU  19 -17.265  -5.873  -5.249
  127   2HB   LEU  19          1HB       LEU  19 -17.747  -4.957  -6.654
  128    HG   LEU  19           HG       LEU  19 -16.835  -3.764  -4.028
  129   1HD1  LEU  19          2HD1      LEU  19 -15.013  -4.896  -5.257
  130   2HD1  LEU  19          3HD1      LEU  19 -15.419  -3.968  -6.701
  131   3HD1  LEU  19          1HD1      LEU  19 -14.800  -3.146  -5.269
  132   1HD2  LEU  19          2HD2      LEU  19 -18.099  -2.675  -6.449
  133   2HD2  LEU  19          3HD2      LEU  19 -17.940  -1.956  -4.846
  134   3HD2  LEU  19          1HD2      LEU  19 -16.608  -1.846  -5.999
  135    HA   PRO  20           HA       PRO  20 -22.377  -7.055  -6.461
  136   1HB   PRO  20          1HB       PRO  20 -22.511  -5.983  -9.143
  137   2HB   PRO  20          2HB       PRO  20 -23.710  -5.837  -7.852
  138   1HG   PRO  20          1HG       PRO  20 -21.973  -3.781  -8.868
  139   2HG   PRO  20          2HG       PRO  20 -23.133  -3.650  -7.542
  140   1HD   PRO  20          1HD       PRO  20 -20.244  -3.738  -7.387
  141   2HD   PRO  20          2HD       PRO  20 -21.406  -3.549  -6.060
  142    H    ARG  21           H        ARG  21 -21.708  -9.081  -7.067
  143    HA   ARG  21           HA       ARG  21 -19.228  -9.681  -8.240
  144   1HB   ARG  21          2HB       ARG  21 -21.784 -11.294  -8.374
  145   2HB   ARG  21          1HB       ARG  21 -20.192 -11.916  -8.733
  146   1HG   ARG  21          1HG       ARG  21 -20.101 -12.441  -6.530
  147   2HG   ARG  21          2HG       ARG  21 -19.806 -10.737  -6.281
  148   1HD   ARG  21          2HD       ARG  21 -21.768 -10.522  -5.207
  149   2HD   ARG  21          1HD       ARG  21 -22.624 -11.140  -6.618
  150    HE   ARG  21           HE       ARG  21 -21.386 -13.061  -4.704
  151   1HH1  ARG  21          1HH1      ARG  21 -23.799 -13.077  -7.152
  152   2HH1  ARG  21          2HH1      ARG  21 -24.105 -14.575  -6.338
  153   1HH2  ARG  21          1HH2      ARG  21 -23.618 -13.443  -3.262
  154   2HH2  ARG  21          2HH2      ARG  21 -24.985 -12.872  -4.159
  155    H    ALA  22           H        ALA  22 -22.218  -8.737  -9.783
  156    HA   ALA  22           HA       ALA  22 -21.495  -9.678 -12.425
  157   1HB   ALA  22          3HB       ALA  22 -23.845  -9.082 -11.567
  158   2HB   ALA  22          1HB       ALA  22 -23.388  -7.399 -11.833
  159   3HB   ALA  22          2HB       ALA  22 -23.430  -8.526 -13.189
  160    H    HIS  23           H        HIS  23 -21.138  -6.592 -10.706
  161    HA   HIS  23           HA       HIS  23 -20.051  -5.240 -13.041
  162   1HB   HIS  23          1HB       HIS  23 -19.896  -4.473 -10.112
  163   2HB   HIS  23          2HB       HIS  23 -19.526  -3.421 -11.476
  164    HD2  HIS  23           HD2      HIS  23 -22.646  -5.574 -12.148
  165    HE1  HIS  23           HE1      HIS  23 -24.036  -1.792 -10.870
  166    HE2  HIS  23           HE2      HIS  23 -24.724  -4.017 -11.896
  167    H    ILE  24           H        ILE  24 -18.733  -7.305 -10.564
  168    HA   ILE  24           HA       ILE  24 -16.000  -6.324 -11.086
  169    HB   ILE  24           HB       ILE  24 -16.736  -8.708  -9.412
  170   1HG1  ILE  24          2HG1      ILE  24 -16.532  -5.809  -8.549
  171   2HG1  ILE  24          1HG1      ILE  24 -18.015  -6.758  -8.601
  172   1HG2  ILE  24          1HG2      ILE  24 -14.316  -7.138  -9.995
  173   2HG2  ILE  24          2HG2      ILE  24 -14.578  -7.464  -8.288
  174   3HG2  ILE  24          3HG2      ILE  24 -14.469  -8.802  -9.428
  175   1HD1  ILE  24          1HD1      ILE  24 -16.110  -8.282  -7.144
  176   2HD1  ILE  24          2HD1      ILE  24 -16.033  -6.633  -6.518
  177   3HD1  ILE  24          3HD1      ILE  24 -17.568  -7.504  -6.522
  178    H    LYS  25           H        LYS  25 -14.285  -7.940 -11.716
  179    HA   LYS  25           HA       LYS  25 -15.436 -10.067 -13.484
  180   1HB   LYS  25          1HB       LYS  25 -13.049  -8.266 -13.979
  181   2HB   LYS  25          2HB       LYS  25 -13.467  -9.654 -14.984
  182   1HG   LYS  25          1HG       LYS  25 -15.705  -7.800 -14.464
  183   2HG   LYS  25          2HG       LYS  25 -14.389  -7.109 -15.412
  184   1HD   LYS  25          1HD       LYS  25 -14.517  -8.982 -16.994
  185   2HD   LYS  25          2HD       LYS  25 -15.787  -9.731 -16.027
  186   1HE   LYS  25          1HE       LYS  25 -17.120  -8.614 -17.538
  187   2HE   LYS  25          2HE       LYS  25 -16.909  -7.314 -16.366
  188   1HZ   LYS  25          1HZ       LYS  25 -14.762  -6.914 -17.816
  189   2HZ   LYS  25          2HZ       LYS  25 -15.720  -7.645 -19.012
  190   3HZ   LYS  25          3HZ       LYS  25 -16.262  -6.236 -18.233
  191    H    GLU  26           H        GLU  26 -12.921  -9.178 -11.187
  192    HA   GLU  26           HA       GLU  26 -12.371 -11.987 -10.641
  193   1HB   GLU  26          2HB       GLU  26  -9.775 -11.271 -10.993
  194   2HB   GLU  26          1HB       GLU  26 -10.698 -12.101 -12.200
  195   1HG   GLU  26          2HG       GLU  26 -10.975  -9.160 -12.246
  196   2HG   GLU  26          1HG       GLU  26  -9.367  -9.762 -12.625
  197    H    TYR  27           H        TYR  27  -9.945 -11.587  -9.214
  198    HA   TYR  27           HA       TYR  27 -10.210  -9.218  -7.610
  199   1HB   TYR  27          1HB       TYR  27 -10.831 -10.234  -5.528
  200   2HB   TYR  27          2HB       TYR  27 -11.988 -10.808  -6.701
  201    HD1  TYR  27           HD2      TYR  27 -11.624 -13.112  -7.779
  202    HD2  TYR  27           HD1      TYR  27  -9.408 -11.734  -4.341
  203    HE1  TYR  27           HE2      TYR  27 -10.916 -15.454  -7.296
  204    HE2  TYR  27           HE1      TYR  27  -8.694 -14.072  -3.862
  205    HH   TYR  27           HH       TYR  27  -9.106 -16.623  -6.112
  206    H    PHE  28           H        PHE  28  -8.604  -9.679  -5.522
  207    HA   PHE  28           HA       PHE  28  -6.423 -11.434  -6.343
  208   1HB   PHE  28          1HB       PHE  28  -5.768  -9.614  -7.710
  209   2HB   PHE  28          2HB       PHE  28  -6.219  -8.426  -6.491
  210    HD1  PHE  28           HD1      PHE  28  -4.188 -11.569  -6.161
  211    HD2  PHE  28           HD2      PHE  28  -4.247  -7.258  -5.941
  212    HE1  PHE  28           HE1      PHE  28  -1.905 -11.589  -5.160
  213    HE2  PHE  28           HE2      PHE  28  -1.964  -7.278  -4.950
  214    HZ   PHE  28           HZ       PHE  28  -0.785  -9.441  -4.567
  215    H    TYR  29           H        TYR  29  -7.100 -12.287  -4.193
  216    HA   TYR  29           HA       TYR  29  -7.003 -10.790  -1.785
  217   1HB   TYR  29          1HB       TYR  29  -7.889 -13.066  -1.856
  218   2HB   TYR  29          2HB       TYR  29  -6.297 -13.697  -2.262
  219    HD1  TYR  29           HD1      TYR  29  -7.578 -11.219   0.270
  220    HD2  TYR  29           HD2      TYR  29  -5.321 -14.824  -0.467
  221    HE1  TYR  29           HE1      TYR  29  -7.010 -11.359   2.693
  222    HE2  TYR  29           HE2      TYR  29  -4.753 -14.965   1.955
  223    HH   TYR  29           HH       TYR  29  -5.417 -14.178   4.053
  224    H    THR  30           H        THR  30  -5.350  -9.976  -0.654
  225    HA   THR  30           HA       THR  30  -2.645 -10.088  -1.746
  226    HB   THR  30           HB       THR  30  -3.214  -8.999   0.987
  227    HG1  THR  30           HG1      THR  30  -3.904  -7.059  -0.226
  228   1HG2  THR  30          3HG2      THR  30  -1.257  -8.703  -1.165
  229   2HG2  THR  30          1HG2      THR  30  -1.866  -7.148  -0.597
  230   3HG2  THR  30          2HG2      THR  30  -1.120  -8.271   0.540
  231    H    SER  31           H        SER  31  -0.827 -11.085  -0.768
  232    HA   SER  31           HA       SER  31  -1.466 -13.457   0.838
  233   1HB   SER  31          1HB       SER  31   0.216 -13.518  -1.008
  234   2HB   SER  31          2HB       SER  31   1.232 -12.417  -0.078
  235    HG   SER  31           HG       SER  31   1.084 -14.036   1.634
  236    H    GLY  32           H        GLY  32   1.055 -10.947   1.270
  237   1HA   GLY  32          1HA       GLY  32   0.294  -9.989   3.780
  238   2HA   GLY  32          2HA       GLY  32   1.220 -11.433   4.112
  239    H    LYS  33           H        LYS  33   1.564  -8.773   1.739
  240    HA   LYS  33           HA       LYS  33   4.455  -8.672   2.434
  241   1HB   LYS  33          2HB       LYS  33   2.990  -7.320   0.148
  242   2HB   LYS  33          1HB       LYS  33   4.737  -7.444   0.351
  243   1HG   LYS  33          1HG       LYS  33   3.286 -10.014   0.444
  244   2HG   LYS  33          2HG       LYS  33   3.239  -9.205  -1.104
  245   1HD   LYS  33          2HD       LYS  33   5.901  -9.016  -0.046
  246   2HD   LYS  33          1HD       LYS  33   5.383 -10.701   0.003
  247   1HE   LYS  33          1HE       LYS  33   4.684  -9.254  -2.481
  248   2HE   LYS  33          2HE       LYS  33   6.413  -9.486  -2.217
  249   1HZ   LYS  33          1HZ       LYS  33   4.509 -11.714  -1.874
  250   2HZ   LYS  33          2HZ       LYS  33   5.120 -11.319  -3.409
  251   3HZ   LYS  33          3HZ       LYS  33   6.181 -11.778  -2.165
  252    H    CYS  34           H        CYS  34   2.127  -6.146   1.420
  253    HA   CYS  34           HA       CYS  34   3.461  -4.127   2.991
  254   1HB   CYS  34          2HB       CYS  34   0.603  -3.975   2.014
  255   2HB   CYS  34          1HB       CYS  34   1.733  -2.647   2.275
  256    H    SER  35           H        SER  35   1.861  -2.777   4.548
  257    HA   SER  35           HA       SER  35   1.043  -4.726   6.633
  258   1HB   SER  35          1HB       SER  35   1.752  -1.804   6.628
  259   2HB   SER  35          2HB       SER  35   0.806  -2.472   7.957
  260    HG   SER  35           HG       SER  35   2.907  -2.713   8.535
  261    H    ASN  36           H        ASN  36  -0.575  -4.158   4.194
  262    HA   ASN  36           HA       ASN  36  -3.077  -3.373   5.611
  263   1HB   ASN  36          2HB       ASN  36  -1.868  -2.124   3.189
  264   2HB   ASN  36          1HB       ASN  36  -3.615  -2.364   3.182
  265   1HD2  ASN  36          2HD2      ASN  36  -1.656  -0.091   5.926
  266   2HD2  ASN  36          1HD2      ASN  36  -1.319   0.054   4.270
  267    HA   PRO  37           HA       PRO  37  -3.238  -7.396   3.183
  268   1HB   PRO  37          1HB       PRO  37  -4.806  -8.405   5.403
  269   2HB   PRO  37          2HB       PRO  37  -3.232  -8.970   4.832
  270   1HG   PRO  37          2HG       PRO  37  -3.792  -7.464   7.221
  271   2HG   PRO  37          1HG       PRO  37  -2.212  -7.987   6.623
  272   1HD   PRO  37          1HD       PRO  37  -3.288  -5.316   6.653
  273   2HD   PRO  37          2HD       PRO  37  -1.719  -5.837   6.055
  274    H    ALA  38           H        ALA  38  -5.109  -7.983   1.993
  275    HA   ALA  38           HA       ALA  38  -7.786  -7.363   2.805
  276   1HB   ALA  38          3HB       ALA  38  -6.828  -5.042   2.446
  277   2HB   ALA  38          1HB       ALA  38  -6.659  -5.460   0.742
  278   3HB   ALA  38          2HB       ALA  38  -8.259  -5.412   1.484
  279    H    VAL  39           H        VAL  39  -8.587  -6.657  -0.005
  280    HA   VAL  39           HA       VAL  39  -7.680  -8.987  -1.545
  281    HB   VAL  39           HB       VAL  39  -9.870  -9.351   0.014
  282   1HG1  VAL  39          3HG1      VAL  39 -10.961  -7.457  -1.473
  283   2HG1  VAL  39          1HG1      VAL  39 -11.203  -8.790  -2.602
  284   3HG1  VAL  39          2HG1      VAL  39 -11.901  -8.868  -0.985
  285   1HG2  VAL  39          2HG2      VAL  39  -8.871 -10.494  -2.501
  286   2HG2  VAL  39          3HG2      VAL  39  -9.277 -11.288  -0.980
  287   3HG2  VAL  39          1HG2      VAL  39 -10.552 -10.884  -2.129
  288    H    VAL  40           H        VAL  40  -7.715  -8.417  -3.702
  289    HA   VAL  40           HA       VAL  40  -8.734  -5.661  -4.159
  290    HB   VAL  40           HB       VAL  40  -6.285  -7.099  -5.076
  291   1HG1  VAL  40          2HG1      VAL  40  -7.403  -6.242  -7.151
  292   2HG1  VAL  40          3HG1      VAL  40  -7.404  -4.637  -6.424
  293   3HG1  VAL  40          1HG1      VAL  40  -5.878  -5.439  -6.791
  294   1HG2  VAL  40          2HG2      VAL  40  -7.044  -4.404  -3.937
  295   2HG2  VAL  40          3HG2      VAL  40  -6.088  -5.675  -3.164
  296   3HG2  VAL  40          1HG2      VAL  40  -5.413  -4.762  -4.515
  297    H    PHE  41           H        PHE  41 -10.594  -5.691  -5.203
  298    HA   PHE  41           HA       PHE  41 -11.183  -7.780  -7.144
  299   1HB   PHE  41          1HB       PHE  41 -12.710  -5.431  -6.057
  300   2HB   PHE  41          2HB       PHE  41 -13.304  -6.327  -7.432
  301    HD1  PHE  41           HD2      PHE  41 -13.794  -8.810  -7.209
  302    HD2  PHE  41           HD1      PHE  41 -12.791  -6.322  -3.827
  303    HE1  PHE  41           HE2      PHE  41 -14.790 -10.499  -5.673
  304    HE2  PHE  41           HE1      PHE  41 -13.737  -8.035  -2.292
  305    HZ   PHE  41           HZ       PHE  41 -14.792 -10.095  -3.212
  306    H    VAL  42           H        VAL  42 -11.125  -7.629  -9.235
  307    HA   VAL  42           HA       VAL  42 -10.144  -5.077 -10.440
  308    HB   VAL  42           HB       VAL  42  -9.789  -7.110 -12.307
  309   1HG1  VAL  42          3HG2      VAL  42  -8.094  -5.556 -10.413
  310   2HG1  VAL  42          1HG2      VAL  42  -7.330  -6.855 -11.329
  311   3HG1  VAL  42          2HG2      VAL  42  -8.111  -5.521 -12.178
  312   1HG2  VAL  42          3HG1      VAL  42 -10.162  -8.798 -10.522
  313   2HG2  VAL  42          1HG1      VAL  42  -8.518  -8.851 -11.149
  314   3HG2  VAL  42          2HG1      VAL  42  -8.850  -8.081  -9.598
  315    H    THR  43           H        THR  43 -12.420  -4.383 -10.515
  316    HA   THR  43           HA       THR  43 -14.432  -5.998 -11.851
  317    HB   THR  43           HB       THR  43 -15.966  -4.299 -11.274
  318    HG1  THR  43           HG1      THR  43 -13.700  -2.601 -11.253
  319   1HG2  THR  43          1HG2      THR  43 -14.711  -5.365  -9.316
  320   2HG2  THR  43          2HG2      THR  43 -13.780  -3.871  -9.226
  321   3HG2  THR  43          3HG2      THR  43 -15.525  -3.840  -8.974
  322    H    ARG  44           H        ARG  44 -15.882  -4.013 -13.229
  323    HA   ARG  44           HA       ARG  44 -15.088  -4.415 -15.842
  324   1HB   ARG  44          2HB       ARG  44 -16.394  -2.223 -16.324
  325   2HB   ARG  44          1HB       ARG  44 -17.256  -3.555 -15.598
  326   1HG   ARG  44          1HG       ARG  44 -16.141  -2.098 -13.446
  327   2HG   ARG  44          2HG       ARG  44 -16.821  -0.907 -14.549
  328   1HD   ARG  44          1HD       ARG  44 -18.977  -1.986 -14.496
  329   2HD   ARG  44          2HD       ARG  44 -18.323  -3.364 -13.610
  330    HE   ARG  44           HE       ARG  44 -18.221  -1.993 -11.627
  331   1HH1  ARG  44          2HH1      ARG  44 -17.586   0.529 -13.328
  332   2HH1  ARG  44          1HH1      ARG  44 -19.015   1.472 -13.069
  333   1HH2  ARG  44          2HH2      ARG  44 -21.059  -0.880 -12.280
  334   2HH2  ARG  44          1HH2      ARG  44 -20.459   0.340 -11.208
  335    H    LYS  45           H        LYS  45 -14.524  -1.308 -14.092
  336    HA   LYS  45           HA       LYS  45 -12.725  -0.216 -16.018
  337   1HB   LYS  45          2HB       LYS  45 -13.164   0.175 -13.078
  338   2HB   LYS  45          1HB       LYS  45 -11.676   0.811 -13.780
  339   1HG   LYS  45          1HG       LYS  45 -12.971   2.078 -15.434
  340   2HG   LYS  45          2HG       LYS  45 -14.471   1.400 -14.804
  341   1HD   LYS  45          1HD       LYS  45 -14.451   3.368 -13.605
  342   2HD   LYS  45          2HD       LYS  45 -13.483   2.380 -12.510
  343   1HE   LYS  45          1HE       LYS  45 -11.734   3.766 -12.796
  344   2HE   LYS  45          2HE       LYS  45 -11.749   3.437 -14.529
  345   1HZ   LYS  45          1HZ       LYS  45 -13.570   5.116 -14.691
  346   2HZ   LYS  45          2HZ       LYS  45 -13.262   5.530 -13.074
  347   3HZ   LYS  45          3HZ       LYS  45 -12.058   5.751 -14.250
  348    H    ASN  46           H        ASN  46 -12.429  -2.567 -13.499
  349    HA   ASN  46           HA       ASN  46 -10.912  -4.229 -13.099
  350   1HB   ASN  46          2HB       ASN  46 -10.538  -3.553 -15.863
  351   2HB   ASN  46          1HB       ASN  46  -8.946  -3.808 -15.150
  352   1HD2  ASN  46          1HD2      ASN  46 -10.027  -6.930 -16.459
  353   2HD2  ASN  46          2HD2      ASN  46  -8.590  -6.153 -15.996
  354    H    ARG  47           H        ARG  47 -10.375  -1.153 -12.556
  355    HA   ARG  47           HA       ARG  47  -7.514  -1.033 -12.159
  356   1HB   ARG  47          2HB       ARG  47  -9.770   0.594 -11.478
  357   2HB   ARG  47          1HB       ARG  47  -8.894   0.252  -9.990
  358   1HG   ARG  47          1HG       ARG  47  -6.865   1.162 -10.865
  359   2HG   ARG  47          2HG       ARG  47  -7.509   1.199 -12.506
  360   1HD   ARG  47          1HD       ARG  47  -9.363   2.714 -11.210
  361   2HD   ARG  47          2HD       ARG  47  -7.922   3.097 -10.269
  362    HE   ARG  47           HE       ARG  47  -8.155   3.524 -13.219
  363   1HH1  ARG  47          1HH1      ARG  47  -5.173   3.639 -12.150
  364   2HH1  ARG  47          2HH1      ARG  47  -5.418   4.630 -10.750
  365   1HH2  ARG  47          1HH2      ARG  47  -7.793   6.304 -11.518
  366   2HH2  ARG  47          2HH2      ARG  47  -6.977   6.306 -13.047
  367    H    GLN  48           H        GLN  48  -6.635  -1.334  -9.737
  368    HA   GLN  48           HA       GLN  48  -7.779  -3.910  -8.953
  369   1HB   GLN  48          1HB       GLN  48  -5.174  -2.606  -8.578
  370   2HB   GLN  48          2HB       GLN  48  -5.710  -3.600  -7.240
  371   1HG   GLN  48          1HG       GLN  48  -6.152  -5.456  -8.768
  372   2HG   GLN  48          2HG       GLN  48  -5.747  -4.468 -10.139
  373   1HE2  GLN  48          1HE2      GLN  48  -2.274  -5.013  -9.833
  374   2HE2  GLN  48          2HE2      GLN  48  -3.460  -4.034 -10.552
  375    H    VAL  49           H        VAL  49  -9.673  -2.782  -8.394
  376    HA   VAL  49           HA       VAL  49 -10.000  -0.944  -6.307
  377    HB   VAL  49           HB       VAL  49 -12.048  -3.077  -6.561
  378   1HG1  VAL  49          1HG1      VAL  49 -11.981  -0.064  -6.536
  379   2HG1  VAL  49          2HG1      VAL  49 -13.469  -0.988  -6.740
  380   3HG1  VAL  49          3HG1      VAL  49 -12.536  -1.135  -5.249
  381   1HG2  VAL  49          2HG2      VAL  49 -11.210  -1.302  -8.874
  382   2HG2  VAL  49          3HG2      VAL  49 -11.529  -3.034  -8.920
  383   3HG2  VAL  49          1HG2      VAL  49 -12.861  -1.895  -8.727
  384    H    CYS  50           H        CYS  50 -10.778  -1.386  -4.103
  385    HA   CYS  50           HA       CYS  50  -9.640  -3.915  -3.003
  386   1HB   CYS  50          2HB       CYS  50  -8.623  -1.522  -2.486
  387   2HB   CYS  50          1HB       CYS  50  -9.953  -1.435  -1.364
  388    H    ALA  51           H        ALA  51 -10.722  -4.226  -0.632
  389    HA   ALA  51           HA       ALA  51 -13.299  -3.205  -0.101
  390   1HB   ALA  51          1HB       ALA  51 -13.283  -4.975  -2.322
  391   2HB   ALA  51          2HB       ALA  51 -14.051  -5.829  -0.983
  392   3HB   ALA  51          3HB       ALA  51 -14.682  -4.270  -1.513
  393    H    ASN  52           H        ASN  52 -10.977  -4.152   1.352
  394    HA   ASN  52           HA       ASN  52 -10.606  -5.239   3.388
  395   1HB   ASN  52          1HB       ASN  52 -12.939  -4.374   3.809
  396   2HB   ASN  52          2HB       ASN  52 -13.553  -5.919   3.228
  397   1HD2  ASN  52          2HD2      ASN  52 -12.530  -4.818   6.671
  398   2HD2  ASN  52          1HD2      ASN  52 -10.987  -5.244   6.107
  399    HA   PRO  53           HA       PRO  53 -10.050  -9.426   2.029
  400   1HB   PRO  53          1HB       PRO  53  -8.813 -10.362   4.320
  401   2HB   PRO  53          2HB       PRO  53  -7.994  -9.421   3.088
  402   1HG   PRO  53          1HG       PRO  53  -8.832  -8.600   5.801
  403   2HG   PRO  53          2HG       PRO  53  -7.629  -7.874   4.754
  404   1HD   PRO  53          1HD       PRO  53 -10.278  -6.931   5.228
  405   2HD   PRO  53          2HD       PRO  53  -9.125  -6.288   4.069
  406    H    GLU  54           H        GLU  54 -10.809  -9.284   5.533
  407    HA   GLU  54           HA       GLU  54 -12.536 -11.677   5.208
  408   1HB   GLU  54          1HB       GLU  54 -10.820 -10.611   7.305
  409   2HB   GLU  54          2HB       GLU  54 -12.417 -11.029   7.923
  410   1HG   GLU  54          1HG       GLU  54 -12.162 -13.273   7.451
  411   2HG   GLU  54          2HG       GLU  54 -11.109 -12.969   6.069
  412    H    LYS  55           H        LYS  55 -13.728  -9.402   4.169
  413    HA   LYS  55           HA       LYS  55 -15.566  -8.370   6.254
  414   1HB   LYS  55          2HB       LYS  55 -14.590  -7.408   3.719
  415   2HB   LYS  55          1HB       LYS  55 -16.336  -7.398   3.729
  416   1HG   LYS  55          1HG       LYS  55 -14.780  -6.321   6.071
  417   2HG   LYS  55          2HG       LYS  55 -15.098  -5.312   4.660
  418   1HD   LYS  55          1HD       LYS  55 -17.336  -5.155   5.113
  419   2HD   LYS  55          2HD       LYS  55 -17.427  -6.800   5.744
  420   1HE   LYS  55          1HE       LYS  55 -16.525  -6.142   7.855
  421   2HE   LYS  55          2HE       LYS  55 -16.023  -4.572   7.231
  422   1HZ   LYS  55          3HZ       LYS  55 -18.532  -4.307   6.737
  423   2HZ   LYS  55          1HZ       LYS  55 -18.722  -5.525   7.905
  424   3HZ   LYS  55          2HZ       LYS  55 -17.963  -4.062   8.319
  425    H    LYS  56           H        LYS  56 -15.574 -11.204   5.218
  426    HA   LYS  56           HA       LYS  56 -17.176 -12.828   4.746
  427   1HB   LYS  56          1HB       LYS  56 -19.035 -10.511   5.333
  428   2HB   LYS  56          2HB       LYS  56 -19.579 -12.165   5.064
  429   1HG   LYS  56          1HG       LYS  56 -18.392 -12.964   6.982
  430   2HG   LYS  56          2HG       LYS  56 -17.501 -11.451   7.145
  431   1HD   LYS  56          1HD       LYS  56 -19.299 -11.523   8.803
  432   2HD   LYS  56          2HD       LYS  56 -19.649 -10.274   7.608
  433   1HE   LYS  56          1HE       LYS  56 -20.678 -12.998   7.005
  434   2HE   LYS  56          2HE       LYS  56 -21.457 -12.147   8.339
  435   1HZ   LYS  56          1HZ       LYS  56 -20.975 -10.614   5.912
  436   2HZ   LYS  56          2HZ       LYS  56 -22.170 -11.816   5.820
  437   3HZ   LYS  56          3HZ       LYS  56 -22.298 -10.578   6.976
  438    H    TRP  57           H        TRP  57 -19.186 -10.249   3.405
  439    HA   TRP  57           HA       TRP  57 -19.859 -11.475   1.032
  440   1HB   TRP  57          1HB       TRP  57 -20.438  -9.329   0.152
  441   2HB   TRP  57          2HB       TRP  57 -20.742  -9.284   1.890
  442    HD1  TRP  57           HD1      TRP  57 -19.543  -7.386   3.176
  443    HE1  TRP  57           HE1      TRP  57 -17.944  -5.498   2.438
  444    HE3  TRP  57           HE3      TRP  57 -18.340  -9.099  -1.432
  445    HZ2  TRP  57           HZ2      TRP  57 -16.327  -4.822   0.132
  446    HZ3  TRP  57           HZ3      TRP  57 -16.884  -7.815  -2.933
  447    HH2  TRP  57           HH2      TRP  57 -15.886  -5.669  -2.170
  448    H    VAL  58           H        VAL  58 -16.870  -9.613   1.540
  449    HA   VAL  58           HA       VAL  58 -15.951  -9.590  -1.129
  450    HB   VAL  58           HB       VAL  58 -13.593  -9.942   0.059
  451   1HG1  VAL  58          1HG1      VAL  58 -14.939  -7.856  -0.859
  452   2HG1  VAL  58          2HG1      VAL  58 -15.003  -7.447   0.850
  453   3HG1  VAL  58          3HG1      VAL  58 -13.445  -7.658   0.046
  454   1HG2  VAL  58          3HG2      VAL  58 -15.203 -10.463   2.191
  455   2HG2  VAL  58          1HG2      VAL  58 -13.543  -9.882   2.305
  456   3HG2  VAL  58          2HG2      VAL  58 -14.883  -8.743   2.396
  457    H    ARG  59           H        ARG  59 -15.373 -12.133   1.321
  458    HA   ARG  59           HA       ARG  59 -14.041 -13.899  -0.512
  459   1HB   ARG  59          2HB       ARG  59 -15.473 -14.397   2.114
  460   2HB   ARG  59          1HB       ARG  59 -14.611 -15.656   1.230
  461   1HG   ARG  59          2HG       ARG  59 -12.523 -14.455   1.419
  462   2HG   ARG  59          1HG       ARG  59 -13.341 -13.041   2.085
  463   1HD   ARG  59          1HD       ARG  59 -13.969 -14.291   4.081
  464   2HD   ARG  59          2HD       ARG  59 -13.297 -15.773   3.402
  465    HE   ARG  59           HE       ARG  59 -11.587 -13.402   4.042
  466   1HH1  ARG  59          2HH1      ARG  59 -12.254 -16.806   4.894
  467   2HH1  ARG  59          1HH1      ARG  59 -11.079 -16.364   6.087
  468   1HH2  ARG  59          2HH2      ARG  59  -9.382 -14.431   3.701
  469   2HH2  ARG  59          1HH2      ARG  59  -9.266 -16.119   4.075
  470    H    GLU  60           H        GLU  60 -17.388 -13.237   0.216
  471    HA   GLU  60           HA       GLU  60 -18.521 -15.633  -0.893
  472   1HB   GLU  60          2HB       GLU  60 -19.667 -12.836  -0.647
  473   2HB   GLU  60          1HB       GLU  60 -20.603 -14.267  -1.081
  474   1HG   GLU  60          1HG       GLU  60 -19.707 -15.302   1.099
  475   2HG   GLU  60          2HG       GLU  60 -19.210 -13.666   1.533
  476    H    TYR  61           H        TYR  61 -17.156 -12.760  -2.298
  477    HA   TYR  61           HA       TYR  61 -18.284 -13.463  -4.961
  478   1HB   TYR  61          1HB       TYR  61 -16.575 -11.072  -4.209
  479   2HB   TYR  61          2HB       TYR  61 -17.467 -11.301  -5.709
  480    HD1  TYR  61           HD2      TYR  61 -19.770 -12.691  -3.685
  481    HD2  TYR  61           HD1      TYR  61 -17.907  -8.830  -4.241
  482    HE1  TYR  61           HE2      TYR  61 -21.741 -11.591  -2.639
  483    HE2  TYR  61           HE1      TYR  61 -19.888  -7.735  -3.198
  484    HH   TYR  61           HH       TYR  61 -22.825  -9.278  -2.745
  485    H    ILE  62           H        ILE  62 -15.376 -13.573  -3.058
  486    HA   ILE  62           HA       ILE  62 -13.421 -13.743  -5.111
  487    HB   ILE  62           HB       ILE  62 -13.603 -14.970  -2.348
  488   1HG1  ILE  62          1HG1      ILE  62 -11.820 -12.789  -3.444
  489   2HG1  ILE  62          2HG1      ILE  62 -13.353 -12.475  -2.671
  490   1HG2  ILE  62          2HG2      ILE  62 -11.797 -15.683  -4.490
  491   2HG2  ILE  62          3HG2      ILE  62 -10.907 -14.912  -3.177
  492   3HG2  ILE  62          1HG2      ILE  62 -11.893 -16.338  -2.857
  493   1HD1  ILE  62          3HD1      ILE  62 -12.078 -14.209  -0.908
  494   2HD1  ILE  62          1HD1      ILE  62 -10.784 -13.149  -1.467
  495   3HD1  ILE  62          2HD1      ILE  62 -12.223 -12.462  -0.713
  496    H    ASN  63           H        ASN  63 -15.337 -16.344  -3.562
  497    HA   ASN  63           HA       ASN  63 -14.295 -18.337  -5.439
  498   1HB   ASN  63          1HB       ASN  63 -14.948 -18.870  -3.068
  499   2HB   ASN  63          2HB       ASN  63 -16.628 -18.583  -3.520
  500   1HD2  ASN  63          2HD2      ASN  63 -17.195 -21.684  -4.549
  501   2HD2  ASN  63          1HD2      ASN  63 -16.789 -21.194  -2.975
  502    H    SER  64           H        SER  64 -17.368 -16.603  -4.951
  503    HA   SER  64           HA       SER  64 -18.870 -17.920  -6.967
  504   1HB   SER  64          1HB       SER  64 -19.953 -16.417  -5.399
  505   2HB   SER  64          2HB       SER  64 -19.001 -15.054  -5.988
  506    HG   SER  64           HG       SER  64 -20.999 -16.520  -7.345
  507    H    LEU  65           H        LEU  65 -16.218 -15.717  -7.250
  508    HA   LEU  65           HA       LEU  65 -16.833 -14.617  -9.829
  509   1HB   LEU  65          2HB       LEU  65 -14.444 -14.826  -8.087
  510   2HB   LEU  65          1HB       LEU  65 -14.115 -14.648  -9.811
  511    HG   LEU  65           HG       LEU  65 -16.042 -12.858  -8.312
  512   1HD1  LEU  65          1HD1      LEU  65 -13.090 -12.488  -8.893
  513   2HD1  LEU  65          2HD1      LEU  65 -14.166 -11.185  -8.387
  514   3HD1  LEU  65          3HD1      LEU  65 -13.858 -12.544  -7.306
  515   1HD2  LEU  65          1HD2      LEU  65 -16.214 -13.062 -10.818
  516   2HD2  LEU  65          2HD2      LEU  65 -15.823 -11.434 -10.262
  517   3HD2  LEU  65          3HD2      LEU  65 -14.556 -12.467 -10.927
  518    H    GLU  66           H        GLU  66 -16.084 -15.292 -11.904
  519    HA   GLU  66           HA       GLU  66 -15.263 -18.167 -12.033
  520   1HB   GLU  66          1HB       GLU  66 -17.242 -16.579 -13.636
  521   2HB   GLU  66          2HB       GLU  66 -16.391 -17.916 -14.409
  522   1HG   GLU  66          1HG       GLU  66 -17.789 -18.233 -11.748
  523   2HG   GLU  66          2HG       GLU  66 -18.627 -18.481 -13.279
  524    H    MET  67           H        MET  67 -13.067 -17.983 -12.403
  525    HA   MET  67           HA       MET  67 -12.268 -16.371 -14.791
  526   1HB   MET  67          1HB       MET  67 -11.392 -16.089 -12.060
  527   2HB   MET  67          2HB       MET  67 -10.032 -16.593 -13.064
  528   1HG   MET  67          1HG       MET  67 -11.725 -14.533 -14.309
  529   2HG   MET  67          2HG       MET  67 -10.932 -14.000 -12.826
  530   1HE   MET  67          1HE       MET  67 -10.692 -15.879 -15.989
  531   2HE   MET  67          3HE       MET  67 -10.352 -14.298 -16.692
  532   3HE   MET  67          2HE       MET  67  -9.110 -15.551 -16.695
  533    H    SER  68           H        SER  68 -12.946 -19.212 -14.620
  534    HA   SER  68           HA       SER  68 -10.389 -20.655 -14.677
  535   1HB   SER  68          1HB       SER  68 -12.526 -21.699 -13.866
  536   2HB   SER  68          2HB       SER  68 -13.139 -21.618 -15.518
  537    HG   SER  68           HG       SER  68 -10.701 -22.873 -14.822
  538    H    SER   1           H        SER   1 -14.427  12.781   0.253
  539    HA   SER   1           HA       SER   1 -12.652  14.740  -1.112
  540   1HB   SER   1          1HB       SER   1 -10.844  12.896  -0.189
  541   2HB   SER   1          2HB       SER   1 -11.151  14.456   0.574
  542    HG   SER   1           HG       SER   1 -11.425  12.960   2.148
  543    HA   PRO   2           HA       PRO   2 -12.595  11.893  -4.431
  544   1HB   PRO   2          1HB       PRO   2  -9.733  11.696  -4.736
  545   2HB   PRO   2          2HB       PRO   2 -10.863  12.665  -5.690
  546   1HG   PRO   2          1HG       PRO   2  -8.953  13.592  -3.734
  547   2HG   PRO   2          2HG       PRO   2 -10.085  14.562  -4.685
  548   1HD   PRO   2          1HD       PRO   2 -10.214  13.945  -1.870
  549   2HD   PRO   2          2HD       PRO   2 -11.352  14.915  -2.824
  550    H    TYR   3           H        TYR   3 -13.095   9.785  -3.996
  551    HA   TYR   3           HA       TYR   3 -11.597   8.228  -2.037
  552   1HB   TYR   3          1HB       TYR   3 -14.117   8.016  -3.440
  553   2HB   TYR   3          2HB       TYR   3 -13.231   6.496  -3.555
  554    HD1  TYR   3           HD1      TYR   3 -11.740   6.313  -1.071
  555    HD2  TYR   3           HD2      TYR   3 -15.734   7.808  -1.744
  556    HE1  TYR   3           HE1      TYR   3 -12.334   5.790   1.293
  557    HE2  TYR   3           HE2      TYR   3 -16.328   7.287   0.621
  558    HH   TYR   3           HH       TYR   3 -15.647   6.074   2.468
  559    H    SER   4           H        SER   4 -10.965   5.876  -2.801
  560    HA   SER   4           HA       SER   4 -10.075   5.485  -5.500
  561   1HB   SER   4          1HB       SER   4  -8.493   7.310  -4.764
  562   2HB   SER   4          2HB       SER   4  -7.875   6.200  -3.541
  563    HG   SER   4           HG       SER   4  -7.696   6.062  -6.339
  564    H    SER   5           H        SER   5 -11.396   3.990  -3.416
  565    HA   SER   5           HA       SER   5  -9.721   2.162  -2.045
  566   1HB   SER   5          1HB       SER   5 -12.488   1.757  -3.221
  567   2HB   SER   5          2HB       SER   5 -11.709   0.633  -2.109
  568    HG   SER   5           HG       SER   5 -12.262   3.368  -1.604
  569    H    ASP   6           H        ASP   6  -8.002   1.429  -3.341
  570    HA   ASP   6           HA       ASP   6  -8.574  -0.822  -5.068
  571   1HB   ASP   6          1HB       ASP   6  -7.748   0.101  -7.164
  572   2HB   ASP   6          2HB       ASP   6  -9.078   1.105  -6.594
  573    H    THR   7           H        THR   7  -6.045  -0.523  -6.556
  574    HA   THR   7           HA       THR   7  -4.345  -1.612  -4.507
  575    HB   THR   7           HB       THR   7  -4.121  -2.461  -6.755
  576    HG1  THR   7           HG1      THR   7  -2.113  -2.603  -6.190
  577   1HG2  THR   7          3HG2      THR   7  -3.732   0.454  -7.430
  578   2HG2  THR   7          1HG2      THR   7  -3.162  -0.816  -8.513
  579   3HG2  THR   7          2HG2      THR   7  -4.879  -0.690  -8.126
  580    H    THR   8           H        THR   8  -2.020  -0.743  -4.298
  581    HA   THR   8           HA       THR   8  -1.930   2.229  -4.398
  582    HB   THR   8           HB       THR   8  -0.878   0.833  -1.959
  583    HG1  THR   8           HG1      THR   8  -3.536   1.760  -2.165
  584   1HG2  THR   8          1HG2      THR   8  -1.284   3.518  -2.908
  585   2HG2  THR   8          2HG2      THR   8  -2.222   3.278  -1.435
  586   3HG2  THR   8          3HG2      THR   8  -0.483   2.985  -1.431
  587    HA   PRO   9           HA       PRO   9   1.856   0.603  -6.277
  588   1HB   PRO   9          1HB       PRO   9   2.511   3.346  -6.919
  589   2HB   PRO   9          2HB       PRO   9   2.002   2.062  -8.022
  590   1HG   PRO   9          1HG       PRO   9   0.455   4.326  -7.119
  591   2HG   PRO   9          2HG       PRO   9  -0.043   3.064  -8.220
  592   1HD   PRO   9          2HD       PRO   9  -0.911   3.468  -5.538
  593   2HD   PRO   9          1HD       PRO   9  -1.365   2.152  -6.638
  594    H    CYS  10           H        CYS  10   2.806   0.121  -4.196
  595    HA   CYS  10           HA       CYS  10   4.740   2.168  -3.326
  596   1HB   CYS  10          2HB       CYS  10   4.113   1.993  -0.960
  597   2HB   CYS  10          1HB       CYS  10   2.754   2.588  -1.910
  598    H    CYS  11           H        CYS  11   6.573   1.300  -2.452
  599    HA   CYS  11           HA       CYS  11   6.971  -1.529  -2.957
  600   1HB   CYS  11          1HB       CYS  11   8.999  -0.670  -3.408
  601   2HB   CYS  11          2HB       CYS  11   8.616   0.837  -2.595
  602    H    PHE  12           H        PHE  12   7.994  -2.939  -1.229
  603    HA   PHE  12           HA       PHE  12   6.740  -2.385   1.433
  604   1HB   PHE  12          1HB       PHE  12   5.693  -4.313   0.351
  605   2HB   PHE  12          2HB       PHE  12   7.255  -5.036   0.054
  606    HD1  PHE  12           HD1      PHE  12   5.913  -3.294   3.095
  607    HD2  PHE  12           HD2      PHE  12   7.391  -6.976   1.393
  608    HE1  PHE  12           HE1      PHE  12   5.888  -4.348   5.355
  609    HE2  PHE  12           HE2      PHE  12   7.363  -8.031   3.652
  610    HZ   PHE  12           HZ       PHE  12   6.613  -6.717   5.632
  611    H    ALA  13           H        ALA  13   9.220  -4.672   0.245
  612    HA   ALA  13           HA       ALA  13  10.944  -3.868   2.527
  613   1HB   ALA  13          2HB       ALA  13  10.658  -6.287   0.835
  614   2HB   ALA  13          3HB       ALA  13  12.305  -5.881   1.316
  615   3HB   ALA  13          1HB       ALA  13  11.070  -6.156   2.545
  616    H    TYR  14           H        TYR  14  13.088  -3.138   2.204
  617    HA   TYR  14           HA       TYR  14  13.543  -2.174  -0.559
  618   1HB   TYR  14          2HB       TYR  14  15.210  -0.578   0.817
  619   2HB   TYR  14          1HB       TYR  14  13.524  -0.163   0.517
  620    HD1  TYR  14           HD2      TYR  14  11.771  -0.810   2.269
  621    HD2  TYR  14           HD1      TYR  14  16.020  -0.891   3.025
  622    HE1  TYR  14           HE2      TYR  14  11.333  -0.845   4.712
  623    HE2  TYR  14           HE1      TYR  14  15.581  -0.921   5.476
  624    HH   TYR  14           HH       TYR  14  13.547  -0.089   6.997
  625    H    ILE  15           H        ILE  15  15.726  -2.202  -1.386
  626    HA   ILE  15           HA       ILE  15  17.212  -4.564  -0.536
  627    HB   ILE  15           HB       ILE  15  17.046  -3.941  -2.920
  628   1HG1  ILE  15          1HG1      ILE  15  19.889  -3.607  -1.939
  629   2HG1  ILE  15          2HG1      ILE  15  19.069  -5.149  -2.006
  630   1HG2  ILE  15          3HG2      ILE  15  17.499  -1.360  -1.946
  631   2HG2  ILE  15          1HG2      ILE  15  18.976  -1.759  -2.824
  632   3HG2  ILE  15          2HG2      ILE  15  17.416  -1.834  -3.643
  633   1HD1  ILE  15          3HD1      ILE  15  18.578  -4.204  -4.519
  634   2HD1  ILE  15          1HD1      ILE  15  20.166  -3.506  -4.200
  635   3HD1  ILE  15          2HD1      ILE  15  19.936  -5.252  -4.112
  636    H    ALA  16           H        ALA  16  19.603  -4.405  -0.069
  637    HA   ALA  16           HA       ALA  16  20.144  -1.990   1.610
  638   1HB   ALA  16          2HB       ALA  16  20.075  -4.562   2.460
  639   2HB   ALA  16          3HB       ALA  16  21.770  -4.445   1.990
  640   3HB   ALA  16          1HB       ALA  16  21.111  -3.336   3.190
  641    H    ARG  17           H        ARG  17  20.841  -1.098  -0.610
  642    HA   ARG  17           HA       ARG  17  23.658  -0.930  -0.745
  643   1HB   ARG  17          2HB       ARG  17  22.627  -3.314  -1.946
  644   2HB   ARG  17          1HB       ARG  17  23.250  -2.272  -3.225
  645   1HG   ARG  17          1HG       ARG  17  25.417  -2.258  -2.338
  646   2HG   ARG  17          2HG       ARG  17  24.862  -2.688  -0.720
  647   1HD   ARG  17          1HD       ARG  17  25.247  -4.857  -1.181
  648   2HD   ARG  17          2HD       ARG  17  24.061  -4.781  -2.484
  649    HE   ARG  17           HE       ARG  17  26.994  -4.475  -2.796
  650   1HH1  ARG  17          2HH2      ARG  17  27.137  -3.222  -4.973
  651   2HH1  ARG  17          1HH2      ARG  17  25.857  -3.553  -6.091
  652   1HH2  ARG  17          1HH1      ARG  17  24.584  -6.148  -4.136
  653   2HH2  ARG  17          2HH1      ARG  17  24.729  -5.541  -5.752
  654    HA   PRO  18           HA       PRO  18  21.884   2.488  -3.020
  655   1HB   PRO  18          1HB       PRO  18  24.491   3.394  -3.796
  656   2HB   PRO  18          2HB       PRO  18  23.446   4.061  -2.547
  657   1HG   PRO  18          2HG       PRO  18  25.855   2.486  -2.207
  658   2HG   PRO  18          1HG       PRO  18  24.857   3.239  -0.958
  659   1HD   PRO  18          2HD       PRO  18  25.050   0.455  -1.559
  660   2HD   PRO  18          1HD       PRO  18  23.976   1.215  -0.401
  661    H    LEU  19           H        LEU  19  21.037   2.169  -4.987
  662    HA   LEU  19           HA       LEU  19  22.209   0.396  -6.935
  663   1HB   LEU  19          1HB       LEU  19  19.947   2.393  -7.118
  664   2HB   LEU  19          2HB       LEU  19  20.346   1.269  -8.394
  665    HG   LEU  19           HG       LEU  19  19.608   0.493  -5.565
  666   1HD1  LEU  19          2HD1      LEU  19  17.703   1.445  -6.816
  667   2HD1  LEU  19          3HD1      LEU  19  18.015   0.320  -8.139
  668   3HD1  LEU  19          1HD1      LEU  19  17.495  -0.289  -6.568
  669   1HD2  LEU  19          2HD2      LEU  19  20.706  -0.949  -7.880
  670   2HD2  LEU  19          3HD2      LEU  19  20.656  -1.426  -6.182
  671   3HD2  LEU  19          1HD2      LEU  19  19.250  -1.692  -7.215
  672    HA   PRO  20           HA       PRO  20  24.954   3.376  -8.804
  673   1HB   PRO  20          1HB       PRO  20  24.907   1.938 -11.312
  674   2HB   PRO  20          2HB       PRO  20  26.195   1.970 -10.101
  675   1HG   PRO  20          1HG       PRO  20  24.407  -0.202 -10.694
  676   2HG   PRO  20          2HG       PRO  20  25.655  -0.148  -9.445
  677   1HD   PRO  20          1HD       PRO  20  22.781  -0.029  -9.111
  678   2HD   PRO  20          2HD       PRO  20  24.030  -0.035  -7.852
  679    H    ARG  21           H        ARG  21  24.248   5.299  -9.654
  680    HA   ARG  21           HA       ARG  21  21.682   5.740 -10.718
  681   1HB   ARG  21          1HB       ARG  21  24.215   7.307 -11.251
  682   2HB   ARG  21          2HB       ARG  21  22.599   7.880 -11.584
  683   1HG   ARG  21          2HG       ARG  21  22.656   8.709  -9.475
  684   2HG   ARG  21          1HG       ARG  21  22.387   7.058  -8.971
  685   1HD   ARG  21          2HD       ARG  21  24.419   6.987  -8.012
  686   2HD   ARG  21          1HD       ARG  21  25.174   7.397  -9.551
  687    HE   ARG  21           HE       ARG  21  24.059   9.574  -7.848
  688   1HH1  ARG  21          1HH1      ARG  21  26.303   9.233 -10.429
  689   2HH1  ARG  21          2HH1      ARG  21  26.656  10.829  -9.857
  690   1HH2  ARG  21          1HH2      ARG  21  26.382  10.143  -6.627
  691   2HH2  ARG  21          2HH2      ARG  21  27.688   9.445  -7.525
  692    H    ALA  22           H        ALA  22  24.565   4.575 -12.311
  693    HA   ALA  22           HA       ALA  22  23.661   5.137 -15.005
  694   1HB   ALA  22          3HB       ALA  22  26.067   4.659 -14.231
  695   2HB   ALA  22          1HB       ALA  22  25.603   2.957 -14.226
  696   3HB   ALA  22          2HB       ALA  22  25.548   3.882 -15.726
  697    H    HIS  23           H        HIS  23  23.427   2.335 -12.841
  698    HA   HIS  23           HA       HIS  23  22.196   0.668 -14.886
  699   1HB   HIS  23          1HB       HIS  23  22.245   0.321 -11.876
  700   2HB   HIS  23          2HB       HIS  23  21.788  -0.910 -13.051
  701    HD2  HIS  23           HD2      HIS  23  24.846   1.113 -14.227
  702    HE1  HIS  23           HE1      HIS  23  26.333  -2.465 -12.533
  703    HE2  HIS  23           HE2      HIS  23  26.941  -0.407 -13.903
  704    H    ILE  24           H        ILE  24  21.040   3.066 -12.638
  705    HA   ILE  24           HA       ILE  24  18.281   2.037 -12.835
  706    HB   ILE  24           HB       ILE  24  19.124   4.626 -11.559
  707   1HG1  ILE  24          2HG1      ILE  24  18.918   1.898 -10.267
  708   2HG1  ILE  24          1HG1      ILE  24  20.429   2.757 -10.570
  709   1HG2  ILE  24          1HG2      ILE  24  16.667   3.015 -11.763
  710   2HG2  ILE  24          2HG2      ILE  24  17.038   3.586 -10.143
  711   3HG2  ILE  24          3HG2      ILE  24  16.858   4.743 -11.460
  712   1HD1  ILE  24          1HD1      ILE  24  18.662   4.553  -9.233
  713   2HD1  ILE  24          2HD1      ILE  24  18.621   3.024  -8.354
  714   3HD1  ILE  24          3HD1      ILE  24  20.158   3.849  -8.615
  715    H    LYS  25           H        LYS  25  16.525   3.553 -13.578
  716    HA   LYS  25           HA       LYS  25  17.546   5.403 -15.700
  717   1HB   LYS  25          1HB       LYS  25  15.141   3.560 -15.775
  718   2HB   LYS  25          2HB       LYS  25  15.483   4.792 -16.992
  719   1HG   LYS  25          1HG       LYS  25  17.762   3.021 -16.366
  720   2HG   LYS  25          2HG       LYS  25  16.387   2.208 -17.117
  721   1HD   LYS  25          1HD       LYS  25  16.398   3.841 -18.951
  722   2HD   LYS  25          2HD       LYS  25  17.729   4.710 -18.188
  723   1HE   LYS  25          1HE       LYS  25  18.959   3.385 -19.615
  724   2HE   LYS  25          2HE       LYS  25  18.834   2.265 -18.259
  725   1HZ   LYS  25          1HZ       LYS  25  16.595   1.676 -19.487
  726   2HZ   LYS  25          2HZ       LYS  25  17.466   2.225 -20.838
  727   3HZ   LYS  25          3HZ       LYS  25  18.065   0.937 -19.907
  728    H    GLU  26           H        GLU  26  15.199   4.859 -13.138
  729    HA   GLU  26           HA       GLU  26  14.662   7.717 -12.968
  730   1HB   GLU  26          1HB       GLU  26  12.056   6.998 -13.066
  731   2HB   GLU  26          2HB       GLU  26  12.913   7.576 -14.457
  732   1HG   GLU  26          2HG       GLU  26  13.178   4.680 -14.012
  733   2HG   GLU  26          1HG       GLU  26  11.543   5.223 -14.367
  734    H    TYR  27           H        TYR  27  12.327   7.502 -11.332
  735    HA   TYR  27           HA       TYR  27  12.729   5.401  -9.402
  736   1HB   TYR  27          2HB       TYR  27  13.546   6.697  -7.571
  737   2HB   TYR  27          1HB       TYR  27  14.569   7.118  -8.917
  738    HD1  TYR  27           HD2      TYR  27  14.117   9.249 -10.233
  739    HD2  TYR  27           HD1      TYR  27  12.152   8.346  -6.496
  740    HE1  TYR  27           HE2      TYR  27  13.420  11.633 -10.023
  741    HE2  TYR  27           HE1      TYR  27  11.449  10.729  -6.291
  742    HH   TYR  27           HH       TYR  27  11.703  12.955  -8.894
  743    H    PHE  28           H        PHE  28  11.268   6.168  -7.308
  744    HA   PHE  28           HA       PHE  28   9.036   7.810  -8.221
  745   1HB   PHE  28          1HB       PHE  28   8.294   5.823  -9.273
  746   2HB   PHE  28          2HB       PHE  28   8.829   4.813  -7.933
  747    HD1  PHE  28           HD1      PHE  28   6.812   7.983  -7.914
  748    HD2  PHE  28           HD2      PHE  28   6.903   3.746  -7.094
  749    HE1  PHE  28           HE1      PHE  28   4.601   8.154  -6.776
  750    HE2  PHE  28           HE2      PHE  28   4.691   3.916  -5.966
  751    HZ   PHE  28           HZ       PHE  28   3.531   6.118  -5.816
  752    H    TYR  29           H        TYR  29   9.848   8.953  -6.263
  753    HA   TYR  29           HA       TYR  29   9.913   7.811  -3.668
  754   1HB   TYR  29          1HB       TYR  29  10.785  10.049  -4.120
  755   2HB   TYR  29          2HB       TYR  29   9.167  10.626  -4.502
  756    HD1  TYR  29           HD1      TYR  29  10.632   8.525  -1.740
  757    HD2  TYR  29           HD2      TYR  29   8.303  11.995  -2.821
  758    HE1  TYR  29           HE1      TYR  29  10.233   9.008   0.672
  759    HE2  TYR  29           HE2      TYR  29   7.902  12.478  -0.410
  760    HH   TYR  29           HH       TYR  29   8.713  11.993   1.726
  761    H    THR  30           H        THR  30   8.343   7.175  -2.326
  762    HA   THR  30           HA       THR  30   5.573   7.146  -3.243
  763    HB   THR  30           HB       THR  30   6.328   6.447  -0.429
  764    HG1  THR  30           HG1      THR  30   6.945   4.354  -1.401
  765   1HG2  THR  30          3HG2      THR  30   4.233   5.862  -2.380
  766   2HG2  THR  30          1HG2      THR  30   4.886   4.399  -1.642
  767   3HG2  THR  30          2HG2      THR  30   4.212   5.675  -0.627
  768    H    SER  31           H        SER  31   3.820   8.280  -2.293
  769    HA   SER  31           HA       SER  31   4.555  10.849  -1.084
  770   1HB   SER  31          1HB       SER  31   2.753  10.659  -2.802
  771   2HB   SER  31          2HB       SER  31   1.806   9.705  -1.660
  772    HG   SER  31           HG       SER  31   2.064  11.548  -0.205
  773    H    GLY  32           H        GLY  32   2.082   8.436  -0.133
  774   1HA   GLY  32          2HA       GLY  32   3.015   7.837   2.429
  775   2HA   GLY  32          1HA       GLY  32   2.107   9.319   2.616
  776    H    LYS  33           H        LYS  33   1.616   6.353   0.670
  777    HA   LYS  33           HA       LYS  33  -1.221   6.365   1.565
  778   1HB   LYS  33          2HB       LYS  33   0.092   4.698  -0.601
  779   2HB   LYS  33          1HB       LYS  33  -1.637   4.859  -0.301
  780   1HG   LYS  33          2HG       LYS  33  -0.195   7.408  -0.668
  781   2HG   LYS  33          1HG       LYS  33  -0.249   6.390  -2.086
  782   1HD   LYS  33          2HD       LYS  33  -2.832   6.364  -0.835
  783   2HD   LYS  33          1HD       LYS  33  -2.320   8.037  -1.059
  784   1HE   LYS  33          1HE       LYS  33  -1.784   6.252  -3.355
  785   2HE   LYS  33          2HE       LYS  33  -3.493   6.527  -3.012
  786   1HZ   LYS  33          1HZ       LYS  33  -1.580   8.772  -3.114
  787   2HZ   LYS  33          2HZ       LYS  33  -2.291   8.167  -4.533
  788   3HZ   LYS  33          3HZ       LYS  33  -3.268   8.803  -3.298
  789    H    CYS  34           H        CYS  34   1.044   3.711   0.763
  790    HA   CYS  34           HA       CYS  34  -0.172   1.939   2.687
  791   1HB   CYS  34          2HB       CYS  34   2.615   1.636   1.551
  792   2HB   CYS  34          1HB       CYS  34   1.511   0.365   2.072
  793    H    SER  35           H        SER  35   1.533   0.814   4.308
  794    HA   SER  35           HA       SER  35   2.482   3.032   6.039
  795   1HB   SER  35          1HB       SER  35   1.786   0.142   6.492
  796   2HB   SER  35          2HB       SER  35   2.817   0.985   7.648
  797    HG   SER  35           HG       SER  35   0.761   1.316   8.327
  798    H    ASN  36           H        ASN  36   3.933   2.116   3.601
  799    HA   ASN  36           HA       ASN  36   6.529   1.525   4.943
  800   1HB   ASN  36          2HB       ASN  36   5.166  -0.043   2.806
  801   2HB   ASN  36          1HB       ASN  36   6.907   0.185   2.648
  802   1HD2  ASN  36          2HD2      ASN  36   5.150  -1.670   5.811
  803   2HD2  ASN  36          1HD2      ASN  36   4.700  -2.046   4.217
  804    HA   PRO  37           HA       PRO  37   6.507   5.169   1.972
  805   1HB   PRO  37          1HB       PRO  37   8.217   6.469   3.918
  806   2HB   PRO  37          2HB       PRO  37   6.607   6.959   3.379
  807   1HG   PRO  37          2HG       PRO  37   7.331   5.799   5.913
  808   2HG   PRO  37          1HG       PRO  37   5.713   6.242   5.355
  809   1HD   PRO  37          2HD       PRO  37   6.797   3.595   5.688
  810   2HD   PRO  37          1HD       PRO  37   5.191   4.036   5.128
  811    H    ALA  38           H        ALA  38   8.291   5.568   0.588
  812    HA   ALA  38           HA       ALA  38  11.018   5.049   1.301
  813   1HB   ALA  38          3HB       ALA  38  10.043   2.708   1.338
  814   2HB   ALA  38          1HB       ALA  38   9.757   2.884  -0.393
  815   3HB   ALA  38          2HB       ALA  38  11.405   2.930   0.237
  816    H    VAL  39           H        VAL  39  11.604   3.938  -1.439
  817    HA   VAL  39           HA       VAL  39  10.611   6.047  -3.217
  818    HB   VAL  39           HB       VAL  39  12.889   6.551  -1.815
  819   1HG1  VAL  39          3HG1      VAL  39  13.912   4.557  -3.169
  820   2HG1  VAL  39          1HG1      VAL  39  14.037   5.759  -4.455
  821   3HG1  VAL  39          2HG1      VAL  39  14.851   6.028  -2.913
  822   1HG2  VAL  39          2HG2      VAL  39  11.709   7.492  -4.323
  823   2HG2  VAL  39          3HG2      VAL  39  12.215   8.396  -2.890
  824   3HG2  VAL  39          1HG2      VAL  39  13.407   7.915  -4.102
  825    H    VAL  40           H        VAL  40  10.497   5.178  -5.264
  826    HA   VAL  40           HA       VAL  40  11.511   2.386  -5.412
  827    HB   VAL  40           HB       VAL  40   8.999   3.696  -6.353
  828   1HG1  VAL  40          2HG1      VAL  40   9.979   2.554  -8.360
  829   2HG1  VAL  40          3HG1      VAL  40  10.034   1.065  -7.421
  830   3HG1  VAL  40          1HG1      VAL  40   8.484   1.818  -7.793
  831   1HG2  VAL  40          2HG2      VAL  40   9.842   1.181  -4.903
  832   2HG2  VAL  40          3HG2      VAL  40   8.934   2.551  -4.254
  833   3HG2  VAL  40          1HG2      VAL  40   8.175   1.463  -5.418
  834    H    PHE  41           H        PHE  41  13.298   2.261  -6.573
  835    HA   PHE  41           HA       PHE  41  13.745   4.057  -8.819
  836   1HB   PHE  41          2HB       PHE  41  15.354   1.876  -7.526
  837   2HB   PHE  41          1HB       PHE  41  15.848   2.570  -9.048
  838    HD1  PHE  41           HD2      PHE  41  16.330   5.063  -9.204
  839    HD2  PHE  41           HD1      PHE  41  15.582   3.068  -5.451
  840    HE1  PHE  41           HE2      PHE  41  17.409   6.951  -7.989
  841    HE2  PHE  41           HE1      PHE  41  16.608   4.980  -4.235
  842    HZ   PHE  41           HZ       PHE  41  17.576   6.896  -5.500
  843    H    VAL  42           H        VAL  42  13.550   3.628 -10.860
  844    HA   VAL  42           HA       VAL  42  12.492   0.946 -11.642
  845    HB   VAL  42           HB       VAL  42  12.028   2.750 -13.736
  846   1HG1  VAL  42          3HG2      VAL  42  10.443   1.428 -11.572
  847   2HG1  VAL  42          1HG2      VAL  42   9.624   2.580 -12.627
  848   3HG1  VAL  42          2HG2      VAL  42  10.388   1.146 -13.315
  849   1HG2  VAL  42          3HG1      VAL  42  12.464   4.627 -12.195
  850   2HG2  VAL  42          1HG1      VAL  42  10.780   4.585 -12.701
  851   3HG2  VAL  42          2HG1      VAL  42  11.238   4.006 -11.099
  852    H    THR  43           H        THR  43  14.754   0.222 -11.769
  853    HA   THR  43           HA       THR  43  16.672   1.616 -13.450
  854    HB   THR  43           HB       THR  43  18.245   0.006 -12.739
  855    HG1  THR  43           HG1      THR  43  15.989  -1.655 -12.323
  856   1HG2  THR  43          1HG2      THR  43  17.124   1.351 -10.876
  857   2HG2  THR  43          2HG2      THR  43  16.200  -0.104 -10.511
  858   3HG2  THR  43          3HG2      THR  43  17.958  -0.117 -10.373
  859    H    ARG  44           H        ARG  44  18.031  -0.552 -14.625
  860    HA   ARG  44           HA       ARG  44  17.062  -0.523 -17.209
  861   1HB   ARG  44          1HB       ARG  44  18.340  -2.769 -17.459
  862   2HB   ARG  44          2HB       ARG  44  19.244  -1.353 -16.994
  863   1HG   ARG  44          1HG       ARG  44  18.283  -2.480 -14.584
  864   2HG   ARG  44          2HG       ARG  44  18.892  -3.821 -15.549
  865   1HD   ARG  44          1HD       ARG  44  21.042  -2.756 -15.798
  866   2HD   ARG  44          2HD       ARG  44  20.444  -1.263 -15.071
  867    HE   ARG  44           HE       ARG  44  20.483  -2.342 -12.913
  868   1HH1  ARG  44          2HH1      ARG  44  19.744  -5.073 -14.197
  869   2HH1  ARG  44          1HH1      ARG  44  21.193  -5.978 -13.904
  870   1HH2  ARG  44          2HH2      ARG  44  23.276  -3.550 -13.594
  871   2HH2  ARG  44          1HH2      ARG  44  22.754  -4.605 -12.323
  872    H    LYS  45           H        LYS  45  16.629  -3.348 -15.003
  873    HA   LYS  45           HA       LYS  45  14.708  -4.690 -16.628
  874   1HB   LYS  45          2HB       LYS  45  15.347  -4.666 -13.700
  875   2HB   LYS  45          1HB       LYS  45  13.818  -5.386 -14.205
  876   1HG   LYS  45          1HG       LYS  45  15.004  -6.880 -15.746
  877   2HG   LYS  45          2HG       LYS  45  16.541  -6.127 -15.320
  878   1HD   LYS  45          1HD       LYS  45  16.610  -7.908 -13.860
  879   2HD   LYS  45          2HD       LYS  45  15.714  -6.772 -12.851
  880   1HE   LYS  45          1HE       LYS  45  13.956  -8.175 -12.820
  881   2HE   LYS  45          2HE       LYS  45  13.854  -8.093 -14.579
  882   1HZ   LYS  45          1HZ       LYS  45  15.666  -9.787 -14.626
  883   2HZ   LYS  45          2HZ       LYS  45  15.471  -9.967 -12.949
  884   3HZ   LYS  45          3HZ       LYS  45  14.191 -10.346 -13.999
  885    H    ASN  46           H        ASN  46  14.575  -2.005 -14.454
  886    HA   ASN  46           HA       ASN  46  13.081  -0.295 -14.189
  887   1HB   ASN  46          2HB       ASN  46  12.523  -1.351 -16.798
  888   2HB   ASN  46          1HB       ASN  46  10.983  -0.990 -16.022
  889   1HD2  ASN  46          1HD2      ASN  46  11.960   1.910 -17.830
  890   2HD2  ASN  46          2HD2      ASN  46  10.561   1.213 -17.165
  891    H    ARG  47           H        ARG  47  12.593  -3.265 -13.186
  892    HA   ARG  47           HA       ARG  47   9.768  -3.311 -12.582
  893   1HB   ARG  47          2HB       ARG  47  12.072  -4.837 -11.834
  894   2HB   ARG  47          1HB       ARG  47  11.299  -4.284 -10.352
  895   1HG   ARG  47          1HG       ARG  47   9.218  -5.297 -10.950
  896   2HG   ARG  47          2HG       ARG  47   9.747  -5.569 -12.610
  897   1HD   ARG  47          1HD       ARG  47  11.695  -6.896 -11.241
  898   2HD   ARG  47          2HD       ARG  47  10.321  -7.135 -10.160
  899    HE   ARG  47           HE       ARG  47  10.356  -7.974 -13.030
  900   1HH1  ARG  47          1HH1      ARG  47   7.455  -7.924 -11.757
  901   2HH1  ARG  47          2HH1      ARG  47   7.798  -8.708 -10.252
  902   1HH2  ARG  47          1HH2      ARG  47  10.123 -10.486 -10.935
  903   2HH2  ARG  47          2HH2      ARG  47   9.206 -10.699 -12.390
  904    H    GLN  48           H        GLN  48   9.053  -2.668 -10.172
  905    HA   GLN  48           HA       GLN  48  10.235  -0.014  -9.838
  906   1HB   GLN  48          2HB       GLN  48   7.666  -1.238  -9.101
  907   2HB   GLN  48          1HB       GLN  48   8.291  -0.065  -7.961
  908   1HG   GLN  48          2HG       GLN  48   8.618   1.552  -9.763
  909   2HG   GLN  48          1HG       GLN  48   8.126   0.382 -10.949
  910   1HE2  GLN  48          1HE2      GLN  48   4.678   0.983 -10.492
  911   2HE2  GLN  48          2HE2      GLN  48   5.819  -0.093 -11.143
  912    H    VAL  49           H        VAL  49  12.169  -1.063  -9.256
  913    HA   VAL  49           HA       VAL  49  12.646  -2.588  -6.958
  914    HB   VAL  49           HB       VAL  49  14.662  -0.522  -7.646
  915   1HG1  VAL  49          1HG1      VAL  49  14.610  -3.502  -7.195
  916   2HG1  VAL  49          2HG1      VAL  49  16.076  -2.622  -7.626
  917   3HG1  VAL  49          3HG1      VAL  49  15.245  -2.263  -6.111
  918   1HG2  VAL  49          2HG2      VAL  49  13.677  -2.600  -9.625
  919   2HG2  VAL  49          3HG2      VAL  49  13.983  -0.892  -9.935
  920   3HG2  VAL  49          1HG2      VAL  49  15.331  -2.000  -9.675
  921    H    CYS  50           H        CYS  50  13.571  -1.844  -4.896
  922    HA   CYS  50           HA       CYS  50  12.498   0.819  -4.086
  923   1HB   CYS  50          1HB       CYS  50  11.528  -1.473  -3.173
  924   2HB   CYS  50          2HB       CYS  50  12.930  -1.409  -2.141
  925    H    ALA  51           H        ALA  51  13.735   1.450  -1.860
  926    HA   ALA  51           HA       ALA  51  16.347   0.502  -1.364
  927   1HB   ALA  51          1HB       ALA  51  16.173   1.944  -3.805
  928   2HB   ALA  51          2HB       ALA  51  17.026   2.973  -2.654
  929   3HB   ALA  51          3HB       ALA  51  17.627   1.352  -3.001
  930    H    ASN  52           H        ASN  52  14.130   1.641   0.104
  931    HA   ASN  52           HA       ASN  52  13.882   3.028   1.977
  932   1HB   ASN  52          1HB       ASN  52  16.247   2.212   2.361
  933   2HB   ASN  52          2HB       ASN  52  16.812   3.658   1.525
  934   1HD2  ASN  52          2HD2      ASN  52  16.027   3.058   5.149
  935   2HD2  ASN  52          1HD2      ASN  52  14.446   3.409   4.637
  936    HA   PRO  53           HA       PRO  53  13.289   6.944   0.007
  937   1HB   PRO  53          2HB       PRO  53  12.068   8.240   2.049
  938   2HB   PRO  53          1HB       PRO  53  11.265   6.999   1.120
  939   1HG   PRO  53          2HG       PRO  53  12.326   6.824   3.896
  940   2HG   PRO  53          1HG       PRO  53  11.025   5.912   3.153
  941   1HD   PRO  53          2HD       PRO  53  13.691   5.016   3.558
  942   2HD   PRO  53          1HD       PRO  53  12.456   4.201   2.606
  943    H    GLU  54           H        GLU  54  14.223   7.293   3.463
  944    HA   GLU  54           HA       GLU  54  15.891   9.641   2.722
  945   1HB   GLU  54          1HB       GLU  54  14.304   8.877   5.037
  946   2HB   GLU  54          2HB       GLU  54  15.936   9.352   5.506
  947   1HG   GLU  54          1HG       GLU  54  15.674  11.517   4.747
  948   2HG   GLU  54          2HG       GLU  54  14.523  11.049   3.494
  949    H    LYS  55           H        LYS  55  17.028   7.228   1.942
  950    HA   LYS  55           HA       LYS  55  19.007   6.505   4.026
  951   1HB   LYS  55          1HB       LYS  55  17.877   5.193   1.722
  952   2HB   LYS  55          2HB       LYS  55  19.619   5.180   1.622
  953   1HG   LYS  55          1HG       LYS  55  18.227   4.454   4.190
  954   2HG   LYS  55          2HG       LYS  55  18.452   3.252   2.920
  955   1HD   LYS  55          1HD       LYS  55  20.719   3.151   3.237
  956   2HD   LYS  55          2HD       LYS  55  20.844   4.868   3.622
  957   1HE   LYS  55          1HE       LYS  55  20.088   4.517   5.862
  958   2HE   LYS  55          2HE       LYS  55  19.552   2.876   5.499
  959   1HZ   LYS  55          3HZ       LYS  55  22.023   2.530   4.879
  960   2HZ   LYS  55          1HZ       LYS  55  22.287   3.900   5.849
  961   3HZ   LYS  55          2HZ       LYS  55  21.564   2.515   6.514
  962    H    LYS  56           H        LYS  56  18.937   9.163   2.607
  963    HA   LYS  56           HA       LYS  56  20.498  10.695   1.804
  964   1HB   LYS  56          1HB       LYS  56  22.401   8.473   2.586
  965   2HB   LYS  56          2HB       LYS  56  22.920  10.069   2.051
  966   1HG   LYS  56          1HG       LYS  56  21.861  11.138   3.913
  967   2HG   LYS  56          2HG       LYS  56  20.989   9.667   4.346
  968   1HD   LYS  56          1HD       LYS  56  22.895   9.962   5.853
  969   2HD   LYS  56          2HD       LYS  56  23.169   8.557   4.824
  970   1HE   LYS  56          1HE       LYS  56  24.143  11.162   3.775
  971   2HE   LYS  56          2HE       LYS  56  25.014  10.505   5.161
  972   1HZ   LYS  56          1HZ       LYS  56  24.376   8.646   3.012
  973   2HZ   LYS  56          2HZ       LYS  56  25.557   9.818   2.671
  974   3HZ   LYS  56          3HZ       LYS  56  25.768   8.755   3.979
  975    H    TRP  57           H        TRP  57  22.425   7.943   0.708
  976    HA   TRP  57           HA       TRP  57  22.932   8.819  -1.853
  977   1HB   TRP  57          1HB       TRP  57  23.459   6.567  -2.460
  978   2HB   TRP  57          2HB       TRP  57  23.880   6.765  -0.756
  979    HD1  TRP  57           HD1      TRP  57  22.777   5.074   0.862
  980    HE1  TRP  57           HE1      TRP  57  21.140   3.109   0.507
  981    HE3  TRP  57           HE3      TRP  57  21.259   6.125  -3.852
  982    HZ2  TRP  57           HZ2      TRP  57  19.378   2.122  -1.567
  983    HZ3  TRP  57           HZ3      TRP  57  19.712   4.648  -5.055
  984    HH2  TRP  57           HH2      TRP  57  18.779   2.636  -3.931
  985    H    VAL  58           H        VAL  58  19.991   7.063  -0.890
  986    HA   VAL  58           HA       VAL  58  18.898   6.671  -3.464
  987    HB   VAL  58           HB       VAL  58  16.626   7.196  -2.186
  988   1HG1  VAL  58          1HG1      VAL  58  17.914   4.995  -2.888
  989   2HG1  VAL  58          2HG1      VAL  58  18.089   4.829  -1.145
  990   3HG1  VAL  58          3HG1      VAL  58  16.482   4.936  -1.869
  991   1HG2  VAL  58          3HG2      VAL  58  18.366   8.001  -0.255
  992   2HG2  VAL  58          1HG2      VAL  58  16.719   7.451   0.045
  993   3HG2  VAL  58          2HG2      VAL  58  18.067   6.328   0.208
  994    H    ARG  59           H        ARG  59  18.475   9.534  -1.359
  995    HA   ARG  59           HA       ARG  59  17.015  11.035  -3.327
  996   1HB   ARG  59          2HB       ARG  59  18.616  11.885  -0.899
  997   2HB   ARG  59          1HB       ARG  59  17.693  13.015  -1.890
  998   1HG   ARG  59          2HG       ARG  59  15.628  11.861  -1.397
  999   2HG   ARG  59          1HG       ARG  59  16.493  10.551  -0.595
 1000   1HD   ARG  59          1HD       ARG  59  17.249  12.066   1.159
 1001   2HD   ARG  59          2HD       ARG  59  16.525  13.442   0.325
 1002    HE   ARG  59           HE       ARG  59  14.872  11.193   1.404
 1003   1HH1  ARG  59          2HH1      ARG  59  15.580  14.679   1.723
 1004   2HH1  ARG  59          1HH1      ARG  59  14.490  14.414   3.043
 1005   1HH2  ARG  59          2HH2      ARG  59  12.646  12.174   1.073
 1006   2HH2  ARG  59          1HH2      ARG  59  12.547  13.899   1.211
 1007    H    GLU  60           H        GLU  60  20.406  10.461  -2.742
 1008    HA   GLU  60           HA       GLU  60  21.449  12.672  -4.251
 1009   1HB   GLU  60          2HB       GLU  60  22.621   9.932  -3.694
 1010   2HB   GLU  60          1HB       GLU  60  23.519  11.282  -4.385
 1011   1HG   GLU  60          1HG       GLU  60  22.767  12.617  -2.316
 1012   2HG   GLU  60          2HG       GLU  60  22.308  11.061  -1.626
 1013    H    TYR  61           H        TYR  61  20.005   9.637  -5.142
 1014    HA   TYR  61           HA       TYR  61  20.947   9.953  -7.948
 1015   1HB   TYR  61          1HB       TYR  61  19.302   7.700  -6.753
 1016   2HB   TYR  61          2HB       TYR  61  20.090   7.711  -8.327
 1017    HD1  TYR  61           HD2      TYR  61  22.518   9.361  -6.679
 1018    HD2  TYR  61           HD1      TYR  61  20.639   5.470  -6.556
 1019    HE1  TYR  61           HE2      TYR  61  24.561   8.407  -5.625
 1020    HE2  TYR  61           HE1      TYR  61  22.689   4.521  -5.508
 1021    HH   TYR  61           HH       TYR  61  25.645   6.097  -5.476
 1022    H    ILE  62           H        ILE  62  18.173  10.346  -5.888
 1023    HA   ILE  62           HA       ILE  62  16.083  10.234  -7.808
 1024    HB   ILE  62           HB       ILE  62  16.445  11.837  -5.263
 1025   1HG1  ILE  62          2HG1      ILE  62  14.602   9.530  -5.916
 1026   2HG1  ILE  62          1HG1      ILE  62  16.187   9.321  -5.214
 1027   1HG2  ILE  62          2HG2      ILE  62  14.494  12.246  -7.357
 1028   2HG2  ILE  62          3HG2      ILE  62  13.700  11.674  -5.891
 1029   3HG2  ILE  62          1HG2      ILE  62  14.696  13.127  -5.844
 1030   1HD1  ILE  62          3HD1      ILE  62  15.029  11.292  -3.628
 1031   2HD1  ILE  62          1HD1      ILE  62  13.703  10.171  -3.944
 1032   3HD1  ILE  62          2HD1      ILE  62  15.194   9.589  -3.201
 1033    H    ASN  63           H        ASN  63  18.087  13.016  -6.772
 1034    HA   ASN  63           HA       ASN  63  16.911  14.730  -8.837
 1035   1HB   ASN  63          1HB       ASN  63  17.721  15.588  -6.613
 1036   2HB   ASN  63          2HB       ASN  63  19.368  15.232  -7.132
 1037   1HD2  ASN  63          2HD2      ASN  63  19.850  18.154  -8.623
 1038   2HD2  ASN  63          1HD2      ASN  63  19.554  17.892  -6.972
 1039    H    SER  64           H        SER  64  20.018  13.067  -8.317
 1040    HA   SER  64           HA       SER  64  21.374  14.079 -10.595
 1041   1HB   SER  64          1HB       SER  64  22.568  12.806  -8.909
 1042   2HB   SER  64          2HB       SER  64  21.584  11.379  -9.233
 1043    HG   SER  64           HG       SER  64  23.480  12.628 -10.915
 1044    H    LEU  65           H        LEU  65  18.719  11.872 -10.386
 1045    HA   LEU  65           HA       LEU  65  19.164  10.417 -12.821
 1046   1HB   LEU  65          2HB       LEU  65  16.897  10.882 -10.969
 1047   2HB   LEU  65          1HB       LEU  65  16.453  10.465 -12.623
 1048    HG   LEU  65           HG       LEU  65  18.486   8.893 -11.022
 1049   1HD1  LEU  65          1HD1      LEU  65  15.503   8.459 -11.345
 1050   2HD1  LEU  65          2HD1      LEU  65  16.615   7.235 -10.733
 1051   3HD1  LEU  65          3HD1      LEU  65  16.375   8.735  -9.836
 1052   1HD2  LEU  65          1HD2      LEU  65  18.486   8.741 -13.537
 1053   2HD2  LEU  65          2HD2      LEU  65  18.141   7.211 -12.732
 1054   3HD2  LEU  65          3HD2      LEU  65  16.829   8.146 -13.448
 1055    H    GLU  66           H        GLU  66  18.274  10.797 -14.914
 1056    HA   GLU  66           HA       GLU  66  17.433  13.629 -15.391
 1057   1HB   GLU  66          1HB       GLU  66  19.306  11.821 -16.884
 1058   2HB   GLU  66          2HB       GLU  66  18.399  13.041 -17.778
 1059   1HG   GLU  66          1HG       GLU  66  19.972  13.722 -15.288
 1060   2HG   GLU  66          2HG       GLU  66  20.705  13.749 -16.893
 1061    H    MET  67           H        MET  67  15.217  13.405 -15.581
 1062    HA   MET  67           HA       MET  67  14.266  11.477 -17.660
 1063   1HB   MET  67          1HB       MET  67  13.578  11.586 -14.863
 1064   2HB   MET  67          2HB       MET  67  12.152  11.952 -15.833
 1065   1HG   MET  67          1HG       MET  67  13.765   9.728 -16.888
 1066   2HG   MET  67          2HG       MET  67  13.076   9.414 -15.295
 1067   1HE   MET  67          1HE       MET  67  12.616  10.832 -18.667
 1068   2HE   MET  67          3HE       MET  67  12.235   9.169 -19.116
 1069   3HE   MET  67          2HE       MET  67  10.991  10.415 -19.212
 1070    H    SER  68           H        SER  68  14.941  14.310 -17.935
 1071    HA   SER  68           HA       SER  68  12.380  15.744 -18.023
 1072   1HB   SER  68          1HB       SER  68  14.563  16.883 -17.512
 1073   2HB   SER  68          2HB       SER  68  15.063  16.565 -19.173
 1074    HG   SER  68           HG       SER  68  12.673  17.918 -18.499
   
  No H/Q in entry =        1074
  Start of MODEL    4
    1    H    SER   1           H        SER   1  16.853 -17.846  -2.631
    2    HA   SER   1           HA       SER   1  15.265 -17.564  -5.010
    3   1HB   SER   1          1HB       SER   1  15.070 -16.755  -2.182
    4   2HB   SER   1          2HB       SER   1  14.264 -15.660  -3.305
    5    HG   SER   1           HG       SER   1  13.711 -18.303  -2.678
    6    HA   PRO   2           HA       PRO   2  16.651 -13.868  -6.894
    7   1HB   PRO   2          1HB       PRO   2  14.174 -12.389  -6.779
    8   2HB   PRO   2          2HB       PRO   2  14.853 -13.262  -8.157
    9   1HG   PRO   2          1HG       PRO   2  12.588 -14.012  -6.537
   10   2HG   PRO   2          2HG       PRO   2  13.275 -14.891  -7.909
   11   1HD   PRO   2          1HD       PRO   2  13.433 -15.573  -5.109
   12   2HD   PRO   2          2HD       PRO   2  14.119 -16.456  -6.487
   13    H    TYR   3           H        TYR   3  14.446 -13.200  -4.161
   14    HA   TYR   3           HA       TYR   3  14.596 -11.608  -2.441
   15   1HB   TYR   3          1HB       TYR   3  16.673 -12.875  -1.967
   16   2HB   TYR   3          2HB       TYR   3  17.555 -11.827  -3.077
   17    HD1  TYR   3           HD1      TYR   3  14.871 -10.978  -0.593
   18    HD2  TYR   3           HD2      TYR   3  19.016 -10.549  -1.723
   19    HE1  TYR   3           HE1      TYR   3  15.198  -9.315   1.235
   20    HE2  TYR   3           HE2      TYR   3  19.343  -8.886   0.105
   21    HH   TYR   3           HH       TYR   3  18.364  -8.171   2.144
   22    H    SER   4           H        SER   4  13.810 -10.451  -4.756
   23    HA   SER   4           HA       SER   4  15.589  -8.121  -5.239
   24   1HB   SER   4          1HB       SER   4  13.579  -9.571  -6.789
   25   2HB   SER   4          2HB       SER   4  13.332  -7.827  -6.841
   26    HG   SER   4           HG       SER   4  15.857  -9.028  -7.247
   27    H    SER   5           H        SER   5  14.776  -5.963  -4.998
   28    HA   SER   5           HA       SER   5  12.407  -5.777  -3.179
   29   1HB   SER   5          1HB       SER   5  15.060  -4.389  -3.192
   30   2HB   SER   5          2HB       SER   5  13.653  -3.494  -2.618
   31    HG   SER   5           HG       SER   5  15.003  -5.578  -1.470
   32    H    ASP   6           H        ASP   6  10.705  -4.752  -4.105
   33    HA   ASP   6           HA       ASP   6  11.118  -2.396  -5.812
   34   1HB   ASP   6          1HB       ASP   6   9.599  -4.752  -6.954
   35   2HB   ASP   6          2HB       ASP   6  10.044  -3.277  -7.773
   36    H    THR   7           H        THR   7   8.409  -2.594  -6.922
   37    HA   THR   7           HA       THR   7   7.035  -1.468  -4.673
   38    HB   THR   7           HB       THR   7   6.658  -0.848  -7.094
   39    HG1  THR   7           HG1      THR   7   4.957  -0.057  -6.212
   40   1HG2  THR   7          3HG2      THR   7   6.514  -3.385  -7.708
   41   2HG2  THR   7          1HG2      THR   7   4.820  -3.222  -7.245
   42   3HG2  THR   7          2HG2      THR   7   5.474  -2.241  -8.556
   43    H    THR   8           H        THR   8   4.530  -2.445  -4.547
   44    HA   THR   8           HA       THR   8   4.520  -5.370  -4.422
   45    HB   THR   8           HB       THR   8   3.992  -3.978  -1.818
   46    HG1  THR   8           HG1      THR   8   6.314  -4.669  -1.451
   47   1HG2  THR   8          3HG2      THR   8   4.206  -6.678  -2.854
   48   2HG2  THR   8          1HG2      THR   8   5.337  -6.437  -1.523
   49   3HG2  THR   8          2HG2      THR   8   3.615  -6.138  -1.283
   50    HA   PRO   9           HA       PRO   9   0.431  -3.936  -5.598
   51   1HB   PRO   9          1HB       PRO   9  -0.425  -6.710  -5.318
   52   2HB   PRO   9          2HB       PRO   9  -0.272  -5.744  -6.792
   53   1HG   PRO   9          1HG       PRO   9   1.476  -7.840  -5.906
   54   2HG   PRO   9          2HG       PRO   9   1.674  -6.826  -7.316
   55   1HD   PRO   9          1HD       PRO   9   3.207  -6.778  -4.914
   56   2HD   PRO   9          2HD       PRO   9   3.378  -5.735  -6.318
   57    H    CYS  10           H        CYS  10   0.106  -2.863  -3.553
   58    HA   CYS  10           HA       CYS  10  -1.423  -4.508  -1.582
   59   1HB   CYS  10          2HB       CYS  10   0.718  -2.447  -1.116
   60   2HB   CYS  10          1HB       CYS  10  -0.505  -2.756   0.107
   61    H    CYS  11           H        CYS  11  -3.338  -3.657  -1.002
   62    HA   CYS  11           HA       CYS  11  -4.111  -1.142  -2.303
   63   1HB   CYS  11          1HB       CYS  11  -6.036  -2.267  -2.533
   64   2HB   CYS  11          2HB       CYS  11  -5.501  -3.533  -1.472
   65    H    PHE  12           H        PHE  12  -5.230   0.553  -0.944
   66    HA   PHE  12           HA       PHE  12  -4.081   0.619   1.820
   67   1HB   PHE  12          1HB       PHE  12  -2.882   2.219   0.458
   68   2HB   PHE  12          2HB       PHE  12  -4.384   2.860  -0.200
   69    HD1  PHE  12           HD1      PHE  12  -3.868   1.934   3.377
   70    HD2  PHE  12           HD2      PHE  12  -4.117   5.144   0.499
   71    HE1  PHE  12           HE1      PHE  12  -3.996   3.588   5.237
   72    HE2  PHE  12           HE2      PHE  12  -4.256   6.799   2.362
   73    HZ   PHE  12           HZ       PHE  12  -4.193   6.020   4.729
   74    H    ALA  13           H        ALA  13  -6.558   2.294  -0.165
   75    HA   ALA  13           HA       ALA  13  -8.302   2.383   2.236
   76   1HB   ALA  13          2HB       ALA  13  -8.037   3.962  -0.238
   77   2HB   ALA  13          3HB       ALA  13  -9.705   3.626   0.226
   78   3HB   ALA  13          1HB       ALA  13  -8.627   4.455   1.349
   79    H    TYR  14           H        TYR  14  -9.884   0.938   2.499
   80    HA   TYR  14           HA       TYR  14 -10.387  -0.990   0.368
   81   1HB   TYR  14          1HB       TYR  14 -11.965  -0.861   2.931
   82   2HB   TYR  14          2HB       TYR  14 -11.538  -2.275   1.972
   83    HD1  TYR  14           HD2      TYR  14  -9.003  -2.886   1.799
   84    HD2  TYR  14           HD1      TYR  14 -10.632  -0.218   4.776
   85    HE1  TYR  14           HE2      TYR  14  -6.977  -3.219   3.206
   86    HE2  TYR  14           HE1      TYR  14  -8.608  -0.562   6.190
   87    HH   TYR  14           HH       TYR  14  -6.178  -1.246   5.795
   88    H    ILE  15           H        ILE  15 -12.107  -0.906  -1.045
   89    HA   ILE  15           HA       ILE  15 -13.648   1.427  -1.371
   90    HB   ILE  15           HB       ILE  15 -13.327  -0.436  -3.063
   91   1HG1  ILE  15          2HG1      ILE  15 -16.132  -0.188  -3.371
   92   2HG1  ILE  15          1HG1      ILE  15 -15.580   1.290  -2.584
   93   1HG2  ILE  15          2HG2      ILE  15 -14.068  -2.249  -1.445
   94   2HG2  ILE  15          3HG2      ILE  15 -15.716  -1.672  -1.674
   95   3HG2  ILE  15          1HG2      ILE  15 -14.811  -2.322  -3.041
   96   1HD1  ILE  15          3HD1      ILE  15 -14.098   0.172  -4.957
   97   2HD1  ILE  15          1HD1      ILE  15 -15.522   1.186  -5.185
   98   3HD1  ILE  15          2HD1      ILE  15 -14.110   1.825  -4.344
   99    H    ALA  16           H        ALA  16 -14.344  -1.452   0.569
  100    HA   ALA  16           HA       ALA  16 -15.902  -1.737   2.294
  101   1HB   ALA  16          2HB       ALA  16 -15.239   0.735   2.731
  102   2HB   ALA  16          3HB       ALA  16 -16.757   1.134   1.927
  103   3HB   ALA  16          1HB       ALA  16 -16.768   0.162   3.399
  104    H    ARG  17           H        ARG  17 -18.041  -2.382   2.343
  105    HA   ARG  17           HA       ARG  17 -20.241  -2.734   1.592
  106   1HB   ARG  17          1HB       ARG  17 -19.873  -0.155   0.864
  107   2HB   ARG  17          2HB       ARG  17 -20.047  -0.886  -0.713
  108   1HG   ARG  17          1HG       ARG  17 -22.221  -1.627  -0.282
  109   2HG   ARG  17          2HG       ARG  17 -21.984  -1.602   1.466
  110   1HD   ARG  17          1HD       ARG  17 -23.438   0.272   0.526
  111   2HD   ARG  17          2HD       ARG  17 -22.087   0.791   1.535
  112    HE   ARG  17           HE       ARG  17 -21.614   0.703  -1.386
  113   1HH1  ARG  17          2HH1      ARG  17 -23.259   2.757   0.749
  114   2HH1  ARG  17          1HH1      ARG  17 -22.650   4.130  -0.115
  115   1HH2  ARG  17          2HH2      ARG  17 -19.826   2.414  -1.223
  116   2HH2  ARG  17          1HH2      ARG  17 -20.341   3.929  -0.560
  117    HA   PRO  18           HA       PRO  18 -18.894  -5.804  -1.369
  118   1HB   PRO  18          2HB       PRO  18 -21.648  -6.587  -1.752
  119   2HB   PRO  18          1HB       PRO  18 -20.390  -7.458  -0.921
  120   1HG   PRO  18          2HG       PRO  18 -22.608  -6.083   0.249
  121   2HG   PRO  18          1HG       PRO  18 -21.305  -6.895   1.090
  122   1HD   PRO  18          2HD       PRO  18 -21.768  -4.062   0.876
  123   2HD   PRO  18          1HD       PRO  18 -20.448  -4.884   1.727
  124    H    LEU  19           H        LEU  19 -18.293  -4.518  -3.116
  125    HA   LEU  19           HA       LEU  19 -20.001  -2.874  -4.665
  126   1HB   LEU  19          2HB       LEU  19 -18.217  -2.781  -6.263
  127   2HB   LEU  19          1HB       LEU  19 -17.458  -2.934  -4.685
  128    HG   LEU  19           HG       LEU  19 -18.026  -5.390  -6.335
  129   1HD1  LEU  19          3HD1      LEU  19 -15.775  -3.403  -6.601
  130   2HD1  LEU  19          1HD1      LEU  19 -15.541  -5.103  -7.004
  131   3HD1  LEU  19          2HD1      LEU  19 -16.739  -4.148  -7.875
  132   1HD2  LEU  19          3HD2      LEU  19 -16.347  -4.610  -3.981
  133   2HD2  LEU  19          1HD2      LEU  19 -17.339  -6.049  -4.216
  134   3HD2  LEU  19          2HD2      LEU  19 -15.780  -5.910  -5.029
  135    HA   PRO  20           HA       PRO  20 -22.483  -5.504  -7.124
  136   1HB   PRO  20          1HB       PRO  20 -21.726  -4.358  -9.678
  137   2HB   PRO  20          2HB       PRO  20 -23.222  -4.114  -8.768
  138   1HG   PRO  20          1HG       PRO  20 -21.061  -2.249  -9.116
  139   2HG   PRO  20          2HG       PRO  20 -22.527  -2.029  -8.154
  140   1HD   PRO  20          1HD       PRO  20 -19.834  -2.446  -7.212
  141   2HD   PRO  20          2HD       PRO  20 -21.300  -2.215  -6.243
  142    H    ARG  21           H        ARG  21 -21.837  -7.589  -7.413
  143    HA   ARG  21           HA       ARG  21 -19.219  -8.370  -8.270
  144   1HB   ARG  21          1HB       ARG  21 -20.891  -9.751  -6.926
  145   2HB   ARG  21          2HB       ARG  21 -21.706 -10.076  -8.435
  146   1HG   ARG  21          1HG       ARG  21 -20.063 -11.477  -9.181
  147   2HG   ARG  21          2HG       ARG  21 -18.779 -10.507  -8.460
  148   1HD   ARG  21          1HD       ARG  21 -18.668 -12.007  -6.785
  149   2HD   ARG  21          2HD       ARG  21 -20.278 -11.533  -6.303
  150    HE   ARG  21           HE       ARG  21 -19.592 -14.008  -7.600
  151   1HH1  ARG  21          1HH1      ARG  21 -22.545 -11.724  -7.572
  152   2HH1  ARG  21          2HH1      ARG  21 -22.858 -12.978  -6.420
  153   1HH2  ARG  21          1HH2      ARG  21 -21.630 -14.207  -9.626
  154   2HH2  ARG  21          2HH2      ARG  21 -22.358 -15.110  -8.339
  155    H    ALA  22           H        ALA  22 -22.245  -7.883 -10.023
  156    HA   ALA  22           HA       ALA  22 -21.470  -9.166 -12.452
  157   1HB   ALA  22          2HB       ALA  22 -23.539  -7.215 -11.619
  158   2HB   ALA  22          3HB       ALA  22 -23.110  -7.182 -13.329
  159   3HB   ALA  22          1HB       ALA  22 -23.698  -8.675 -12.596
  160    H    HIS  23           H        HIS  23 -20.473  -6.177 -11.025
  161    HA   HIS  23           HA       HIS  23 -19.444  -5.164 -13.610
  162   1HB   HIS  23          2HB       HIS  23 -19.152  -3.914 -10.874
  163   2HB   HIS  23          1HB       HIS  23 -18.936  -3.134 -12.420
  164    HD2  HIS  23           HD2      HIS  23 -22.009  -5.145 -12.962
  165    HE1  HIS  23           HE1      HIS  23 -23.431  -1.555 -11.241
  166    HE2  HIS  23           HE2      HIS  23 -24.107  -3.670 -12.483
  167    H    ILE  24           H        ILE  24 -18.355  -7.001 -10.902
  168    HA   ILE  24           HA       ILE  24 -15.543  -6.224 -11.216
  169    HB   ILE  24           HB       ILE  24 -16.383  -8.724  -9.808
  170   1HG1  ILE  24          2HG1      ILE  24 -16.658  -5.908  -8.715
  171   2HG1  ILE  24          1HG1      ILE  24 -17.981  -7.032  -9.021
  172   1HG2  ILE  24          3HG2      ILE  24 -14.061  -6.978  -9.980
  173   2HG2  ILE  24          1HG2      ILE  24 -14.548  -7.247  -8.309
  174   3HG2  ILE  24          2HG2      ILE  24 -14.178  -8.621  -9.350
  175   1HD1  ILE  24          1HD1      ILE  24 -16.006  -8.356  -7.410
  176   2HD1  ILE  24          2HD1      ILE  24 -16.404  -6.808  -6.663
  177   3HD1  ILE  24          3HD1      ILE  24 -17.681  -7.976  -7.001
  178    H    LYS  25           H        LYS  25 -13.921  -7.988 -11.611
  179    HA   LYS  25           HA       LYS  25 -14.883  -9.825 -13.760
  180   1HB   LYS  25          2HB       LYS  25 -13.193  -7.609 -14.000
  181   2HB   LYS  25          1HB       LYS  25 -12.123  -8.970 -14.027
  182   1HG   LYS  25          1HG       LYS  25 -13.782  -9.995 -15.739
  183   2HG   LYS  25          2HG       LYS  25 -14.413  -8.354 -15.878
  184   1HD   LYS  25          1HD       LYS  25 -11.855  -7.737 -16.171
  185   2HD   LYS  25          2HD       LYS  25 -11.726  -9.424 -16.668
  186   1HE   LYS  25          1HE       LYS  25 -13.893  -8.735 -18.104
  187   2HE   LYS  25          2HE       LYS  25 -13.123  -7.153 -18.001
  188   1HZ   LYS  25          2HZ       LYS  25 -11.044  -8.744 -18.586
  189   2HZ   LYS  25          3HZ       LYS  25 -12.294  -9.520 -19.435
  190   3HZ   LYS  25          1HZ       LYS  25 -11.947  -7.885 -19.740
  191    H    GLU  26           H        GLU  26 -12.658  -9.283 -11.071
  192    HA   GLU  26           HA       GLU  26 -12.438 -12.112 -10.536
  193   1HB   GLU  26          2HB       GLU  26  -9.740 -11.686 -10.749
  194   2HB   GLU  26          1HB       GLU  26 -10.694 -12.495 -11.936
  195   1HG   GLU  26          1HG       GLU  26 -10.723  -9.584 -12.269
  196   2HG   GLU  26          2HG       GLU  26  -9.115 -10.280 -12.377
  197    H    TYR  27           H        TYR  27  -9.952 -11.888  -9.020
  198    HA   TYR  27           HA       TYR  27 -10.248  -9.536  -7.355
  199   1HB   TYR  27          1HB       TYR  27 -10.615 -10.865  -5.268
  200   2HB   TYR  27          2HB       TYR  27 -11.971 -11.018  -6.388
  201    HD1  TYR  27           HD2      TYR  27  -8.961 -12.705  -5.015
  202    HD2  TYR  27           HD1      TYR  27 -12.434 -13.106  -7.550
  203    HE1  TYR  27           HE2      TYR  27  -8.578 -15.164  -5.152
  204    HE2  TYR  27           HE1      TYR  27 -12.046 -15.564  -7.692
  205    HH   TYR  27           HH       TYR  27  -9.664 -17.174  -5.689
  206    H    PHE  28           H        PHE  28  -8.601  -9.965  -5.330
  207    HA   PHE  28           HA       PHE  28  -6.421 -11.726  -6.117
  208   1HB   PHE  28          2HB       PHE  28  -5.873  -9.916  -7.590
  209   2HB   PHE  28          1HB       PHE  28  -6.171  -8.724  -6.352
  210    HD1  PHE  28           HD1      PHE  28  -4.010 -11.741  -6.987
  211    HD2  PHE  28           HD2      PHE  28  -4.359  -7.849  -5.153
  212    HE1  PHE  28           HE1      PHE  28  -1.637 -11.880  -6.236
  213    HE2  PHE  28           HE2      PHE  28  -1.992  -7.989  -4.398
  214    HZ   PHE  28           HZ       PHE  28  -0.625 -10.002  -4.947
  215    H    TYR  29           H        TYR  29  -6.981 -12.483  -3.905
  216    HA   TYR  29           HA       TYR  29  -6.895 -10.875  -1.580
  217   1HB   TYR  29          1HB       TYR  29  -7.641 -13.191  -1.493
  218   2HB   TYR  29          2HB       TYR  29  -6.035 -13.755  -1.947
  219    HD1  TYR  29           HD1      TYR  29  -7.904 -11.874   0.700
  220    HD2  TYR  29           HD2      TYR  29  -4.351 -14.107  -0.315
  221    HE1  TYR  29           HE1      TYR  29  -7.218 -11.872   3.095
  222    HE2  TYR  29           HE2      TYR  29  -3.665 -14.107   2.080
  223    HH   TYR  29           HH       TYR  29  -4.138 -12.604   4.134
  224    H    THR  30           H        THR  30  -5.271  -9.922  -0.510
  225    HA   THR  30           HA       THR  30  -2.579  -9.960  -1.668
  226    HB   THR  30           HB       THR  30  -3.386  -8.622   0.919
  227    HG1  THR  30           HG1      THR  30  -3.824  -6.811  -0.520
  228   1HG2  THR  30          3HG2      THR  30  -0.960  -8.823  -0.248
  229   2HG2  THR  30          1HG2      THR  30  -1.571  -7.405  -1.100
  230   3HG2  THR  30          2HG2      THR  30  -1.461  -7.397   0.661
  231    H    SER  31           H        SER  31  -0.947 -11.272  -0.992
  232    HA   SER  31           HA       SER  31  -1.321 -13.353   0.896
  233   1HB   SER  31          1HB       SER  31   1.136 -12.072  -0.295
  234   2HB   SER  31          2HB       SER  31   1.277 -13.355   0.906
  235    HG   SER  31           HG       SER  31  -0.280 -13.551  -1.450
  236    H    GLY  32           H        GLY  32   1.044 -10.718   1.392
  237   1HA   GLY  32          1HA       GLY  32   0.107  -9.510   3.672
  238   2HA   GLY  32          2HA       GLY  32   0.779 -11.001   4.285
  239    H    LYS  33           H        LYS  33   1.717  -8.413   1.994
  240    HA   LYS  33           HA       LYS  33   4.515  -8.700   2.986
  241   1HB   LYS  33          2HB       LYS  33   3.394  -7.383   0.500
  242   2HB   LYS  33          1HB       LYS  33   5.080  -7.333   0.952
  243   1HG   LYS  33          1HG       LYS  33   4.309 -10.040   1.135
  244   2HG   LYS  33          2HG       LYS  33   3.633  -9.448  -0.364
  245   1HD   LYS  33          1HD       LYS  33   5.994  -8.390  -0.721
  246   2HD   LYS  33          2HD       LYS  33   6.509  -9.546   0.483
  247   1HE   LYS  33          1HE       LYS  33   5.551 -11.382  -0.875
  248   2HE   LYS  33          2HE       LYS  33   5.064 -10.207  -2.096
  249   1HZ   LYS  33          1HZ       LYS  33   7.662  -9.622  -1.761
  250   2HZ   LYS  33          2HZ       LYS  33   7.675 -11.303  -1.527
  251   3HZ   LYS  33          3HZ       LYS  33   7.059 -10.651  -2.970
  252    H    CYS  34           H        CYS  34   2.214  -6.119   2.045
  253    HA   CYS  34           HA       CYS  34   3.726  -4.149   3.614
  254   1HB   CYS  34          1HB       CYS  34   0.971  -3.677   2.489
  255   2HB   CYS  34          2HB       CYS  34   2.280  -2.522   2.718
  256    H    SER  35           H        SER  35   1.511  -2.670   4.648
  257    HA   SER  35           HA       SER  35   0.643  -4.518   6.833
  258   1HB   SER  35          1HB       SER  35   2.079  -2.222   7.106
  259   2HB   SER  35          2HB       SER  35   0.438  -1.591   7.247
  260    HG   SER  35           HG       SER  35   0.116  -3.366   8.789
  261    H    ASN  36           H        ASN  36  -0.669  -4.033   4.192
  262    HA   ASN  36           HA       ASN  36  -3.305  -3.085   5.249
  263   1HB   ASN  36          2HB       ASN  36  -1.959  -2.443   2.621
  264   2HB   ASN  36          1HB       ASN  36  -3.704  -2.298   2.833
  265   1HD2  ASN  36          2HD2      ASN  36  -3.488   0.610   4.864
  266   2HD2  ASN  36          1HD2      ASN  36  -4.498  -0.526   4.107
  267    HA   PRO  37           HA       PRO  37  -3.231  -7.417   3.287
  268   1HB   PRO  37          1HB       PRO  37  -4.682  -8.279   5.647
  269   2HB   PRO  37          2HB       PRO  37  -3.108  -8.837   5.069
  270   1HG   PRO  37          1HG       PRO  37  -3.643  -7.128   7.323
  271   2HG   PRO  37          2HG       PRO  37  -2.083  -7.666   6.739
  272   1HD   PRO  37          1HD       PRO  37  -3.195  -5.026   6.560
  273   2HD   PRO  37          2HD       PRO  37  -1.642  -5.591   5.915
  274    H    ALA  38           H        ALA  38  -5.003  -7.778   1.970
  275    HA   ALA  38           HA       ALA  38  -7.726  -7.365   2.907
  276   1HB   ALA  38          2HB       ALA  38  -6.867  -5.021   2.484
  277   2HB   ALA  38          3HB       ALA  38  -6.690  -5.467   0.786
  278   3HB   ALA  38          1HB       ALA  38  -8.288  -5.463   1.536
  279    H    VAL  39           H        VAL  39  -8.570  -6.735   0.072
  280    HA   VAL  39           HA       VAL  39  -7.645  -9.109  -1.383
  281    HB   VAL  39           HB       VAL  39  -9.859  -9.405   0.155
  282   1HG1  VAL  39          2HG1      VAL  39 -10.909  -7.560  -1.428
  283   2HG1  VAL  39          3HG1      VAL  39 -11.150  -8.942  -2.497
  284   3HG1  VAL  39          1HG1      VAL  39 -11.868  -8.936  -0.886
  285   1HG2  VAL  39          3HG2      VAL  39  -8.794 -10.645  -2.273
  286   2HG2  VAL  39          1HG2      VAL  39  -9.295 -11.385  -0.753
  287   3HG2  VAL  39          2HG2      VAL  39 -10.498 -10.990  -1.981
  288    H    VAL  40           H        VAL  40  -7.734  -8.641  -3.595
  289    HA   VAL  40           HA       VAL  40  -8.671  -5.866  -4.115
  290    HB   VAL  40           HB       VAL  40  -6.226  -7.353  -4.929
  291   1HG1  VAL  40          2HG1      VAL  40  -7.231  -6.668  -7.084
  292   2HG1  VAL  40          3HG1      VAL  40  -7.375  -5.023  -6.472
  293   3HG1  VAL  40          1HG1      VAL  40  -5.782  -5.736  -6.714
  294   1HG2  VAL  40          2HG2      VAL  40  -6.997  -4.596  -3.958
  295   2HG2  VAL  40          3HG2      VAL  40  -6.030  -5.810  -3.117
  296   3HG2  VAL  40          1HG2      VAL  40  -5.364  -4.969  -4.516
  297    H    PHE  41           H        PHE  41 -10.392  -5.722  -5.324
  298    HA   PHE  41           HA       PHE  41 -11.136  -7.887  -7.134
  299   1HB   PHE  41          1HB       PHE  41 -12.399  -5.282  -6.295
  300   2HB   PHE  41          2HB       PHE  41 -13.011  -6.159  -7.695
  301    HD1  PHE  41           HD1      PHE  41 -13.502  -8.730  -7.329
  302    HD2  PHE  41           HD2      PHE  41 -13.198  -5.815  -4.158
  303    HE1  PHE  41           HE1      PHE  41 -14.881 -10.192  -5.853
  304    HE2  PHE  41           HE2      PHE  41 -14.571  -7.279  -2.681
  305    HZ   PHE  41           HZ       PHE  41 -15.426  -9.460  -3.532
  306    H    VAL  42           H        VAL  42 -11.083  -7.818  -9.272
  307    HA   VAL  42           HA       VAL  42  -9.708  -5.484 -10.551
  308    HB   VAL  42           HB       VAL  42  -9.385  -7.671 -12.242
  309   1HG1  VAL  42          1HG2      VAL  42  -7.804  -5.804 -11.608
  310   2HG1  VAL  42          2HG2      VAL  42  -7.437  -6.716 -10.143
  311   3HG1  VAL  42          3HG2      VAL  42  -7.044  -7.390 -11.727
  312   1HG2  VAL  42          2HG1      VAL  42 -10.033  -9.209 -10.436
  313   2HG2  VAL  42          3HG1      VAL  42  -8.333  -9.404 -10.845
  314   3HG2  VAL  42          1HG1      VAL  42  -8.798  -8.514  -9.395
  315    H    THR  43           H        THR  43 -11.852  -4.592 -10.906
  316    HA   THR  43           HA       THR  43 -13.972  -6.133 -12.145
  317    HB   THR  43           HB       THR  43 -15.285  -4.150 -11.973
  318    HG1  THR  43           HG1      THR  43 -12.903  -2.702 -11.503
  319   1HG2  THR  43          3HG2      THR  43 -14.689  -5.158  -9.807
  320   2HG2  THR  43          1HG2      THR  43 -13.255  -4.139  -9.722
  321   3HG2  THR  43          2HG2      THR  43 -14.856  -3.411  -9.664
  322    H    ARG  44           H        ARG  44 -15.136  -4.305 -13.873
  323    HA   ARG  44           HA       ARG  44 -14.212  -5.124 -16.348
  324   1HB   ARG  44          2HB       ARG  44 -15.259  -2.822 -17.154
  325   2HB   ARG  44          1HB       ARG  44 -16.281  -4.089 -16.528
  326   1HG   ARG  44          1HG       ARG  44 -16.928  -2.820 -14.779
  327   2HG   ARG  44          2HG       ARG  44 -15.262  -2.412 -14.377
  328   1HD   ARG  44          1HD       ARG  44 -15.237  -0.597 -15.949
  329   2HD   ARG  44          2HD       ARG  44 -16.764  -1.114 -16.664
  330    HE   ARG  44           HE       ARG  44 -17.070  -0.536 -13.845
  331   1HH1  ARG  44          1HH2      ARG  44 -15.790   2.052 -15.494
  332   2HH1  ARG  44          2HH2      ARG  44 -17.027   2.104 -16.705
  333   1HH2  ARG  44          1HH1      ARG  44 -18.871   1.305 -13.787
  334   2HH2  ARG  44          2HH1      ARG  44 -19.294   1.559 -15.447
  335    H    LYS  45           H        LYS  45 -13.595  -1.803 -15.080
  336    HA   LYS  45           HA       LYS  45 -11.507  -1.198 -16.938
  337   1HB   LYS  45          2HB       LYS  45 -12.685   0.184 -14.882
  338   2HB   LYS  45          1HB       LYS  45 -11.108  -0.188 -14.183
  339   1HG   LYS  45          1HG       LYS  45 -10.536   0.591 -16.808
  340   2HG   LYS  45          2HG       LYS  45 -11.791   1.714 -16.283
  341   1HD   LYS  45          1HD       LYS  45 -10.411   2.003 -14.137
  342   2HD   LYS  45          2HD       LYS  45  -9.109   1.180 -14.994
  343   1HE   LYS  45          1HE       LYS  45 -10.461   3.780 -15.758
  344   2HE   LYS  45          2HE       LYS  45  -8.769   3.537 -15.323
  345   1HZ   LYS  45          3HZ       LYS  45  -8.550   2.100 -17.289
  346   2HZ   LYS  45          1HZ       LYS  45 -10.147   2.475 -17.728
  347   3HZ   LYS  45          2HZ       LYS  45  -8.967   3.695 -17.693
  348    H    ASN  46           H        ASN  46 -11.708  -3.093 -14.059
  349    HA   ASN  46           HA       ASN  46 -10.368  -4.725 -13.171
  350   1HB   ASN  46          2HB       ASN  46  -9.443  -4.416 -15.911
  351   2HB   ASN  46          1HB       ASN  46  -8.103  -4.794 -14.863
  352   1HD2  ASN  46          1HD2      ASN  46  -9.212  -8.076 -15.735
  353   2HD2  ASN  46          2HD2      ASN  46  -9.106  -6.750 -16.791
  354    H    ARG  47           H        ARG  47  -9.897  -1.739 -12.789
  355    HA   ARG  47           HA       ARG  47  -7.100  -1.436 -12.150
  356   1HB   ARG  47          1HB       ARG  47  -9.580  -0.238 -10.872
  357   2HB   ARG  47          2HB       ARG  47  -7.953   0.221 -10.431
  358   1HG   ARG  47          1HG       ARG  47  -8.668   0.279 -13.328
  359   2HG   ARG  47          2HG       ARG  47  -9.308   1.559 -12.297
  360   1HD   ARG  47          1HD       ARG  47  -7.273   2.500 -12.884
  361   2HD   ARG  47          2HD       ARG  47  -6.795   1.631 -11.425
  362    HE   ARG  47           HE       ARG  47  -6.495  -0.132 -13.637
  363   1HH1  ARG  47          1HH1      ARG  47  -4.976   1.866 -15.254
  364   2HH1  ARG  47          2HH1      ARG  47  -4.226   2.861 -14.050
  365   1HH2  ARG  47          2HH2      ARG  47  -4.251   0.110 -11.828
  366   2HH2  ARG  47          1HH2      ARG  47  -3.068   0.816 -12.879
  367    H    GLN  48           H        GLN  48  -6.314  -1.704  -9.739
  368    HA   GLN  48           HA       GLN  48  -7.474  -4.253  -8.906
  369   1HB   GLN  48          2HB       GLN  48  -4.886  -2.915  -8.481
  370   2HB   GLN  48          1HB       GLN  48  -5.467  -3.902  -7.133
  371   1HG   GLN  48          1HG       GLN  48  -5.852  -5.777  -8.661
  372   2HG   GLN  48          2HG       GLN  48  -5.376  -4.810 -10.024
  373   1HE2  GLN  48          1HE2      GLN  48  -1.862  -4.744  -8.857
  374   2HE2  GLN  48          2HE2      GLN  48  -3.029  -3.646  -9.418
  375    H    VAL  49           H        VAL  49  -9.385  -3.064  -8.449
  376    HA   VAL  49           HA       VAL  49  -9.850  -1.215  -6.433
  377    HB   VAL  49           HB       VAL  49 -11.800  -3.437  -6.576
  378   1HG1  VAL  49          2HG1      VAL  49 -11.775  -0.436  -6.709
  379   2HG1  VAL  49          3HG1      VAL  49 -13.237  -1.350  -7.084
  380   3HG1  VAL  49          1HG1      VAL  49 -12.504  -1.477  -5.485
  381   1HG2  VAL  49          1HG2      VAL  49 -10.864  -1.958  -9.039
  382   2HG2  VAL  49          2HG2      VAL  49 -11.387  -3.633  -8.907
  383   3HG2  VAL  49          3HG2      VAL  49 -12.575  -2.333  -8.869
  384    H    CYS  50           H        CYS  50 -10.799  -1.675  -4.232
  385    HA   CYS  50           HA       CYS  50  -9.522  -4.055  -2.953
  386   1HB   CYS  50          2HB       CYS  50  -8.550  -1.624  -2.562
  387   2HB   CYS  50          1HB       CYS  50  -9.924  -1.484  -1.464
  388    H    ALA  51           H        ALA  51 -10.633  -4.281  -0.592
  389    HA   ALA  51           HA       ALA  51 -13.187  -3.244  -0.078
  390   1HB   ALA  51          1HB       ALA  51 -13.185  -5.180  -2.219
  391   2HB   ALA  51          2HB       ALA  51 -14.117  -5.791  -0.854
  392   3HB   ALA  51          3HB       ALA  51 -14.532  -4.240  -1.580
  393    H    ASN  52           H        ASN  52 -10.905  -4.153   1.394
  394    HA   ASN  52           HA       ASN  52 -10.529  -5.212   3.447
  395   1HB   ASN  52          1HB       ASN  52 -12.833  -4.307   3.881
  396   2HB   ASN  52          2HB       ASN  52 -13.493  -5.832   3.293
  397   1HD2  ASN  52          1HD2      ASN  52 -12.472  -5.537   7.100
  398   2HD2  ASN  52          2HD2      ASN  52 -11.948  -4.292   6.071
  399    HA   PRO  53           HA       PRO  53 -10.066  -9.443   2.201
  400   1HB   PRO  53          1HB       PRO  53  -8.843 -10.338   4.519
  401   2HB   PRO  53          2HB       PRO  53  -8.006  -9.474   3.244
  402   1HG   PRO  53          2HG       PRO  53  -8.779  -8.525   5.932
  403   2HG   PRO  53          1HG       PRO  53  -7.581  -7.867   4.835
  404   1HD   PRO  53          2HD       PRO  53 -10.209  -6.854   5.330
  405   2HD   PRO  53          1HD       PRO  53  -9.047  -6.262   4.127
  406    H    GLU  54           H        GLU  54 -10.951  -9.020   5.657
  407    HA   GLU  54           HA       GLU  54 -12.652 -11.453   5.462
  408   1HB   GLU  54          1HB       GLU  54 -10.806 -10.980   7.283
  409   2HB   GLU  54          2HB       GLU  54 -12.086 -10.032   8.040
  410   1HG   GLU  54          1HG       GLU  54 -13.558 -11.960   8.096
  411   2HG   GLU  54          2HG       GLU  54 -12.406 -12.917   7.165
  412    H    LYS  55           H        LYS  55 -13.814  -9.223   4.262
  413    HA   LYS  55           HA       LYS  55 -15.716  -8.121   6.253
  414   1HB   LYS  55          1HB       LYS  55 -14.694  -7.251   3.682
  415   2HB   LYS  55          2HB       LYS  55 -16.438  -7.192   3.719
  416   1HG   LYS  55          1HG       LYS  55 -14.907  -6.138   6.069
  417   2HG   LYS  55          2HG       LYS  55 -15.017  -5.150   4.613
  418   1HD   LYS  55          1HD       LYS  55 -17.446  -5.211   4.693
  419   2HD   LYS  55          2HD       LYS  55 -17.409  -6.347   6.042
  420   1HE   LYS  55          1HE       LYS  55 -16.254  -4.645   7.426
  421   2HE   LYS  55          2HE       LYS  55 -16.341  -3.507   6.082
  422   1HZ   LYS  55          3HZ       LYS  55 -18.741  -4.810   7.227
  423   2HZ   LYS  55          1HZ       LYS  55 -18.143  -3.328   7.804
  424   3HZ   LYS  55          2HZ       LYS  55 -18.673  -3.463   6.195
  425    H    LYS  56           H        LYS  56 -15.697 -10.975   5.391
  426    HA   LYS  56           HA       LYS  56 -17.259 -12.632   4.901
  427   1HB   LYS  56          1HB       LYS  56 -19.072 -10.277   5.434
  428   2HB   LYS  56          2HB       LYS  56 -19.704 -11.873   5.036
  429   1HG   LYS  56          1HG       LYS  56 -19.599 -11.689   7.450
  430   2HG   LYS  56          2HG       LYS  56 -18.335 -12.806   6.934
  431   1HD   LYS  56          1HD       LYS  56 -16.625 -11.229   7.293
  432   2HD   LYS  56          2HD       LYS  56 -17.746  -9.868   7.249
  433   1HE   LYS  56          1HE       LYS  56 -17.142 -10.208   9.556
  434   2HE   LYS  56          2HE       LYS  56 -18.793 -10.798   9.364
  435   1HZ   LYS  56          2HZ       LYS  56 -17.406 -12.992   8.788
  436   2HZ   LYS  56          3HZ       LYS  56 -16.351 -12.266   9.903
  437   3HZ   LYS  56          1HZ       LYS  56 -17.951 -12.614  10.352
  438    H    TRP  57           H        TRP  57 -19.271 -10.148   3.408
  439    HA   TRP  57           HA       TRP  57 -19.847 -11.464   1.063
  440   1HB   TRP  57          1HB       TRP  57 -20.439  -9.349   0.102
  441   2HB   TRP  57          2HB       TRP  57 -20.808  -9.278   1.827
  442    HD1  TRP  57           HD1      TRP  57 -19.685  -7.334   3.122
  443    HE1  TRP  57           HE1      TRP  57 -18.029  -5.473   2.442
  444    HE3  TRP  57           HE3      TRP  57 -18.337  -9.089  -1.421
  445    HZ2  TRP  57           HZ2      TRP  57 -16.385  -4.786   0.154
  446    HZ3  TRP  57           HZ3      TRP  57 -16.823  -7.826  -2.886
  447    HH2  TRP  57           HH2      TRP  57 -15.850  -5.670  -2.115
  448    H    VAL  58           H        VAL  58 -16.859  -9.635   1.636
  449    HA   VAL  58           HA       VAL  58 -15.920  -9.625  -1.047
  450    HB   VAL  58           HB       VAL  58 -13.576  -9.917   0.180
  451   1HG1  VAL  58          2HG1      VAL  58 -14.896  -7.887  -0.870
  452   2HG1  VAL  58          3HG1      VAL  58 -15.011  -7.394   0.818
  453   3HG1  VAL  58          1HG1      VAL  58 -13.431  -7.639   0.072
  454   1HG2  VAL  58          2HG2      VAL  58 -15.169 -10.389   2.306
  455   2HG2  VAL  58          3HG2      VAL  58 -13.541  -9.722   2.420
  456   3HG2  VAL  58          1HG2      VAL  58 -14.940  -8.650   2.446
  457    H    ARG  59           H        ARG  59 -15.333 -12.091   1.485
  458    HA   ARG  59           HA       ARG  59 -13.903 -13.844  -0.290
  459   1HB   ARG  59          1HB       ARG  59 -15.190 -14.131   2.398
  460   2HB   ARG  59          2HB       ARG  59 -14.721 -15.577   1.535
  461   1HG   ARG  59          2HG       ARG  59 -12.427 -14.558   1.239
  462   2HG   ARG  59          1HG       ARG  59 -12.936 -13.264   2.325
  463   1HD   ARG  59          1HD       ARG  59 -13.008 -14.663   4.175
  464   2HD   ARG  59          2HD       ARG  59 -13.314 -16.103   3.205
  465    HE   ARG  59           HE       ARG  59 -10.783 -15.460   2.433
  466   1HH1  ARG  59          1HH1      ARG  59 -12.223 -16.888   5.099
  467   2HH1  ARG  59          2HH1      ARG  59 -10.732 -17.037   5.967
  468   1HH2  ARG  59          1HH2      ARG  59  -9.101 -14.649   4.040
  469   2HH2  ARG  59          2HH2      ARG  59  -9.065 -15.550   5.519
  470    H    GLU  60           H        GLU  60 -17.296 -13.371   0.460
  471    HA   GLU  60           HA       GLU  60 -18.264 -15.790  -0.780
  472   1HB   GLU  60          1HB       GLU  60 -19.479 -13.166   0.014
  473   2HB   GLU  60          2HB       GLU  60 -20.388 -14.237  -1.025
  474   1HG   GLU  60          1HG       GLU  60 -19.995 -16.079   0.651
  475   2HG   GLU  60          2HG       GLU  60 -19.289 -14.869   1.722
  476    H    TYR  61           H        TYR  61 -16.996 -12.838  -2.010
  477    HA   TYR  61           HA       TYR  61 -18.243 -13.204  -4.671
  478   1HB   TYR  61          1HB       TYR  61 -16.546 -11.062  -3.384
  479   2HB   TYR  61          2HB       TYR  61 -16.739 -11.121  -5.134
  480    HD1  TYR  61           HD1      TYR  61 -19.215 -11.917  -2.408
  481    HD2  TYR  61           HD2      TYR  61 -18.144  -9.315  -5.682
  482    HE1  TYR  61           HE1      TYR  61 -21.388 -10.727  -2.171
  483    HE2  TYR  61           HE2      TYR  61 -20.321  -8.128  -5.447
  484    HH   TYR  61           HH       TYR  61 -22.026  -7.742  -3.666
  485    H    ILE  62           H        ILE  62 -15.199 -13.496  -2.953
  486    HA   ILE  62           HA       ILE  62 -13.420 -13.830  -5.128
  487    HB   ILE  62           HB       ILE  62 -13.447 -15.078  -2.362
  488   1HG1  ILE  62          1HG1      ILE  62 -11.838 -12.788  -3.516
  489   2HG1  ILE  62          2HG1      ILE  62 -13.269 -12.589  -2.536
  490   1HG2  ILE  62          2HG2      ILE  62 -11.847 -15.799  -4.598
  491   2HG2  ILE  62          3HG2      ILE  62 -10.821 -14.878  -3.501
  492   3HG2  ILE  62          1HG2      ILE  62 -11.661 -16.316  -2.924
  493   1HD1  ILE  62          2HD1      ILE  62 -11.938 -14.213  -0.894
  494   2HD1  ILE  62          3HD1      ILE  62 -10.551 -13.530  -1.742
  495   3HD1  ILE  62          1HD1      ILE  62 -11.664 -12.471  -0.877
  496    H    ASN  63           H        ASN  63 -15.170 -16.372  -3.294
  497    HA   ASN  63           HA       ASN  63 -14.428 -18.415  -5.235
  498   1HB   ASN  63          2HB       ASN  63 -16.205 -18.319  -2.809
  499   2HB   ASN  63          1HB       ASN  63 -16.275 -19.704  -3.899
  500   1HD2  ASN  63          2HD2      ASN  63 -12.696 -18.599  -2.323
  501   2HD2  ASN  63          1HD2      ASN  63 -14.062 -18.208  -1.395
  502    H    SER  64           H        SER  64 -17.201 -16.311  -4.702
  503    HA   SER  64           HA       SER  64 -18.960 -17.722  -6.523
  504   1HB   SER  64          1HB       SER  64 -19.822 -16.204  -4.777
  505   2HB   SER  64          2HB       SER  64 -19.050 -14.850  -5.566
  506    HG   SER  64           HG       SER  64 -21.424 -15.708  -6.035
  507    H    LEU  65           H        LEU  65 -16.224 -15.758  -7.040
  508    HA   LEU  65           HA       LEU  65 -17.163 -14.667  -9.605
  509   1HB   LEU  65          1HB       LEU  65 -14.704 -14.425  -7.938
  510   2HB   LEU  65          2HB       LEU  65 -14.538 -14.151  -9.656
  511    HG   LEU  65           HG       LEU  65 -16.568 -12.772  -7.880
  512   1HD1  LEU  65          3HD1      LEU  65 -13.789 -12.092  -8.739
  513   2HD1  LEU  65          1HD1      LEU  65 -14.973 -10.786  -8.698
  514   3HD1  LEU  65          2HD1      LEU  65 -14.624 -11.706  -7.234
  515   1HD2  LEU  65          3HD2      LEU  65 -16.238 -13.029 -10.758
  516   2HD2  LEU  65          1HD2      LEU  65 -17.565 -12.303  -9.850
  517   3HD2  LEU  65          2HD2      LEU  65 -16.143 -11.341 -10.254
  518    H    GLU  66           H        GLU  66 -16.914 -15.700 -11.532
  519    HA   GLU  66           HA       GLU  66 -15.054 -18.045 -11.608
  520   1HB   GLU  66          1HB       GLU  66 -17.719 -17.669 -13.008
  521   2HB   GLU  66          2HB       GLU  66 -16.625 -19.023 -13.291
  522   1HG   GLU  66          1HG       GLU  66 -17.191 -18.544 -10.445
  523   2HG   GLU  66          2HG       GLU  66 -18.620 -18.975 -11.385
  524    H    MET  67           H        MET  67 -14.394 -18.546 -13.958
  525    HA   MET  67           HA       MET  67 -13.111 -16.252 -15.081
  526   1HB   MET  67          1HB       MET  67 -12.309 -18.581 -15.406
  527   2HB   MET  67          2HB       MET  67 -13.721 -18.909 -16.412
  528   1HG   MET  67          1HG       MET  67 -13.020 -17.288 -18.053
  529   2HG   MET  67          2HG       MET  67 -11.738 -16.695 -16.997
  530   1HE   MET  67          1HE       MET  67  -9.854 -17.163 -16.829
  531   2HE   MET  67          3HE       MET  67  -9.064 -18.741 -16.829
  532   3HE   MET  67          2HE       MET  67  -9.044 -17.743 -18.285
  533    H    SER  68           H        SER  68 -15.973 -18.097 -16.179
  534    HA   SER  68           HA       SER  68 -16.762 -15.669 -17.738
  535   1HB   SER  68          1HB       SER  68 -15.968 -17.765 -19.065
  536   2HB   SER  68          2HB       SER  68 -17.515 -18.462 -18.582
  537    HG   SER  68           HG       SER  68 -17.848 -17.432 -20.502
  538    H    SER   1           H        SER   1 -13.940  14.733  -3.850
  539    HA   SER   1           HA       SER   1 -12.559  14.188  -6.317
  540   1HB   SER   1          1HB       SER   1 -12.112  13.745  -3.438
  541   2HB   SER   1          2HB       SER   1 -11.387  12.518  -4.475
  542    HG   SER   1           HG       SER   1 -10.831  15.227  -4.246
  543    HA   PRO   2           HA       PRO   2 -14.037  10.264  -7.574
  544   1HB   PRO   2          1HB       PRO   2 -11.553   8.796  -7.419
  545   2HB   PRO   2          2HB       PRO   2 -12.328   9.471  -8.858
  546   1HG   PRO   2          1HG       PRO   2  -9.960  10.427  -7.518
  547   2HG   PRO   2          2HG       PRO   2 -10.742  11.109  -8.950
  548   1HD   PRO   2          1HD       PRO   2 -10.710  12.178  -6.270
  549   2HD   PRO   2          2HD       PRO   2 -11.493  12.863  -7.707
  550    H    TYR   3           H        TYR   3 -11.657   9.973  -4.925
  551    HA   TYR   3           HA       TYR   3 -11.685   8.640  -2.993
  552   1HB   TYR   3          1HB       TYR   3 -13.732   9.972  -2.565
  553   2HB   TYR   3          2HB       TYR   3 -14.681   8.782  -3.455
  554    HD1  TYR   3           HD1      TYR   3 -11.832   8.278  -1.061
  555    HD2  TYR   3           HD2      TYR   3 -16.043   7.717  -1.838
  556    HE1  TYR   3           HE1      TYR   3 -12.029   6.893   1.002
  557    HE2  TYR   3           HE2      TYR   3 -16.239   6.331   0.224
  558    HH   TYR   3           HH       TYR   3 -15.123   5.906   2.274
  559    H    SER   4           H        SER   4 -11.051   7.163  -5.169
  560    HA   SER   4           HA       SER   4 -12.850   4.798  -5.198
  561   1HB   SER   4          1HB       SER   4 -10.953   6.005  -7.067
  562   2HB   SER   4          2HB       SER   4 -10.704   4.269  -6.889
  563    HG   SER   4           HG       SER   4 -13.253   5.416  -7.290
  564    H    SER   5           H        SER   5 -12.013   2.691  -4.709
  565    HA   SER   5           HA       SER   5  -9.527   2.751  -3.045
  566   1HB   SER   5          1HB       SER   5 -12.169   1.390  -2.683
  567   2HB   SER   5          2HB       SER   5 -10.723   0.577  -2.086
  568    HG   SER   5           HG       SER   5 -12.001   2.810  -1.153
  569    H    ASP   6           H        ASP   6  -7.887   1.598  -3.929
  570    HA   ASP   6           HA       ASP   6  -8.403  -0.974  -5.253
  571   1HB   ASP   6          2HB       ASP   6  -6.975   1.189  -6.816
  572   2HB   ASP   6          1HB       ASP   6  -7.466  -0.385  -7.387
  573    H    THR   7           H        THR   7  -5.774  -0.946  -6.560
  574    HA   THR   7           HA       THR   7  -4.247  -1.751  -4.272
  575    HB   THR   7           HB       THR   7  -4.031  -2.709  -6.600
  576    HG1  THR   7           HG1      THR   7  -2.269  -3.376  -5.736
  577   1HG2  THR   7          3HG2      THR   7  -3.941  -0.284  -7.576
  578   2HG2  THR   7          1HG2      THR   7  -2.219  -0.389  -7.210
  579   3HG2  THR   7          2HG2      THR   7  -2.957  -1.543  -8.322
  580    H    THR   8           H        THR   8  -1.744  -0.779  -4.451
  581    HA   THR   8           HA       THR   8  -1.739   2.134  -4.743
  582    HB   THR   8           HB       THR   8  -1.030   1.122  -2.009
  583    HG1  THR   8           HG1      THR   8  -3.325   1.868  -1.589
  584   1HG2  THR   8          3HG2      THR   8  -1.325   3.649  -3.401
  585   2HG2  THR   8          1HG2      THR   8  -2.362   3.603  -1.976
  586   3HG2  THR   8          2HG2      THR   8  -0.628   3.333  -1.813
  587    HA   PRO   9           HA       PRO   9   2.268   0.528  -5.977
  588   1HB   PRO   9          1HB       PRO   9   3.130   3.307  -6.149
  589   2HB   PRO   9          2HB       PRO   9   2.882   2.145  -7.458
  590   1HG   PRO   9          2HG       PRO   9   1.189   4.354  -6.762
  591   2HG   PRO   9          1HG       PRO   9   0.900   3.152  -7.998
  592   1HD   PRO   9          2HD       PRO   9  -0.467   3.452  -5.517
  593   2HD   PRO   9          1HD       PRO   9  -0.727   2.222  -6.744
  594    H    CYS  10           H        CYS  10   2.735  -0.248  -3.828
  595    HA   CYS  10           HA       CYS  10   4.387   1.651  -2.215
  596   1HB   CYS  10          2HB       CYS  10   2.290  -0.314  -1.322
  597   2HB   CYS  10          1HB       CYS  10   3.592   0.158  -0.239
  598    H    CYS  11           H        CYS  11   6.339   0.878  -1.652
  599    HA   CYS  11           HA       CYS  11   7.035  -1.799  -2.634
  600   1HB   CYS  11          2HB       CYS  11   8.935  -0.728  -3.150
  601   2HB   CYS  11          1HB       CYS  11   8.467   0.679  -2.245
  602    H    PHE  12           H        PHE  12   8.247  -3.291  -1.127
  603    HA   PHE  12           HA       PHE  12   7.289  -2.961   1.689
  604   1HB   PHE  12          1HB       PHE  12   6.007  -4.729   0.650
  605   2HB   PHE  12          2HB       PHE  12   7.464  -5.465  -0.011
  606    HD1  PHE  12           HD1      PHE  12   7.186  -4.041   3.426
  607    HD2  PHE  12           HD2      PHE  12   7.256  -7.625   1.020
  608    HE1  PHE  12           HE1      PHE  12   7.445  -5.417   5.489
  609    HE2  PHE  12           HE2      PHE  12   7.527  -9.003   3.084
  610    HZ   PHE  12           HZ       PHE  12   7.620  -7.898   5.317
  611    H    ALA  13           H        ALA  13   9.634  -4.913  -0.201
  612    HA   ALA  13           HA       ALA  13  11.534  -4.670   2.066
  613   1HB   ALA  13          2HB       ALA  13  11.111  -6.581  -0.138
  614   2HB   ALA  13          3HB       ALA  13  12.805  -6.191   0.160
  615   3HB   ALA  13          1HB       ALA  13  11.809  -6.848   1.459
  616    H    TYR  14           H        TYR  14  13.125  -3.212   2.016
  617    HA   TYR  14           HA       TYR  14  13.478  -1.605  -0.394
  618   1HB   TYR  14          1HB       TYR  14  15.224  -1.381   2.051
  619   2HB   TYR  14          2HB       TYR  14  14.728  -0.112   0.934
  620    HD1  TYR  14           HD2      TYR  14  12.182   0.478   0.845
  621    HD2  TYR  14           HD1      TYR  14  14.019  -1.749   4.055
  622    HE1  TYR  14           HE2      TYR  14  10.252   1.017   2.323
  623    HE2  TYR  14           HE1      TYR  14  12.094  -1.198   5.536
  624    HH   TYR  14           HH       TYR  14   9.639  -0.566   5.213
  625    H    ILE  15           H        ILE  15  15.102  -1.892  -1.891
  626    HA   ILE  15           HA       ILE  15  16.628  -4.255  -1.985
  627    HB   ILE  15           HB       ILE  15  16.183  -2.651  -3.900
  628   1HG1  ILE  15          2HG1      ILE  15  18.962  -2.956  -4.358
  629   2HG1  ILE  15          1HG1      ILE  15  18.469  -4.307  -3.335
  630   1HG2  ILE  15          2HG2      ILE  15  17.025  -0.631  -2.611
  631   2HG2  ILE  15          3HG2      ILE  15  18.657  -1.243  -2.866
  632   3HG2  ILE  15          1HG2      ILE  15  17.658  -0.790  -4.246
  633   1HD1  ILE  15          3HD1      ILE  15  16.826  -3.522  -5.736
  634   2HD1  ILE  15          1HD1      ILE  15  18.236  -4.567  -5.915
  635   3HD1  ILE  15          2HD1      ILE  15  16.886  -5.073  -4.899
  636    H    ALA  16           H        ALA  16  17.443  -1.130  -0.529
  637    HA   ALA  16           HA       ALA  16  19.116  -0.610   1.027
  638   1HB   ALA  16          2HB       ALA  16  18.479  -2.986   1.861
  639   2HB   ALA  16          3HB       ALA  16  19.943  -3.511   1.030
  640   3HB   ALA  16          1HB       ALA  16  20.046  -2.337   2.341
  641    H    ARG  17           H        ARG  17  21.250   0.043   0.811
  642    HA   ARG  17           HA       ARG  17  23.391   0.235  -0.113
  643   1HB   ARG  17          2HB       ARG  17  22.979  -2.417  -0.428
  644   2HB   ARG  17          1HB       ARG  17  23.049  -1.926  -2.103
  645   1HG   ARG  17          1HG       ARG  17  25.243  -1.135  -1.923
  646   2HG   ARG  17          2HG       ARG  17  25.118  -0.915  -0.178
  647   1HD   ARG  17          1HD       ARG  17  26.518  -2.907  -0.942
  648   2HD   ARG  17          2HD       ARG  17  25.242  -3.272   0.220
  649    HE   ARG  17           HE       ARG  17  24.570  -3.594  -2.643
  650   1HH1  ARG  17          2HH1      ARG  17  26.359  -5.334  -0.352
  651   2HH1  ARG  17          1HH1      ARG  17  25.700  -6.812  -0.970
  652   1HH2  ARG  17          2HH2      ARG  17  22.801  -5.251  -2.119
  653   2HH2  ARG  17          1HH2      ARG  17  23.364  -6.660  -1.284
  654    HA   PRO  18           HA       PRO  18  21.819   2.871  -3.364
  655   1HB   PRO  18          1HB       PRO  18  24.542   3.569  -4.016
  656   2HB   PRO  18          2HB       PRO  18  23.333   4.563  -3.258
  657   1HG   PRO  18          1HG       PRO  18  25.606   3.351  -2.013
  658   2HG   PRO  18          2HG       PRO  18  24.357   4.293  -1.235
  659   1HD   PRO  18          2HD       PRO  18  24.813   1.464  -1.049
  660   2HD   PRO  18          1HD       PRO  18  23.526   2.407  -0.273
  661    H    LEU  19           H        LEU  19  21.113   1.351  -4.865
  662    HA   LEU  19           HA       LEU  19  22.722  -0.499  -6.277
  663   1HB   LEU  19          2HB       LEU  19  20.836  -0.807  -7.724
  664   2HB   LEU  19          1HB       LEU  19  20.183  -0.431  -6.135
  665    HG   LEU  19           HG       LEU  19  20.627   1.766  -8.151
  666   1HD1  LEU  19          3HD1      LEU  19  18.372  -0.226  -7.979
  667   2HD1  LEU  19          1HD1      LEU  19  18.104   1.400  -8.604
  668   3HD1  LEU  19          2HD1      LEU  19  19.246   0.325  -9.409
  669   1HD2  LEU  19          3HD2      LEU  19  19.114   1.334  -5.602
  670   2HD2  LEU  19          1HD2      LEU  19  20.083   2.720  -6.104
  671   3HD2  LEU  19          2HD2      LEU  19  18.474   2.478  -6.782
  672    HA   PRO  20           HA       PRO  20  25.021   1.746  -9.243
  673   1HB   PRO  20          1HB       PRO  20  24.103   0.255 -11.555
  674   2HB   PRO  20          2HB       PRO  20  25.655   0.134 -10.720
  675   1HG   PRO  20          1HG       PRO  20  23.485  -1.751 -10.657
  676   2HG   PRO  20          2HG       PRO  20  25.013  -1.841  -9.772
  677   1HD   PRO  20          1HD       PRO  20  22.386  -1.281  -8.724
  678   2HD   PRO  20          2HD       PRO  20  23.914  -1.381  -7.830
  679    H    ARG  21           H        ARG  21  24.346   3.772  -9.779
  680    HA   ARG  21           HA       ARG  21  21.675   4.438 -10.562
  681   1HB   ARG  21          2HB       ARG  21  23.429   5.985  -9.541
  682   2HB   ARG  21          1HB       ARG  21  24.138   6.090 -11.133
  683   1HG   ARG  21          1HG       ARG  21  22.442   7.381 -11.955
  684   2HG   ARG  21          2HG       ARG  21  21.214   6.529 -11.019
  685   1HD   ARG  21          2HD       ARG  21  21.210   8.251  -9.568
  686   2HD   ARG  21          1HD       ARG  21  22.851   7.839  -9.134
  687    HE   ARG  21           HE       ARG  21  22.068  10.112 -10.717
  688   1HH1  ARG  21          1HH1      ARG  21  25.027   7.839 -10.566
  689   2HH1  ARG  21          2HH1      ARG  21  25.410   9.242  -9.626
  690   1HH2  ARG  21          1HH2      ARG  21  23.966  10.015 -12.884
  691   2HH2  ARG  21          2HH2      ARG  21  24.774  11.084 -11.787
  692    H    ALA  22           H        ALA  22  24.577   3.687 -12.428
  693    HA   ALA  22           HA       ALA  22  23.635   4.623 -14.956
  694   1HB   ALA  22          2HB       ALA  22  25.763   2.798 -13.997
  695   2HB   ALA  22          3HB       ALA  22  25.221   2.526 -15.653
  696   3HB   ALA  22          1HB       ALA  22  25.850   4.105 -15.178
  697    H    HIS  23           H        HIS  23  22.748   1.867 -13.064
  698    HA   HIS  23           HA       HIS  23  21.545   0.505 -15.407
  699   1HB   HIS  23          1HB       HIS  23  21.448  -0.346 -12.508
  700   2HB   HIS  23          2HB       HIS  23  21.138  -1.336 -13.913
  701    HD2  HIS  23           HD2      HIS  23  24.159   0.569 -14.930
  702    HE1  HIS  23           HE1      HIS  23  25.709  -2.746 -12.813
  703    HE2  HIS  23           HE2      HIS  23  26.290  -0.832 -14.387
  704    H    ILE  24           H        ILE  24  20.639   2.719 -12.919
  705    HA   ILE  24           HA       ILE  24  17.829   1.896 -12.911
  706    HB   ILE  24           HB       ILE  24  18.741   4.578 -11.945
  707   1HG1  ILE  24          2HG1      ILE  24  19.103   1.946 -10.482
  708   2HG1  ILE  24          1HG1      ILE  24  20.396   3.010 -11.035
  709   1HG2  ILE  24          3HG2      ILE  24  16.417   2.844 -11.711
  710   2HG2  ILE  24          1HG2      ILE  24  17.017   3.338 -10.129
  711   3HG2  ILE  24          2HG2      ILE  24  16.575   4.558 -11.325
  712   1HD1  ILE  24          1HD1      ILE  24  18.529   4.558  -9.498
  713   2HD1  ILE  24          2HD1      ILE  24  18.984   3.132  -8.567
  714   3HD1  ILE  24          3HD1      ILE  24  20.229   4.233  -9.154
  715    H    LYS  25           H        LYS  25  16.145   3.617 -13.454
  716    HA   LYS  25           HA       LYS  25  16.954   5.137 -15.904
  717   1HB   LYS  25          1HB       LYS  25  15.073   3.008 -15.643
  718   2HB   LYS  25          2HB       LYS  25  14.170   4.462 -15.949
  719   1HG   LYS  25          1HG       LYS  25  15.833   4.931 -17.843
  720   2HG   LYS  25          2HG       LYS  25  16.343   3.253 -17.650
  721   1HD   LYS  25          1HD       LYS  25  13.798   2.710 -17.805
  722   2HD   LYS  25          2HD       LYS  25  13.656   4.324 -18.498
  723   1HE   LYS  25          1HE       LYS  25  15.712   3.442 -19.975
  724   2HE   LYS  25          2HE       LYS  25  14.966   1.886 -19.613
  725   1HZ   LYS  25          2HZ       LYS  25  12.838   3.392 -20.259
  726   2HZ   LYS  25          3HZ       LYS  25  14.023   4.036 -21.291
  727   3HZ   LYS  25          1HZ       LYS  25  13.661   2.376 -21.342
  728    H    GLU  26           H        GLU  26  14.905   4.980 -13.036
  729    HA   GLU  26           HA       GLU  26  14.728   7.869 -12.879
  730   1HB   GLU  26          1HB       GLU  26  12.027   7.369 -12.839
  731   2HB   GLU  26          2HB       GLU  26  12.865   8.038 -14.192
  732   1HG   GLU  26          1HG       GLU  26  12.950   5.105 -14.127
  733   2HG   GLU  26          2HG       GLU  26  11.323   5.757 -14.208
  734    H    TYR  27           H        TYR  27  12.347   7.837 -11.169
  735    HA   TYR  27           HA       TYR  27  12.785   5.759  -9.186
  736   1HB   TYR  27          1HB       TYR  27  13.289   7.384  -7.359
  737   2HB   TYR  27          2HB       TYR  27  14.562   7.367  -8.580
  738    HD1  TYR  27           HD2      TYR  27  11.640   9.242  -7.266
  739    HD2  TYR  27           HD1      TYR  27  14.932   9.262 -10.059
  740    HE1  TYR  27           HE2      TYR  27  11.236  11.660  -7.724
  741    HE2  TYR  27           HE1      TYR  27  14.525  11.678 -10.522
  742    HH   TYR  27           HH       TYR  27  12.276  13.567  -8.613
  743    H    PHE  28           H        PHE  28  11.270   6.484  -7.155
  744    HA   PHE  28           HA       PHE  28   9.039   8.130  -8.042
  745   1HB   PHE  28          1HB       PHE  28   8.402   6.136  -9.208
  746   2HB   PHE  28          2HB       PHE  28   8.786   5.126  -7.837
  747    HD1  PHE  28           HD1      PHE  28   6.574   8.034  -8.745
  748    HD2  PHE  28           HD2      PHE  28   7.063   4.435  -6.412
  749    HE1  PHE  28           HE1      PHE  28   4.254   8.287  -7.865
  750    HE2  PHE  28           HE2      PHE  28   4.749   4.690  -5.531
  751    HZ   PHE  28           HZ       PHE  28   3.339   6.611  -6.263
  752    H    TYR  29           H        TYR  29   9.746   9.184  -6.001
  753    HA   TYR  29           HA       TYR  29   9.818   7.926  -3.471
  754   1HB   TYR  29          1HB       TYR  29  10.555  10.229  -3.766
  755   2HB   TYR  29          2HB       TYR  29   8.921  10.728  -4.186
  756    HD1  TYR  29           HD1      TYR  29  10.969   9.232  -1.430
  757    HD2  TYR  29           HD2      TYR  29   7.349  11.319  -2.511
  758    HE1  TYR  29           HE1      TYR  29  10.445   9.572   0.982
  759    HE2  TYR  29           HE2      TYR  29   6.825  11.659  -0.100
  760    HH   TYR  29           HH       TYR  29   7.441  10.456   2.110
  761    H    THR  30           H        THR  30   8.271   7.144  -2.171
  762    HA   THR  30           HA       THR  30   5.509   7.029  -3.144
  763    HB   THR  30           HB       THR  30   6.492   6.065  -0.454
  764    HG1  THR  30           HG1      THR  30   6.842   4.067  -1.651
  765   1HG2  THR  30          3HG2      THR  30   3.992   6.111  -1.475
  766   2HG2  THR  30          1HG2      THR  30   4.553   4.584  -2.157
  767   3HG2  THR  30          2HG2      THR  30   4.560   4.826  -0.409
  768    H    SER  31           H        SER  31   3.922   8.434  -2.555
  769    HA   SER  31           HA       SER  31   4.410  10.757  -1.008
  770   1HB   SER  31          1HB       SER  31   1.885   9.333  -1.839
  771   2HB   SER  31          2HB       SER  31   1.820  10.774  -0.824
  772    HG   SER  31           HG       SER  31   3.214  10.628  -3.283
  773    H    GLY  32           H        GLY  32   2.098   8.229   0.011
  774   1HA   GLY  32          2HA       GLY  32   3.190   7.349   2.371
  775   2HA   GLY  32          1HA       GLY  32   2.554   8.916   2.811
  776    H    LYS  33           H        LYS  33   1.475   6.036   0.976
  777    HA   LYS  33           HA       LYS  33  -1.251   6.474   2.102
  778   1HB   LYS  33          1HB       LYS  33  -0.293   4.814  -0.242
  779   2HB   LYS  33          2HB       LYS  33  -1.945   4.838   0.325
  780   1HG   LYS  33          2HG       LYS  33  -1.176   7.539   0.073
  781   2HG   LYS  33          1HG       LYS  33  -0.598   6.739  -1.370
  782   1HD   LYS  33          2HD       LYS  33  -2.972   5.652  -1.416
  783   2HD   LYS  33          1HD       LYS  33  -3.412   6.969  -0.355
  784   1HE   LYS  33          1HE       LYS  33  -2.556   8.592  -2.019
  785   2HE   LYS  33          2HE       LYS  33  -2.146   7.254  -3.092
  786   1HZ   LYS  33          1HZ       LYS  33  -4.713   6.734  -2.506
  787   2HZ   LYS  33          2HZ       LYS  33  -4.717   8.432  -2.511
  788   3HZ   LYS  33          3HZ       LYS  33  -4.196   7.580  -3.885
  789    H    CYS  34           H        CYS  34   0.994   3.775   1.383
  790    HA   CYS  34           HA       CYS  34  -0.403   2.053   3.311
  791   1HB   CYS  34          1HB       CYS  34   2.275   1.413   2.083
  792   2HB   CYS  34          2HB       CYS  34   0.990   0.309   2.559
  793    H    SER  35           H        SER  35   1.884   0.723   4.394
  794    HA   SER  35           HA       SER  35   2.886   2.857   6.235
  795   1HB   SER  35          1HB       SER  35   1.482   0.629   6.924
  796   2HB   SER  35          2HB       SER  35   3.131   0.014   7.041
  797    HG   SER  35           HG       SER  35   3.550   1.988   8.293
  798    H    ASN  36           H        ASN  36   4.020   1.995   3.606
  799    HA   ASN  36           HA       ASN  36   6.726   1.194   4.606
  800   1HB   ASN  36          2HB       ASN  36   5.211   0.195   2.191
  801   2HB   ASN  36          1HB       ASN  36   6.966   0.074   2.305
  802   1HD2  ASN  36          2HD2      ASN  36   6.902  -2.519   4.733
  803   2HD2  ASN  36          1HD2      ASN  36   7.852  -1.506   3.758
  804    HA   PRO  37           HA       PRO  37   6.499   5.207   2.066
  805   1HB   PRO  37          1HB       PRO  37   8.101   6.383   4.179
  806   2HB   PRO  37          2HB       PRO  37   6.489   6.864   3.636
  807   1HG   PRO  37          2HG       PRO  37   7.183   5.485   6.065
  808   2HG   PRO  37          1HG       PRO  37   5.584   5.945   5.519
  809   1HD   PRO  37          1HD       PRO  37   6.692   3.300   5.638
  810   2HD   PRO  37          2HD       PRO  37   5.097   3.777   5.025
  811    H    ALA  38           H        ALA  38   8.177   5.369   0.599
  812    HA   ALA  38           HA       ALA  38  10.956   5.073   1.402
  813   1HB   ALA  38          2HB       ALA  38  10.075   2.699   1.370
  814   2HB   ALA  38          3HB       ALA  38   9.787   2.903  -0.358
  815   3HB   ALA  38          1HB       ALA  38  11.429   2.992   0.278
  816    H    VAL  39           H        VAL  39  11.590   4.035  -1.370
  817    HA   VAL  39           HA       VAL  39  10.585   6.198  -3.076
  818    HB   VAL  39           HB       VAL  39  12.880   6.635  -1.680
  819   1HG1  VAL  39          2HG1      VAL  39  13.858   4.670  -3.121
  820   2HG1  VAL  39          3HG1      VAL  39  14.001   5.926  -4.353
  821   3HG1  VAL  39          1HG1      VAL  39  14.822   6.112  -2.801
  822   1HG2  VAL  39          3HG2      VAL  39  11.644   7.677  -4.107
  823   2HG2  VAL  39          1HG2      VAL  39  12.267   8.530  -2.689
  824   3HG2  VAL  39          2HG2      VAL  39  13.367   8.033  -3.981
  825    H    VAL  40           H        VAL  40  10.510   5.414  -5.186
  826    HA   VAL  40           HA       VAL  40  11.443   2.597  -5.385
  827    HB   VAL  40           HB       VAL  40   8.943   3.966  -6.236
  828   1HG1  VAL  40          2HG1      VAL  40   9.803   2.986  -8.338
  829   2HG1  VAL  40          3HG1      VAL  40  10.001   1.442  -7.516
  830   3HG1  VAL  40          1HG1      VAL  40   8.390   2.117  -7.746
  831   1HG2  VAL  40          2HG2      VAL  40   9.789   1.366  -4.945
  832   2HG2  VAL  40          3HG2      VAL  40   8.873   2.691  -4.218
  833   3HG2  VAL  40          1HG2      VAL  40   8.120   1.667  -5.441
  834    H    PHE  41           H        PHE  41  13.079   2.276  -6.677
  835    HA   PHE  41           HA       PHE  41  13.689   4.161  -8.818
  836   1HB   PHE  41          1HB       PHE  41  15.017   1.694  -7.710
  837   2HB   PHE  41          2HB       PHE  41  15.528   2.361  -9.260
  838    HD1  PHE  41           HD1      PHE  41  16.033   4.955  -9.295
  839    HD2  PHE  41           HD2      PHE  41  15.958   2.520  -5.731
  840    HE1  PHE  41           HE1      PHE  41  17.501   6.603  -8.138
  841    HE2  PHE  41           HE2      PHE  41  17.421   4.169  -4.573
  842    HZ   PHE  41           HZ       PHE  41  18.206   6.204  -5.779
  843    H    VAL  42           H        VAL  42  13.488   3.801 -10.910
  844    HA   VAL  42           HA       VAL  42  12.037   1.326 -11.768
  845    HB   VAL  42           HB       VAL  42  11.634   3.287 -13.723
  846   1HG1  VAL  42          1HG2      VAL  42  10.089   1.516 -12.768
  847   2HG1  VAL  42          2HG2      VAL  42   9.797   2.613 -11.418
  848   3HG1  VAL  42          3HG2      VAL  42   9.320   3.076 -13.054
  849   1HG2  VAL  42          1HG1      VAL  42  11.210   4.479 -10.976
  850   2HG2  VAL  42          2HG1      VAL  42  12.360   5.039 -12.181
  851   3HG2  VAL  42          3HG1      VAL  42  10.635   5.174 -12.492
  852    H    THR  43           H        THR  43  14.111   0.316 -12.178
  853    HA   THR  43           HA       THR  43  16.171   1.700 -13.716
  854    HB   THR  43           HB       THR  43  17.510  -0.238 -13.349
  855    HG1  THR  43           HG1      THR  43  15.176  -1.606 -12.532
  856   1HG2  THR  43          1HG2      THR  43  15.613   0.094 -11.009
  857   2HG2  THR  43          2HG2      THR  43  17.206  -0.652 -10.932
  858   3HG2  THR  43          3HG2      THR  43  17.054   1.060 -11.317
  859    H    ARG  44           H        ARG  44  17.244  -0.365 -15.237
  860    HA   ARG  44           HA       ARG  44  16.174   0.099 -17.747
  861   1HB   ARG  44          1HB       ARG  44  17.195  -2.282 -18.283
  862   2HB   ARG  44          2HB       ARG  44  18.238  -0.945 -17.886
  863   1HG   ARG  44          1HG       ARG  44  18.987  -1.977 -16.029
  864   2HG   ARG  44          2HG       ARG  44  17.347  -2.307 -15.479
  865   1HD   ARG  44          1HD       ARG  44  17.224  -4.323 -16.771
  866   2HD   ARG  44          2HD       ARG  44  18.697  -3.922 -17.654
  867    HE   ARG  44           HE       ARG  44  19.196  -4.104 -14.809
  868   1HH1  ARG  44          1HH2      ARG  44  17.817  -6.887 -15.997
  869   2HH1  ARG  44          2HH2      ARG  44  18.972  -7.114 -17.267
  870   1HH2  ARG  44          1HH1      ARG  44  21.007  -5.924 -14.622
  871   2HH2  ARG  44          2HH1      ARG  44  21.316  -6.410 -16.255
  872    H    LYS  45           H        LYS  45  15.637  -2.995 -15.973
  873    HA   LYS  45           HA       LYS  45  13.440  -3.844 -17.598
  874   1HB   LYS  45          2HB       LYS  45  14.747  -4.929 -15.443
  875   2HB   LYS  45          1HB       LYS  45  13.217  -4.448 -14.707
  876   1HG   LYS  45          1HG       LYS  45  12.476  -5.590 -17.150
  877   2HG   LYS  45          2HG       LYS  45  13.769  -6.634 -16.557
  878   1HD   LYS  45          1HD       LYS  45  12.538  -6.610 -14.304
  879   2HD   LYS  45          2HD       LYS  45  11.177  -5.911 -15.180
  880   1HE   LYS  45          1HE       LYS  45  12.489  -8.598 -15.657
  881   2HE   LYS  45          2HE       LYS  45  10.830  -8.290 -15.148
  882   1HZ   LYS  45          3HZ       LYS  45  10.471  -7.143 -17.278
  883   2HZ   LYS  45          1HZ       LYS  45  12.037  -7.585 -17.767
  884   3HZ   LYS  45          2HZ       LYS  45  10.866  -8.782 -17.479
  885    H    ASN  46           H        ASN  46  13.820  -1.564 -15.033
  886    HA   ASN  46           HA       ASN  46  12.540   0.192 -14.304
  887   1HB   ASN  46          1HB       ASN  46  11.439  -0.491 -16.904
  888   2HB   ASN  46          2HB       ASN  46  10.163   0.025 -15.835
  889   1HD2  ASN  46          1HD2      ASN  46  11.192   3.155 -17.227
  890   2HD2  ASN  46          2HD2      ASN  46  11.021   1.693 -18.074
  891    H    ARG  47           H        ARG  47  12.112  -2.698 -13.473
  892    HA   ARG  47           HA       ARG  47   9.374  -2.914 -12.604
  893   1HB   ARG  47          2HB       ARG  47  11.974  -3.900 -11.397
  894   2HB   ARG  47          1HB       ARG  47  10.417  -4.270 -10.711
  895   1HG   ARG  47          1HG       ARG  47  10.848  -4.795 -13.624
  896   2HG   ARG  47          2HG       ARG  47  11.557  -5.913 -12.461
  897   1HD   ARG  47          1HD       ARG  47   9.480  -6.894 -12.714
  898   2HD   ARG  47          2HD       ARG  47   9.112  -5.779 -11.398
  899    HE   ARG  47           HE       ARG  47   8.663  -4.405 -13.841
  900   1HH1  ARG  47          1HH1      ARG  47   7.054  -6.594 -15.053
  901   2HH1  ARG  47          2HH1      ARG  47   6.390  -7.412 -13.678
  902   1HH2  ARG  47          2HH2      ARG  47   6.535  -4.376 -11.869
  903   2HH2  ARG  47          1HH2      ARG  47   5.294  -5.221 -12.734
  904    H    GLN  48           H        GLN  48   8.744  -2.302 -10.212
  905    HA   GLN  48           HA       GLN  48   9.933   0.340  -9.821
  906   1HB   GLN  48          2HB       GLN  48   7.388  -0.920  -9.046
  907   2HB   GLN  48          1HB       GLN  48   8.049   0.240  -7.887
  908   1HG   GLN  48          2HG       GLN  48   8.322   1.887  -9.679
  909   2HG   GLN  48          1HG       GLN  48   7.759   0.746 -10.862
  910   1HE2  GLN  48          1HE2      GLN  48   4.335   0.854  -9.463
  911   2HE2  GLN  48          2HE2      GLN  48   5.467  -0.316  -9.940
  912    H    VAL  49           H        VAL  49  11.877  -0.789  -9.331
  913    HA   VAL  49           HA       VAL  49  12.484  -2.336  -7.110
  914    HB   VAL  49           HB       VAL  49  14.408  -0.164  -7.696
  915   1HG1  VAL  49          2HG1      VAL  49  14.391  -3.154  -7.398
  916   2HG1  VAL  49          3HG1      VAL  49  15.821  -2.309  -7.996
  917   3HG1  VAL  49          1HG1      VAL  49  15.194  -1.952  -6.386
  918   1HG2  VAL  49          1HG2      VAL  49  13.317  -1.975  -9.854
  919   2HG2  VAL  49          2HG2      VAL  49  13.841  -0.302 -10.000
  920   3HG2  VAL  49          3HG2      VAL  49  15.033  -1.590  -9.856
  921    H    CYS  50           H        CYS  50  13.578  -1.574  -5.066
  922    HA   CYS  50           HA       CYS  50  12.381   0.969  -4.051
  923   1HB   CYS  50          2HB       CYS  50  11.444  -1.379  -3.259
  924   2HB   CYS  50          1HB       CYS  50  12.888  -1.371  -2.244
  925    H    ALA  51           H        ALA  51  13.648   1.510  -1.820
  926    HA   ALA  51           HA       ALA  51  16.233   0.540  -1.336
  927   1HB   ALA  51          1HB       ALA  51  16.083   2.152  -3.727
  928   2HB   ALA  51          2HB       ALA  51  17.097   2.950  -2.528
  929   3HB   ALA  51          3HB       ALA  51  17.476   1.310  -3.049
  930    H    ASN  52           H        ASN  52  14.054   1.657   0.144
  931    HA   ASN  52           HA       ASN  52  13.805   3.012   2.041
  932   1HB   ASN  52          1HB       ASN  52  16.141   2.159   2.447
  933   2HB   ASN  52          2HB       ASN  52  16.752   3.584   1.606
  934   1HD2  ASN  52          1HD2      ASN  52  15.989   3.836   5.474
  935   2HD2  ASN  52          2HD2      ASN  52  15.402   2.460   4.671
  936    HA   PRO  53           HA       PRO  53  13.311   6.985   0.167
  937   1HB   PRO  53          2HB       PRO  53  12.102   8.256   2.236
  938   2HB   PRO  53          1HB       PRO  53  11.277   7.072   1.254
  939   1HG   PRO  53          1HG       PRO  53  12.283   6.777   4.038
  940   2HG   PRO  53          2HG       PRO  53  10.977   5.920   3.241
  941   1HD   PRO  53          2HD       PRO  53  13.621   4.954   3.672
  942   2HD   PRO  53          1HD       PRO  53  12.374   4.189   2.667
  943    H    GLU  54           H        GLU  54  14.369   7.056   3.608
  944    HA   GLU  54           HA       GLU  54  16.018   9.459   2.990
  945   1HB   GLU  54          1HB       GLU  54  14.293   9.258   4.967
  946   2HB   GLU  54          2HB       GLU  54  15.612   8.405   5.769
  947   1HG   GLU  54          1HG       GLU  54  17.094  10.306   5.466
  948   2HG   GLU  54          2HG       GLU  54  15.884  11.145   4.496
  949    H    LYS  55           H        LYS  55  17.115   7.065   2.053
  950    HA   LYS  55           HA       LYS  55  19.151   6.261   4.055
  951   1HB   LYS  55          2HB       LYS  55  17.973   5.035   1.705
  952   2HB   LYS  55          1HB       LYS  55  19.715   4.977   1.639
  953   1HG   LYS  55          1HG       LYS  55  18.347   4.276   4.209
  954   2HG   LYS  55          2HG       LYS  55  18.363   3.088   2.904
  955   1HD   LYS  55          1HD       LYS  55  20.792   3.148   2.811
  956   2HD   LYS  55          2HD       LYS  55  20.841   4.463   3.986
  957   1HE   LYS  55          1HE       LYS  55  19.788   2.978   5.670
  958   2HE   LYS  55          2HE       LYS  55  19.790   1.662   4.495
  959   1HZ   LYS  55          3HZ       LYS  55  22.255   3.100   5.284
  960   2HZ   LYS  55          1HZ       LYS  55  21.704   1.717   6.101
  961   3HZ   LYS  55          2HZ       LYS  55  22.123   1.621   4.459
  962    H    LYS  56           H        LYS  56  19.066   8.964   2.804
  963    HA   LYS  56           HA       LYS  56  20.586  10.526   1.983
  964   1HB   LYS  56          1HB       LYS  56  22.438   8.260   2.720
  965   2HB   LYS  56          2HB       LYS  56  23.037   9.780   2.060
  966   1HG   LYS  56          1HG       LYS  56  23.094   9.940   4.476
  967   2HG   LYS  56          2HG       LYS  56  21.793  10.979   3.895
  968   1HD   LYS  56          1HD       LYS  56  20.118   9.476   4.586
  969   2HD   LYS  56          2HD       LYS  56  21.240   8.117   4.659
  970   1HE   LYS  56          1HE       LYS  56  20.791   8.782   6.930
  971   2HE   LYS  56          2HE       LYS  56  22.423   9.330   6.547
  972   1HZ   LYS  56          2HZ       LYS  56  20.991  11.429   5.761
  973   2HZ   LYS  56          3HZ       LYS  56  20.015  10.873   7.035
  974   3HZ   LYS  56          1HZ       LYS  56  21.641  11.272   7.322
  975    H    TRP  57           H        TRP  57  22.504   7.847   0.723
  976    HA   TRP  57           HA       TRP  57  22.917   8.817  -1.817
  977   1HB   TRP  57          1HB       TRP  57  23.454   6.584  -2.507
  978   2HB   TRP  57          2HB       TRP  57  23.937   6.756  -0.817
  979    HD1  TRP  57           HD1      TRP  57  22.910   5.021   0.813
  980    HE1  TRP  57           HE1      TRP  57  21.223   3.088   0.511
  981    HE3  TRP  57           HE3      TRP  57  21.256   6.122  -3.835
  982    HZ2  TRP  57           HZ2      TRP  57  19.441   2.090  -1.545
  983    HZ3  TRP  57           HZ3      TRP  57  19.653   4.671  -5.002
  984    HH2  TRP  57           HH2      TRP  57  18.751   2.648  -3.873
  985    H    VAL  58           H        VAL  58  19.984   7.096  -0.796
  986    HA   VAL  58           HA       VAL  58  18.870   6.715  -3.383
  987    HB   VAL  58           HB       VAL  58  16.612   7.187  -2.062
  988   1HG1  VAL  58          2HG1      VAL  58  17.864   5.022  -2.895
  989   2HG1  VAL  58          3HG1      VAL  58  18.097   4.773  -1.166
  990   3HG1  VAL  58          1HG1      VAL  58  16.468   4.918  -1.830
  991   1HG2  VAL  58          2HG2      VAL  58  18.339   7.945  -0.129
  992   2HG2  VAL  58          3HG2      VAL  58  16.723   7.315   0.182
  993   3HG2  VAL  58          1HG2      VAL  58  18.120   6.245   0.271
  994    H    ARG  59           H        ARG  59  18.440   9.516  -1.189
  995    HA   ARG  59           HA       ARG  59  16.884  11.007  -3.092
  996   1HB   ARG  59          2HB       ARG  59  18.347  11.664  -0.564
  997   2HB   ARG  59          1HB       ARG  59  17.817  12.977  -1.588
  998   1HG   ARG  59          2HG       ARG  59  15.512  11.940  -1.585
  999   2HG   ARG  59          1HG       ARG  59  16.095  10.809  -0.365
 1000   1HD   ARG  59          1HD       ARG  59  16.287  12.453   1.262
 1001   2HD   ARG  59          2HD       ARG  59  16.522  13.741   0.081
 1002    HE   ARG  59           HE       ARG  59  13.946  13.010  -0.423
 1003   1HH1  ARG  59          1HH1      ARG  59  15.556  14.792   1.913
 1004   2HH1  ARG  59          2HH1      ARG  59  14.127  15.069   2.850
 1005   1HH2  ARG  59          1HH2      ARG  59  12.380  12.442   1.392
 1006   2HH2  ARG  59          2HH2      ARG  59  12.439  13.543   2.727
 1007    H    GLU  60           H        GLU  60  20.322  10.630  -2.513
 1008    HA   GLU  60           HA       GLU  60  21.194  12.845  -4.143
 1009   1HB   GLU  60          2HB       GLU  60  22.472  10.353  -3.072
 1010   2HB   GLU  60          1HB       GLU  60  23.304  11.264  -4.309
 1011   1HG   GLU  60          1HG       GLU  60  23.015  13.325  -2.885
 1012   2HG   GLU  60          2HG       GLU  60  22.388  12.280  -1.611
 1013    H    TYR  61           H        TYR  61  19.860   9.755  -4.857
 1014    HA   TYR  61           HA       TYR  61  20.923   9.737  -7.621
 1015   1HB   TYR  61          1HB       TYR  61  19.325   7.807  -5.935
 1016   2HB   TYR  61          2HB       TYR  61  19.399   7.618  -7.685
 1017    HD1  TYR  61           HD1      TYR  61  22.050   8.776  -5.270
 1018    HD2  TYR  61           HD2      TYR  61  20.772   5.744  -8.065
 1019    HE1  TYR  61           HE1      TYR  61  24.239   7.619  -5.014
 1020    HE2  TYR  61           HE2      TYR  61  22.966   4.590  -7.813
 1021    HH   TYR  61           HH       TYR  61  24.787   4.451  -6.109
 1022    H    ILE  62           H        ILE  62  18.001  10.283  -5.761
 1023    HA   ILE  62           HA       ILE  62  16.077  10.317  -7.837
 1024    HB   ILE  62           HB       ILE  62  16.284  11.941  -5.282
 1025   1HG1  ILE  62          2HG1      ILE  62  14.612   9.519  -5.991
 1026   2HG1  ILE  62          1HG1      ILE  62  16.107   9.453  -5.092
 1027   1HG2  ILE  62          2HG2      ILE  62  14.535  12.347  -7.486
 1028   2HG2  ILE  62          3HG2      ILE  62  13.588  11.596  -6.203
 1029   3HG2  ILE  62          1HG2      ILE  62  14.460  13.098  -5.894
 1030   1HD1  ILE  62          2HD1      ILE  62  14.882  11.299  -3.608
 1031   2HD1  ILE  62          3HD1      ILE  62  13.444  10.512  -4.259
 1032   3HD1  ILE  62          1HD1      ILE  62  14.616   9.578  -3.329
 1033    H    ASN  63           H        ASN  63  17.935  13.083  -6.501
 1034    HA   ASN  63           HA       ASN  63  17.055  14.837  -8.657
 1035   1HB   ASN  63          2HB       ASN  63  18.991  15.072  -6.365
 1036   2HB   ASN  63          1HB       ASN  63  18.982  16.291  -7.641
 1037   1HD2  ASN  63          2HD2      ASN  63  15.522  15.438  -5.689
 1038   2HD2  ASN  63          1HD2      ASN  63  16.950  15.173  -4.810
 1039    H    SER  64           H        SER  64  19.867  12.813  -8.020
 1040    HA   SER  64           HA       SER  64  21.494  13.945 -10.135
 1041   1HB   SER  64          2HB       SER  64  22.478  12.684  -8.254
 1042   2HB   SER  64          1HB       SER  64  21.661  11.237  -8.789
 1043    HG   SER  64           HG       SER  64  23.994  12.008  -9.534
 1044    H    LEU  65           H        LEU  65  18.738  11.943 -10.185
 1045    HA   LEU  65           HA       LEU  65  19.508  10.496 -12.628
 1046   1HB   LEU  65          2HB       LEU  65  17.167  10.504 -10.783
 1047   2HB   LEU  65          1HB       LEU  65  16.887   9.990 -12.429
 1048    HG   LEU  65           HG       LEU  65  19.038   8.866 -10.617
 1049   1HD1  LEU  65          3HD1      LEU  65  16.210   8.084 -11.184
 1050   2HD1  LEU  65          1HD1      LEU  65  17.401   6.792 -11.037
 1051   3HD1  LEU  65          2HD1      LEU  65  17.146   7.912  -9.698
 1052   1HD2  LEU  65          3HD2      LEU  65  18.515   8.717 -13.474
 1053   2HD2  LEU  65          1HD2      LEU  65  19.902   8.119 -12.564
 1054   3HD2  LEU  65          2HD2      LEU  65  18.459   7.117 -12.732
 1055    H    GLU  66           H        GLU  66  19.126  11.248 -14.660
 1056    HA   GLU  66           HA       GLU  66  17.254  13.568 -14.941
 1057   1HB   GLU  66          1HB       GLU  66  19.821  12.985 -16.450
 1058   2HB   GLU  66          2HB       GLU  66  18.705  14.290 -16.846
 1059   1HG   GLU  66          1HG       GLU  66  19.463  14.215 -14.006
 1060   2HG   GLU  66          2HG       GLU  66  20.823  14.502 -15.091
 1061    H    MET  67           H        MET  67  16.436  13.737 -17.289
 1062    HA   MET  67           HA       MET  67  15.091  11.313 -17.989
 1063   1HB   MET  67          1HB       MET  67  14.259  13.577 -18.585
 1064   2HB   MET  67          2HB       MET  67  15.598  13.753 -19.719
 1065   1HG   MET  67          1HG       MET  67  14.797  11.919 -21.064
 1066   2HG   MET  67          2HG       MET  67  13.590  11.488 -19.852
 1067   1HE   MET  67          1HE       MET  67  11.720  11.986 -19.626
 1068   2HE   MET  67          3HE       MET  67  10.925  13.552 -19.795
 1069   3HE   MET  67          2HE       MET  67  10.812  12.360 -21.091
 1070    H    SER  68           H        SER  68  17.864  12.971 -19.525
 1071    HA   SER  68           HA       SER  68  18.559  10.343 -20.776
 1072   1HB   SER  68          1HB       SER  68  17.668  12.237 -22.328
 1073   2HB   SER  68          2HB       SER  68  19.241  12.985 -22.054
 1074    HG   SER  68           HG       SER  68  19.449  11.694 -23.828
   
  No H/Q in entry =        1074
  Start of MODEL    5
    1    H    SER   1           H        SER   1   6.886 -16.589  -5.008
    2    HA   SER   1           HA       SER   1   9.640 -17.123  -5.402
    3   1HB   SER   1          1HB       SER   1   8.147 -16.492  -7.844
    4   2HB   SER   1          2HB       SER   1   9.497 -15.391  -7.564
    5    HG   SER   1           HG       SER   1  10.785 -16.933  -8.103
    6    HA   PRO   2           HA       PRO   2   8.266 -13.191  -3.299
    7   1HB   PRO   2          1HB       PRO   2  10.211 -13.810  -1.256
    8   2HB   PRO   2          2HB       PRO   2   8.450 -13.769  -1.103
    9   1HG   PRO   2          1HG       PRO   2  10.168 -16.088  -1.143
   10   2HG   PRO   2          2HG       PRO   2   8.407 -16.049  -0.993
   11   1HD   PRO   2          1HD       PRO   2   9.971 -16.870  -3.274
   12   2HD   PRO   2          2HD       PRO   2   8.203 -16.831  -3.122
   13    H    TYR   3           H        TYR   3   9.347 -11.337  -3.862
   14    HA   TYR   3           HA       TYR   3  12.245 -11.589  -4.537
   15   1HB   TYR   3          1HB       TYR   3  10.002 -10.340  -5.864
   16   2HB   TYR   3          2HB       TYR   3  11.238  -9.134  -5.509
   17    HD1  TYR   3           HD2      TYR   3  11.541 -12.797  -6.295
   18    HD2  TYR   3           HD1      TYR   3  12.420  -8.749  -7.515
   19    HE1  TYR   3           HE2      TYR   3  12.928 -13.664  -8.176
   20    HE2  TYR   3           HE1      TYR   3  13.806  -9.617  -9.396
   21    HH   TYR   3           HH       TYR   3  14.933 -11.549 -10.116
   22    H    SER   4           H        SER   4   9.922  -9.217  -3.178
   23    HA   SER   4           HA       SER   4  10.252  -7.551  -1.559
   24   1HB   SER   4          1HB       SER   4  12.652  -8.906  -0.449
   25   2HB   SER   4          2HB       SER   4  11.211  -8.313   0.378
   26    HG   SER   4           HG       SER   4  10.960 -10.452   0.443
   27    H    SER   5           H        SER   5  11.031  -6.227  -3.443
   28    HA   SER   5           HA       SER   5  13.535  -4.942  -2.804
   29   1HB   SER   5          1HB       SER   5  14.670  -5.470  -4.982
   30   2HB   SER   5          2HB       SER   5  14.530  -6.863  -3.910
   31    HG   SER   5           HG       SER   5  13.895  -7.237  -6.131
   32    H    ASP   6           H        ASP   6  11.047  -5.543  -5.258
   33    HA   ASP   6           HA       ASP   6  11.258  -2.687  -6.113
   34   1HB   ASP   6          1HB       ASP   6   9.992  -3.391  -8.095
   35   2HB   ASP   6          2HB       ASP   6  11.373  -4.460  -7.881
   36    H    THR   7           H        THR   7   8.469  -2.765  -7.137
   37    HA   THR   7           HA       THR   7   7.231  -1.944  -4.641
   38    HB   THR   7           HB       THR   7   6.845  -0.701  -6.757
   39    HG1  THR   7           HG1      THR   7   4.941  -0.225  -6.035
   40   1HG2  THR   7          1HG2      THR   7   6.775  -2.968  -8.067
   41   2HG2  THR   7          2HG2      THR   7   5.062  -2.955  -7.649
   42   3HG2  THR   7          3HG2      THR   7   5.746  -1.640  -8.604
   43    H    THR   8           H        THR   8   4.835  -2.721  -4.308
   44    HA   THR   8           HA       THR   8   4.522  -5.594  -4.991
   45    HB   THR   8           HB       THR   8   4.213  -4.600  -2.148
   46    HG1  THR   8           HG1      THR   8   6.382  -5.960  -3.368
   47   1HG2  THR   8          3HG2      THR   8   3.046  -6.721  -3.121
   48   2HG2  THR   8          1HG2      THR   8   4.662  -7.426  -3.090
   49   3HG2  THR   8          2HG2      THR   8   3.917  -6.866  -1.593
   50    HA   PRO   9           HA       PRO   9   0.487  -3.827  -5.746
   51   1HB   PRO   9          1HB       PRO   9  -0.573  -6.492  -6.075
   52   2HB   PRO   9          2HB       PRO   9  -0.206  -5.307  -7.333
   53   1HG   PRO   9          2HG       PRO   9   1.256  -7.717  -6.695
   54   2HG   PRO   9          1HG       PRO   9   1.620  -6.535  -7.955
   55   1HD   PRO   9          2HD       PRO   9   3.021  -6.974  -5.501
   56   2HD   PRO   9          1HD       PRO   9   3.375  -5.790  -6.748
   57    H    CYS  10           H        CYS  10  -0.919  -3.273  -4.138
   58    HA   CYS  10           HA       CYS  10  -2.138  -5.213  -2.377
   59   1HB   CYS  10          1HB       CYS  10   0.026  -5.154  -1.259
   60   2HB   CYS  10          2HB       CYS  10   0.021  -3.409  -1.254
   61    H    CYS  11           H        CYS  11  -3.882  -4.318  -1.269
   62    HA   CYS  11           HA       CYS  11  -4.781  -1.767  -2.318
   63   1HB   CYS  11          1HB       CYS  11  -6.538  -3.292  -2.084
   64   2HB   CYS  11          2HB       CYS  11  -5.971  -3.883  -0.551
   65    H    PHE  12           H        PHE  12  -5.185   0.127  -1.055
   66    HA   PHE  12           HA       PHE  12  -3.565   0.269   1.450
   67   1HB   PHE  12          1HB       PHE  12  -2.807   1.800  -0.305
   68   2HB   PHE  12          2HB       PHE  12  -4.419   2.445  -0.478
   69    HD1  PHE  12           HD2      PHE  12  -2.648   1.544   2.692
   70    HD2  PHE  12           HD1      PHE  12  -4.161   4.719   0.185
   71    HE1  PHE  12           HE2      PHE  12  -2.182   3.194   4.500
   72    HE2  PHE  12           HE1      PHE  12  -3.693   6.369   1.993
   73    HZ   PHE  12           HZ       PHE  12  -2.703   5.607   4.151
   74    H    ALA  13           H        ALA  13  -6.723   0.708   0.043
   75    HA   ALA  13           HA       ALA  13  -7.947   0.819   2.686
   76   1HB   ALA  13          1HB       ALA  13  -7.242   3.269   1.621
   77   2HB   ALA  13          2HB       ALA  13  -8.913   3.085   1.088
   78   3HB   ALA  13          3HB       ALA  13  -8.523   3.013   2.806
   79    H    TYR  14           H        TYR  14 -10.134   0.244   2.597
   80    HA   TYR  14           HA       TYR  14 -10.966  -0.697  -0.087
   81   1HB   TYR  14          1HB       TYR  14 -12.833  -1.611   1.853
   82   2HB   TYR  14          2HB       TYR  14 -11.657  -2.564   0.957
   83    HD1  TYR  14           HD2      TYR  14 -12.298  -0.731   4.118
   84    HD2  TYR  14           HD1      TYR  14  -9.567  -3.288   1.964
   85    HE1  TYR  14           HE2      TYR  14 -11.028  -1.147   6.223
   86    HE2  TYR  14           HE1      TYR  14  -8.294  -3.699   4.065
   87    HH   TYR  14           HH       TYR  14  -7.978  -2.940   6.208
   88    H    ILE  15           H        ILE  15 -12.897   0.000  -1.025
   89    HA   ILE  15           HA       ILE  15 -13.938   2.542  -0.090
   90    HB   ILE  15           HB       ILE  15 -15.592   2.193  -1.984
   91   1HG1  ILE  15          2HG1      ILE  15 -13.894  -0.178  -2.728
   92   2HG1  ILE  15          1HG1      ILE  15 -15.311  -0.390  -1.701
   93   1HG2  ILE  15          2HG2      ILE  15 -13.212   3.211  -2.134
   94   2HG2  ILE  15          3HG2      ILE  15 -12.762   1.686  -2.896
   95   3HG2  ILE  15          1HG2      ILE  15 -13.988   2.713  -3.638
   96   1HD1  ILE  15          3HD1      ILE  15 -15.463   1.114  -4.316
   97   2HD1  ILE  15          1HD1      ILE  15 -15.659  -0.638  -4.245
   98   3HD1  ILE  15          2HD1      ILE  15 -16.783   0.412  -3.380
   99    H    ALA  16           H        ALA  16 -16.501   2.694  -0.061
  100    HA   ALA  16           HA       ALA  16 -17.433   0.585   1.841
  101   1HB   ALA  16          3HB       ALA  16 -17.283   2.929   2.717
  102   2HB   ALA  16          1HB       ALA  16 -18.470   3.414   1.507
  103   3HB   ALA  16          2HB       ALA  16 -18.918   2.271   2.773
  104    H    ARG  17           H        ARG  17 -17.991  -0.691  -0.132
  105    HA   ARG  17           HA       ARG  17 -20.752  -0.598  -0.745
  106   1HB   ARG  17          1HB       ARG  17 -19.187   1.275  -2.256
  107   2HB   ARG  17          2HB       ARG  17 -19.788   0.039  -3.334
  108   1HG   ARG  17          1HG       ARG  17 -22.059   0.400  -2.091
  109   2HG   ARG  17          2HG       ARG  17 -21.341   1.932  -1.593
  110   1HD   ARG  17          1HD       ARG  17 -22.428   2.498  -3.599
  111   2HD   ARG  17          2HD       ARG  17 -20.769   2.211  -4.123
  112    HE   ARG  17           HE       ARG  17 -21.700  -0.205  -4.606
  113   1HH1  ARG  17          2HH1      ARG  17 -24.578   0.706  -4.092
  114   2HH1  ARG  17          1HH1      ARG  17 -24.990   1.607  -5.514
  115   1HH2  ARG  17          2HH2      ARG  17 -22.111   1.456  -7.086
  116   2HH2  ARG  17          1HH2      ARG  17 -23.519   0.484  -7.360
  117    HA   PRO  18           HA       PRO  18 -18.783  -4.599  -1.616
  118   1HB   PRO  18          2HB       PRO  18 -21.436  -5.641  -2.079
  119   2HB   PRO  18          1HB       PRO  18 -20.353  -5.975  -0.731
  120   1HG   PRO  18          1HG       PRO  18 -22.712  -4.307  -0.725
  121   2HG   PRO  18          2HG       PRO  18 -21.676  -4.714   0.626
  122   1HD   PRO  18          2HD       PRO  18 -21.874  -2.193  -0.659
  123   2HD   PRO  18          1HD       PRO  18 -20.702  -2.654   0.562
  124    H    LEU  19           H        LEU  19 -17.991  -5.000  -3.625
  125    HA   LEU  19           HA       LEU  19 -19.351  -3.948  -5.994
  126   1HB   LEU  19          2HB       LEU  19 -16.977  -5.797  -6.060
  127   2HB   LEU  19          1HB       LEU  19 -17.403  -4.540  -7.193
  128    HG   LEU  19           HG       LEU  19 -16.457  -4.113  -4.347
  129   1HD1  LEU  19          2HD1      LEU  19 -14.782  -4.833  -6.152
  130   2HD1  LEU  19          3HD1      LEU  19 -15.113  -3.281  -6.922
  131   3HD1  LEU  19          1HD1      LEU  19 -14.422  -3.331  -5.300
  132   1HD2  LEU  19          1HD2      LEU  19 -18.062  -2.465  -5.992
  133   2HD2  LEU  19          2HD2      LEU  19 -17.248  -2.009  -4.496
  134   3HD2  LEU  19          3HD2      LEU  19 -16.438  -1.779  -6.045
  135    HA   PRO  20           HA       PRO  20 -21.774  -7.692  -6.424
  136   1HB   PRO  20          1HB       PRO  20 -22.132  -7.088  -9.245
  137   2HB   PRO  20          2HB       PRO  20 -23.326  -7.006  -7.943
  138   1HG   PRO  20          1HG       PRO  20 -22.048  -4.805  -9.276
  139   2HG   PRO  20          2HG       PRO  20 -23.180  -4.728  -7.922
  140   1HD   PRO  20          1HD       PRO  20 -20.343  -4.207  -7.888
  141   2HD   PRO  20          2HD       PRO  20 -21.479  -4.131  -6.528
  142    H    ARG  21           H        ARG  21 -20.775  -9.639  -6.663
  143    HA   ARG  21           HA       ARG  21 -18.291 -10.122  -7.809
  144   1HB   ARG  21          2HB       ARG  21 -18.813 -12.475  -7.780
  145   2HB   ARG  21          1HB       ARG  21 -19.602 -11.735  -6.391
  146   1HG   ARG  21          1HG       ARG  21 -21.036 -12.163  -9.017
  147   2HG   ARG  21          2HG       ARG  21 -21.020 -13.368  -7.756
  148   1HD   ARG  21          1HD       ARG  21 -21.781 -11.369  -6.231
  149   2HD   ARG  21          2HD       ARG  21 -22.282 -10.656  -7.745
  150    HE   ARG  21           HE       ARG  21 -23.686 -12.729  -6.384
  151   1HH1  ARG  21          1HH1      ARG  21 -22.959 -14.553  -8.534
  152   2HH1  ARG  21          2HH1      ARG  21 -23.531 -13.857 -10.013
  153   1HH2  ARG  21          2HH2      ARG  21 -24.699 -11.305  -9.432
  154   2HH2  ARG  21          1HH2      ARG  21 -25.802 -12.336  -8.585
  155    H    ALA  22           H        ALA  22 -21.353  -9.801  -9.455
  156    HA   ALA  22           HA       ALA  22 -20.520 -11.007 -11.944
  157   1HB   ALA  22          1HB       ALA  22 -22.797  -9.345 -11.002
  158   2HB   ALA  22          2HB       ALA  22 -22.439  -9.265 -12.727
  159   3HB   ALA  22          3HB       ALA  22 -22.806 -10.817 -11.974
  160    H    HIS  23           H        HIS  23 -20.686  -7.621 -10.817
  161    HA   HIS  23           HA       HIS  23 -19.594  -6.483 -13.209
  162   1HB   HIS  23          2HB       HIS  23 -19.429  -5.461 -10.356
  163   2HB   HIS  23          1HB       HIS  23 -19.116  -4.509 -11.806
  164    HD2  HIS  23           HD2      HIS  23 -22.176  -6.889 -12.076
  165    HE1  HIS  23           HE1      HIS  23 -23.673  -3.001 -11.363
  166    HE2  HIS  23           HE2      HIS  23 -24.304  -5.386 -11.986
  167    H    ILE  24           H        ILE  24 -18.112  -8.061 -10.436
  168    HA   ILE  24           HA       ILE  24 -15.441  -7.096 -11.148
  169    HB   ILE  24           HB       ILE  24 -15.999  -9.425  -9.345
  170   1HG1  ILE  24          1HG1      ILE  24 -16.114  -6.487  -8.636
  171   2HG1  ILE  24          2HG1      ILE  24 -17.434  -7.617  -8.571
  172   1HG2  ILE  24          3HG2      ILE  24 -13.724  -7.736 -10.059
  173   2HG2  ILE  24          1HG2      ILE  24 -13.946  -7.885  -8.319
  174   3HG2  ILE  24          2HG2      ILE  24 -13.750  -9.329  -9.308
  175   1HD1  ILE  24          1HD1      ILE  24 -15.272  -8.720  -7.080
  176   2HD1  ILE  24          2HD1      ILE  24 -15.545  -7.064  -6.536
  177   3HD1  ILE  24          3HD1      ILE  24 -16.865  -8.234  -6.501
  178    H    LYS  25           H        LYS  25 -13.702  -8.618 -11.782
  179    HA   LYS  25           HA       LYS  25 -14.766 -10.924 -13.370
  180   1HB   LYS  25          1HB       LYS  25 -12.457  -9.057 -13.984
  181   2HB   LYS  25          2HB       LYS  25 -12.800 -10.532 -14.890
  182   1HG   LYS  25          1HG       LYS  25 -15.055  -8.619 -14.486
  183   2HG   LYS  25          2HG       LYS  25 -13.796  -8.153 -15.629
  184   1HD   LYS  25          1HD       LYS  25 -14.568 -10.943 -15.960
  185   2HD   LYS  25          2HD       LYS  25 -15.947  -9.861 -16.148
  186   1HE   LYS  25          1HE       LYS  25 -14.986 -10.004 -18.318
  187   2HE   LYS  25          2HE       LYS  25 -14.423  -8.460 -17.677
  188   1HZ   LYS  25          2HZ       LYS  25 -12.440  -9.828 -16.843
  189   2HZ   LYS  25          3HZ       LYS  25 -12.940 -10.991 -17.975
  190   3HZ   LYS  25          1HZ       LYS  25 -12.507  -9.432 -18.493
  191    H    GLU  26           H        GLU  26 -12.481  -9.828 -11.003
  192    HA   GLU  26           HA       GLU  26 -11.732 -12.521 -10.294
  193   1HB   GLU  26          1HB       GLU  26  -9.170 -11.761 -10.666
  194   2HB   GLU  26          2HB       GLU  26 -10.064 -12.645 -11.882
  195   1HG   GLU  26          1HG       GLU  26 -10.438  -9.737 -12.039
  196   2HG   GLU  26          2HG       GLU  26  -8.790 -10.244 -12.291
  197    H    TYR  27           H        TYR  27  -9.368 -11.847  -8.841
  198    HA   TYR  27           HA       TYR  27  -9.792  -9.368  -7.411
  199   1HB   TYR  27          2HB       TYR  27 -10.605 -10.215  -5.352
  200   2HB   TYR  27          1HB       TYR  27 -11.568 -11.047  -6.558
  201    HD1  TYR  27           HD2      TYR  27 -11.149 -13.407  -7.160
  202    HD2  TYR  27           HD1      TYR  27  -8.943 -11.447  -4.007
  203    HE1  TYR  27           HE2      TYR  27 -10.364 -15.622  -6.335
  204    HE2  TYR  27           HE1      TYR  27  -8.152 -13.666  -3.186
  205    HH   TYR  27           HH       TYR  27  -7.853 -15.935  -3.990
  206    H    PHE  28           H        PHE  28  -8.169  -9.492  -5.352
  207    HA   PHE  28           HA       PHE  28  -5.930 -11.270  -6.034
  208   1HB   PHE  28          2HB       PHE  28  -5.294  -9.495  -7.431
  209   2HB   PHE  28          1HB       PHE  28  -5.889  -8.276  -6.310
  210    HD1  PHE  28           HD1      PHE  28  -3.579 -11.215  -5.845
  211    HD2  PHE  28           HD2      PHE  28  -4.100  -6.937  -5.611
  212    HE1  PHE  28           HE1      PHE  28  -1.359 -11.004  -4.734
  213    HE2  PHE  28           HE2      PHE  28  -1.883  -6.725  -4.501
  214    HZ   PHE  28           HZ       PHE  28  -0.502  -8.757  -4.075
  215    H    TYR  29           H        TYR  29  -6.527 -12.146  -3.895
  216    HA   TYR  29           HA       TYR  29  -6.549 -10.631  -1.510
  217   1HB   TYR  29          2HB       TYR  29  -7.217 -12.999  -1.602
  218   2HB   TYR  29          1HB       TYR  29  -5.558 -13.459  -1.889
  219    HD1  TYR  29           HD1      TYR  29  -3.852 -13.274  -0.120
  220    HD2  TYR  29           HD2      TYR  29  -7.971 -12.195   0.587
  221    HE1  TYR  29           HE1      TYR  29  -3.426 -13.261   2.335
  222    HE2  TYR  29           HE2      TYR  29  -7.547 -12.184   3.042
  223    HH   TYR  29           HH       TYR  29  -4.548 -13.370   4.403
  224    H    THR  30           H        THR  30  -4.991  -9.690  -0.345
  225    HA   THR  30           HA       THR  30  -2.249  -9.678  -1.417
  226    HB   THR  30           HB       THR  30  -2.228  -8.216   0.958
  227    HG1  THR  30           HG1      THR  30  -4.644  -7.733  -0.433
  228   1HG2  THR  30          3HG2      THR  30  -2.351  -7.702  -1.956
  229   2HG2  THR  30          1HG2      THR  30  -2.797  -6.339  -0.929
  230   3HG2  THR  30          2HG2      THR  30  -1.214  -7.095  -0.751
  231    H    SER  31           H        SER  31  -0.573 -10.834  -0.575
  232    HA   SER  31           HA       SER  31  -1.033 -12.877   1.383
  233   1HB   SER  31          1HB       SER  31   0.940 -12.344  -0.463
  234   2HB   SER  31          2HB       SER  31   1.762 -12.014   1.062
  235    HG   SER  31           HG       SER  31   1.827 -14.065   1.400
  236    H    GLY  32           H        GLY  32   1.394 -12.537   2.977
  237   1HA   GLY  32          2HA       GLY  32   0.303 -10.610   4.939
  238   2HA   GLY  32          1HA       GLY  32   1.500 -11.835   5.277
  239    H    LYS  33           H        LYS  33   1.839  -9.822   2.447
  240    HA   LYS  33           HA       LYS  33   4.413  -8.850   3.410
  241   1HB   LYS  33          2HB       LYS  33   2.902  -7.906   0.967
  242   2HB   LYS  33          1HB       LYS  33   4.623  -7.815   1.251
  243   1HG   LYS  33          1HG       LYS  33   4.385 -10.439   1.513
  244   2HG   LYS  33          2HG       LYS  33   2.952 -10.188   0.546
  245   1HD   LYS  33          1HD       LYS  33   5.376  -8.791  -0.405
  246   2HD   LYS  33          2HD       LYS  33   5.428 -10.534  -0.514
  247   1HE   LYS  33          1HE       LYS  33   3.121  -8.878  -1.554
  248   2HE   LYS  33          2HE       LYS  33   4.478  -9.388  -2.558
  249   1HZ   LYS  33          1HZ       LYS  33   3.195 -11.465  -0.982
  250   2HZ   LYS  33          2HZ       LYS  33   2.272 -10.825  -2.256
  251   3HZ   LYS  33          3HZ       LYS  33   3.790 -11.516  -2.572
  252    H    CYS  34           H        CYS  34   1.674  -6.957   2.105
  253    HA   CYS  34           HA       CYS  34   2.466  -4.663   3.736
  254   1HB   CYS  34          1HB       CYS  34   0.369  -3.619   2.765
  255   2HB   CYS  34          2HB       CYS  34   1.555  -4.147   1.574
  256    H    SER  35           H        SER  35   0.811  -3.577   5.179
  257    HA   SER  35           HA       SER  35  -0.408  -5.642   6.918
  258   1HB   SER  35          1HB       SER  35  -0.643  -2.814   7.714
  259   2HB   SER  35          2HB       SER  35  -0.049  -4.196   8.634
  260    HG   SER  35           HG       SER  35   1.308  -2.444   6.951
  261    H    ASN  36           H        ASN  36  -1.625  -4.866   4.308
  262    HA   ASN  36           HA       ASN  36  -4.267  -3.988   5.388
  263   1HB   ASN  36          2HB       ASN  36  -2.672  -2.856   3.179
  264   2HB   ASN  36          1HB       ASN  36  -4.348  -3.154   2.783
  265   1HD2  ASN  36          1HD2      ASN  36  -5.791  -0.766   4.310
  266   2HD2  ASN  36          2HD2      ASN  36  -5.793  -2.191   5.232
  267    HA   PRO  37           HA       PRO  37  -4.260  -8.113   3.104
  268   1HB   PRO  37          1HB       PRO  37  -5.982  -9.069   5.227
  269   2HB   PRO  37          2HB       PRO  37  -4.364  -9.635   4.797
  270   1HG   PRO  37          1HG       PRO  37  -5.126  -8.062   7.088
  271   2HG   PRO  37          2HG       PRO  37  -3.504  -8.601   6.641
  272   1HD   PRO  37          2HD       PRO  37  -4.579  -5.930   6.502
  273   2HD   PRO  37          1HD       PRO  37  -2.954  -6.473   6.048
  274    H    ALA  38           H        ALA  38  -5.989  -8.685   1.773
  275    HA   ALA  38           HA       ALA  38  -8.751  -8.255   2.308
  276   1HB   ALA  38          1HB       ALA  38  -8.040  -5.843   2.237
  277   2HB   ALA  38          2HB       ALA  38  -7.497  -6.088   0.579
  278   3HB   ALA  38          3HB       ALA  38  -9.206  -6.248   0.982
  279    H    VAL  39           H        VAL  39  -9.112  -7.304  -0.635
  280    HA   VAL  39           HA       VAL  39  -7.870  -9.456  -2.182
  281    HB   VAL  39           HB       VAL  39 -10.252 -10.089  -3.053
  282   1HG1  VAL  39          3HG1      VAL  39  -8.499 -11.194  -1.168
  283   2HG1  VAL  39          1HG1      VAL  39 -10.100 -11.332  -0.440
  284   3HG1  VAL  39          2HG1      VAL  39  -9.790 -12.031  -2.029
  285   1HG2  VAL  39          2HG2      VAL  39 -11.262  -8.261  -1.551
  286   2HG2  VAL  39          3HG2      VAL  39 -12.062  -9.830  -1.559
  287   3HG2  VAL  39          1HG2      VAL  39 -11.005  -9.384  -0.220
  288    H    VAL  40           H        VAL  40  -7.039  -7.879  -3.466
  289    HA   VAL  40           HA       VAL  40  -8.468  -5.559  -4.270
  290    HB   VAL  40           HB       VAL  40  -5.923  -6.888  -4.972
  291   1HG1  VAL  40          1HG1      VAL  40  -6.875  -6.472  -7.226
  292   2HG1  VAL  40          2HG1      VAL  40  -7.155  -4.791  -6.780
  293   3HG1  VAL  40          3HG1      VAL  40  -5.508  -5.410  -6.892
  294   1HG2  VAL  40          3HG2      VAL  40  -6.964  -4.174  -4.194
  295   2HG2  VAL  40          1HG2      VAL  40  -5.816  -5.203  -3.334
  296   3HG2  VAL  40          2HG2      VAL  40  -5.315  -4.355  -4.798
  297    H    PHE  41           H        PHE  41 -10.280  -5.618  -5.417
  298    HA   PHE  41           HA       PHE  41 -10.871  -7.824  -7.191
  299   1HB   PHE  41          1HB       PHE  41 -12.275  -5.289  -6.399
  300   2HB   PHE  41          2HB       PHE  41 -12.842  -6.195  -7.798
  301    HD1  PHE  41           HD2      PHE  41 -12.429  -8.995  -7.018
  302    HD2  PHE  41           HD1      PHE  41 -13.805  -5.657  -4.661
  303    HE1  PHE  41           HE2      PHE  41 -13.717 -10.557  -5.566
  304    HE2  PHE  41           HE1      PHE  41 -15.078  -7.216  -3.202
  305    HZ   PHE  41           HZ       PHE  41 -15.057  -9.665  -3.656
  306    H    VAL  42           H        VAL  42 -11.075  -7.785  -9.329
  307    HA   VAL  42           HA       VAL  42  -9.848  -5.499 -10.813
  308    HB   VAL  42           HB       VAL  42  -9.409  -7.839 -12.313
  309   1HG1  VAL  42          3HG2      VAL  42  -7.622  -6.153 -10.554
  310   2HG1  VAL  42          1HG2      VAL  42  -7.006  -7.325 -11.721
  311   3HG1  VAL  42          2HG2      VAL  42  -7.924  -5.928 -12.279
  312   1HG2  VAL  42          3HG1      VAL  42  -8.562  -8.236  -9.434
  313   2HG2  VAL  42          1HG1      VAL  42  -9.736  -9.206 -10.311
  314   3HG2  VAL  42          2HG1      VAL  42  -8.047  -9.234 -10.795
  315    H    THR  43           H        THR  43 -12.128  -4.879 -11.042
  316    HA   THR  43           HA       THR  43 -14.046  -6.762 -12.193
  317    HB   THR  43           HB       THR  43 -15.676  -5.080 -11.817
  318    HG1  THR  43           HG1      THR  43 -15.188  -2.953 -11.739
  319   1HG2  THR  43          1HG2      THR  43 -14.551  -5.989  -9.754
  320   2HG2  THR  43          2HG2      THR  43 -13.533  -4.551  -9.742
  321   3HG2  THR  43          3HG2      THR  43 -15.278  -4.398  -9.533
  322    H    ARG  44           H        ARG  44 -15.598  -4.992 -13.752
  323    HA   ARG  44           HA       ARG  44 -14.757  -5.577 -16.317
  324   1HB   ARG  44          1HB       ARG  44 -16.143  -3.447 -16.958
  325   2HB   ARG  44          2HB       ARG  44 -16.954  -4.801 -16.223
  326   1HG   ARG  44          1HG       ARG  44 -17.622  -3.503 -14.515
  327   2HG   ARG  44          2HG       ARG  44 -15.949  -3.116 -14.129
  328   1HD   ARG  44          1HD       ARG  44 -16.443  -1.000 -14.750
  329   2HD   ARG  44          2HD       ARG  44 -16.450  -1.604 -16.407
  330    HE   ARG  44           HE       ARG  44 -19.008  -2.147 -15.411
  331   1HH1  ARG  44          1HH2      ARG  44 -18.358   0.651 -14.004
  332   2HH1  ARG  44          2HH2      ARG  44 -19.807   1.200 -14.778
  333   1HH2  ARG  44          1HH1      ARG  44 -19.728  -0.209 -17.525
  334   2HH2  ARG  44          2HH1      ARG  44 -18.388   0.881 -17.397
  335    H    LYS  45           H        LYS  45 -14.400  -2.297 -14.870
  336    HA   LYS  45           HA       LYS  45 -12.520  -1.361 -16.822
  337   1HB   LYS  45          2HB       LYS  45 -13.573   0.181 -15.208
  338   2HB   LYS  45          1HB       LYS  45 -12.757  -0.638 -13.877
  339   1HG   LYS  45          1HG       LYS  45 -10.643   0.162 -14.516
  340   2HG   LYS  45          2HG       LYS  45 -11.164   0.496 -16.167
  341   1HD   LYS  45          1HD       LYS  45 -12.752   2.237 -15.139
  342   2HD   LYS  45          2HD       LYS  45 -11.819   2.043 -13.654
  343   1HE   LYS  45          1HE       LYS  45 -10.352   2.525 -16.225
  344   2HE   LYS  45          2HE       LYS  45 -11.141   3.887 -15.430
  345   1HZ   LYS  45          3HZ       LYS  45  -9.561   2.131 -13.732
  346   2HZ   LYS  45          1HZ       LYS  45  -8.691   3.090 -14.832
  347   3HZ   LYS  45          2HZ       LYS  45  -9.724   3.821 -13.697
  348    H    ASN  46           H        ASN  46 -12.340  -3.363 -14.006
  349    HA   ASN  46           HA       ASN  46 -10.786  -4.874 -13.261
  350   1HB   ASN  46          2HB       ASN  46 -10.108  -4.431 -16.053
  351   2HB   ASN  46          1HB       ASN  46  -8.659  -4.689 -15.117
  352   1HD2  ASN  46          1HD2      ASN  46  -9.417  -7.885 -16.184
  353   2HD2  ASN  46          2HD2      ASN  46 -10.376  -6.749 -17.002
  354    H    ARG  47           H        ARG  47 -10.523  -1.810 -12.935
  355    HA   ARG  47           HA       ARG  47  -7.730  -1.308 -12.438
  356   1HB   ARG  47          1HB       ARG  47  -8.728   0.143 -10.492
  357   2HB   ARG  47          2HB       ARG  47  -9.050   0.640 -12.151
  358   1HG   ARG  47          1HG       ARG  47 -11.278   0.172 -11.968
  359   2HG   ARG  47          2HG       ARG  47 -10.988  -1.292 -11.027
  360   1HD   ARG  47          1HD       ARG  47 -11.176  -0.195  -9.040
  361   2HD   ARG  47          2HD       ARG  47 -10.296   1.215  -9.630
  362    HE   ARG  47           HE       ARG  47 -12.884   1.108 -10.866
  363   1HH1  ARG  47          1HH1      ARG  47 -11.750   3.615  -9.746
  364   2HH1  ARG  47          2HH1      ARG  47 -12.548   3.810  -8.221
  365   1HH2  ARG  47          2HH2      ARG  47 -14.683   1.712  -8.502
  366   2HH2  ARG  47          1HH2      ARG  47 -13.442   1.221  -7.398
  367    H    GLN  48           H        GLN  48  -6.748  -1.521 -10.120
  368    HA   GLN  48           HA       GLN  48  -7.679  -4.121  -9.164
  369   1HB   GLN  48          2HB       GLN  48  -5.171  -2.593  -8.919
  370   2HB   GLN  48          1HB       GLN  48  -5.604  -3.577  -7.513
  371   1HG   GLN  48          1HG       GLN  48  -5.959  -5.514  -8.990
  372   2HG   GLN  48          2HG       GLN  48  -5.562  -4.554 -10.385
  373   1HE2  GLN  48          1HE2      GLN  48  -3.046  -5.334  -7.348
  374   2HE2  GLN  48          2HE2      GLN  48  -3.713  -6.698  -8.107
  375    H    VAL  49           H        VAL  49  -9.644  -2.981  -8.628
  376    HA   VAL  49           HA       VAL  49 -10.102  -1.133  -6.625
  377    HB   VAL  49           HB       VAL  49 -11.944  -3.415  -6.497
  378   1HG1  VAL  49          3HG1      VAL  49 -12.135  -0.465  -7.079
  379   2HG1  VAL  49          1HG1      VAL  49 -13.541  -1.528  -7.042
  380   3HG1  VAL  49          2HG1      VAL  49 -12.569  -1.299  -5.586
  381   1HG2  VAL  49          2HG2      VAL  49 -11.303  -2.134  -9.176
  382   2HG2  VAL  49          3HG2      VAL  49 -11.532  -3.844  -8.829
  383   3HG2  VAL  49          1HG2      VAL  49 -12.914  -2.752  -8.830
  384    H    CYS  50           H        CYS  50 -11.118  -1.822  -4.371
  385    HA   CYS  50           HA       CYS  50  -9.282  -3.842  -3.145
  386   1HB   CYS  50          2HB       CYS  50  -8.755  -1.482  -2.544
  387   2HB   CYS  50          1HB       CYS  50 -10.367  -1.310  -1.892
  388    H    ALA  51           H        ALA  51 -10.173  -5.137  -1.471
  389    HA   ALA  51           HA       ALA  51 -12.970  -4.733  -0.675
  390   1HB   ALA  51          1HB       ALA  51 -12.220  -6.664  -2.739
  391   2HB   ALA  51          2HB       ALA  51 -13.012  -7.432  -1.362
  392   3HB   ALA  51          3HB       ALA  51 -13.822  -6.128  -2.229
  393    H    ASN  52           H        ASN  52 -12.646  -4.739   1.345
  394    HA   ASN  52           HA       ASN  52 -10.719  -5.759   2.972
  395   1HB   ASN  52          1HB       ASN  52 -12.570  -4.328   3.662
  396   2HB   ASN  52          2HB       ASN  52 -13.712  -5.639   3.394
  397   1HD2  ASN  52          1HD2      ASN  52 -11.850  -5.160   6.874
  398   2HD2  ASN  52          2HD2      ASN  52 -10.844  -4.833   5.547
  399    HA   PRO  53           HA       PRO  53 -11.109 -10.178   2.839
  400   1HB   PRO  53          1HB       PRO  53  -9.874 -10.657   5.326
  401   2HB   PRO  53          2HB       PRO  53  -9.044 -10.512   3.772
  402   1HG   PRO  53          1HG       PRO  53  -9.083  -8.626   6.016
  403   2HG   PRO  53          2HG       PRO  53  -8.045  -8.626   4.588
  404   1HD   PRO  53          2HD       PRO  53 -10.282  -6.914   5.114
  405   2HD   PRO  53          1HD       PRO  53  -9.298  -6.960   3.659
  406    H    GLU  54           H        GLU  54 -11.774  -8.617   6.000
  407    HA   GLU  54           HA       GLU  54 -13.731 -10.773   6.601
  408   1HB   GLU  54          1HB       GLU  54 -12.801  -8.563   8.445
  409   2HB   GLU  54          2HB       GLU  54 -13.596 -10.073   8.889
  410   1HG   GLU  54          1HG       GLU  54 -10.901  -9.943   7.510
  411   2HG   GLU  54          2HG       GLU  54 -11.096 -10.068   9.258
  412    H    LYS  55           H        LYS  55 -14.745  -9.147   4.652
  413    HA   LYS  55           HA       LYS  55 -16.625  -7.350   6.134
  414   1HB   LYS  55          2HB       LYS  55 -15.102  -6.872   3.795
  415   2HB   LYS  55          1HB       LYS  55 -16.770  -6.980   3.292
  416   1HG   LYS  55          1HG       LYS  55 -17.438  -5.264   4.834
  417   2HG   LYS  55          2HG       LYS  55 -15.868  -5.297   5.636
  418   1HD   LYS  55          1HD       LYS  55 -14.869  -4.030   4.018
  419   2HD   LYS  55          2HD       LYS  55 -15.797  -4.780   2.719
  420   1HE   LYS  55          1HE       LYS  55 -17.282  -3.086   2.727
  421   2HE   LYS  55          2HE       LYS  55 -17.551  -3.274   4.460
  422   1HZ   LYS  55          2HZ       LYS  55 -15.126  -1.943   3.431
  423   2HZ   LYS  55          3HZ       LYS  55 -16.578  -1.083   3.623
  424   3HZ   LYS  55          1HZ       LYS  55 -15.840  -1.814   4.966
  425    H    LYS  56           H        LYS  56 -16.705 -10.326   5.670
  426    HA   LYS  56           HA       LYS  56 -18.327 -11.935   5.220
  427   1HB   LYS  56          1HB       LYS  56 -20.000  -9.423   5.267
  428   2HB   LYS  56          2HB       LYS  56 -20.711 -11.011   4.987
  429   1HG   LYS  56          1HG       LYS  56 -18.847 -10.935   7.262
  430   2HG   LYS  56          2HG       LYS  56 -20.261  -9.901   7.470
  431   1HD   LYS  56          1HD       LYS  56 -21.694 -11.868   6.806
  432   2HD   LYS  56          2HD       LYS  56 -20.242 -12.866   6.840
  433   1HE   LYS  56          1HE       LYS  56 -20.975 -13.191   9.009
  434   2HE   LYS  56          2HE       LYS  56 -19.981 -11.754   9.252
  435   1HZ   LYS  56          3HZ       LYS  56 -22.808 -11.451   8.508
  436   2HZ   LYS  56          1HZ       LYS  56 -22.405 -11.808  10.120
  437   3HZ   LYS  56          2HZ       LYS  56 -21.807 -10.397   9.386
  438    H    TRP  57           H        TRP  57 -19.997  -9.561   3.215
  439    HA   TRP  57           HA       TRP  57 -20.377 -11.174   1.003
  440   1HB   TRP  57          1HB       TRP  57 -20.771  -9.168  -0.279
  441   2HB   TRP  57          2HB       TRP  57 -21.382  -8.918   1.358
  442    HD1  TRP  57           HD1      TRP  57 -20.329  -6.918   2.675
  443    HE1  TRP  57           HE1      TRP  57 -18.585  -5.130   2.028
  444    HE3  TRP  57           HE3      TRP  57 -18.577  -9.005  -1.590
  445    HZ2  TRP  57           HZ2      TRP  57 -16.572  -4.732  -0.015
  446    HZ3  TRP  57           HZ3      TRP  57 -16.849  -7.905  -2.928
  447    HH2  TRP  57           HH2      TRP  57 -15.831  -5.763  -2.154
  448    H    VAL  58           H        VAL  58 -17.468  -9.169   1.555
  449    HA   VAL  58           HA       VAL  58 -16.214  -9.534  -0.923
  450    HB   VAL  58           HB       VAL  58 -14.030  -9.641   0.461
  451   1HG1  VAL  58          2HG1      VAL  58 -14.935  -7.602  -0.579
  452   2HG1  VAL  58          3HG1      VAL  58 -15.951  -7.345   0.839
  453   3HG1  VAL  58          1HG1      VAL  58 -14.202  -7.244   0.980
  454   1HG2  VAL  58          1HG2      VAL  58 -16.017  -9.951   2.516
  455   2HG2  VAL  58          2HG2      VAL  58 -14.267 -10.059   2.632
  456   3HG2  VAL  58          3HG2      VAL  58 -15.066  -8.500   2.790
  457    H    ARG  59           H        ARG  59 -15.820 -11.727   1.901
  458    HA   ARG  59           HA       ARG  59 -14.303 -13.661   0.423
  459   1HB   ARG  59          2HB       ARG  59 -14.898 -15.187   2.340
  460   2HB   ARG  59          1HB       ARG  59 -14.176 -13.675   2.830
  461   1HG   ARG  59          1HG       ARG  59 -16.291 -12.764   3.470
  462   2HG   ARG  59          2HG       ARG  59 -17.164 -14.053   2.677
  463   1HD   ARG  59          1HD       ARG  59 -15.481 -14.228   5.180
  464   2HD   ARG  59          2HD       ARG  59 -17.200 -14.583   5.008
  465    HE   ARG  59           HE       ARG  59 -15.000 -16.296   3.941
  466   1HH1  ARG  59          2HH2      ARG  59 -17.920 -16.359   2.680
  467   2HH1  ARG  59          1HH2      ARG  59 -18.810 -17.154   3.935
  468   1HH2  ARG  59          2HH1      ARG  59 -16.127 -18.783   4.672
  469   2HH2  ARG  59          1HH1      ARG  59 -17.100 -18.062   5.909
  470    H    GLU  60           H        GLU  60 -17.750 -13.225   0.981
  471    HA   GLU  60           HA       GLU  60 -18.477 -15.791  -0.217
  472   1HB   GLU  60          1HB       GLU  60 -19.876 -13.509   0.994
  473   2HB   GLU  60          2HB       GLU  60 -20.732 -14.208  -0.359
  474   1HG   GLU  60          1HG       GLU  60 -20.023 -16.476   0.887
  475   2HG   GLU  60          2HG       GLU  60 -20.063 -15.415   2.274
  476    H    TYR  61           H        TYR  61 -17.276 -12.943  -1.459
  477    HA   TYR  61           HA       TYR  61 -18.756 -13.132  -4.020
  478   1HB   TYR  61          2HB       TYR  61 -17.097 -11.050  -2.645
  479   2HB   TYR  61          1HB       TYR  61 -17.198 -11.005  -4.378
  480    HD1  TYR  61           HD1      TYR  61 -19.839 -12.158  -2.001
  481    HD2  TYR  61           HD2      TYR  61 -18.566  -9.073  -4.738
  482    HE1  TYR  61           HE1      TYR  61 -22.048 -11.035  -1.759
  483    HE2  TYR  61           HE2      TYR  61 -20.783  -7.952  -4.500
  484    HH   TYR  61           HH       TYR  61 -22.653  -7.853  -3.064
  485    H    ILE  62           H        ILE  62 -15.599 -13.520  -2.534
  486    HA   ILE  62           HA       ILE  62 -14.029 -13.752  -4.908
  487    HB   ILE  62           HB       ILE  62 -13.686 -15.040  -2.179
  488   1HG1  ILE  62          1HG1      ILE  62 -13.667 -12.594  -2.120
  489   2HG1  ILE  62          2HG1      ILE  62 -12.053 -13.200  -1.859
  490   1HG2  ILE  62          2HG2      ILE  62 -12.138 -15.224  -4.681
  491   2HG2  ILE  62          3HG2      ILE  62 -11.183 -14.787  -3.264
  492   3HG2  ILE  62          1HG2      ILE  62 -12.124 -16.278  -3.267
  493   1HD1  ILE  62          2HD1      ILE  62 -12.206 -12.971  -4.621
  494   2HD1  ILE  62          3HD1      ILE  62 -13.084 -11.557  -4.040
  495   3HD1  ILE  62          1HD1      ILE  62 -11.416 -11.825  -3.537
  496    H    ASN  63           H        ASN  63 -15.677 -16.244  -2.940
  497    HA   ASN  63           HA       ASN  63 -14.952 -18.400  -4.734
  498   1HB   ASN  63          2HB       ASN  63 -15.994 -18.255  -2.186
  499   2HB   ASN  63          1HB       ASN  63 -17.373 -18.788  -3.116
  500   1HD2  ASN  63          2HD2      ASN  63 -15.252 -21.721  -2.051
  501   2HD2  ASN  63          1HD2      ASN  63 -16.490 -20.737  -1.435
  502    H    SER  64           H        SER  64 -17.742 -16.247  -4.426
  503    HA   SER  64           HA       SER  64 -19.402 -17.676  -6.307
  504   1HB   SER  64          1HB       SER  64 -20.508 -16.165  -4.829
  505   2HB   SER  64          2HB       SER  64 -19.427 -14.839  -5.261
  506    HG   SER  64           HG       SER  64 -21.133 -16.133  -7.111
  507    H    LEU  65           H        LEU  65 -16.680 -15.588  -6.681
  508    HA   LEU  65           HA       LEU  65 -17.192 -14.337  -9.150
  509   1HB   LEU  65          2HB       LEU  65 -14.748 -15.261  -7.731
  510   2HB   LEU  65          1HB       LEU  65 -14.579 -14.908  -9.433
  511    HG   LEU  65           HG       LEU  65 -15.813 -13.015  -7.418
  512   1HD1  LEU  65          3HD1      LEU  65 -13.033 -13.582  -8.127
  513   2HD1  LEU  65          1HD1      LEU  65 -13.464 -11.894  -8.398
  514   3HD1  LEU  65          2HD1      LEU  65 -13.675 -12.612  -6.802
  515   1HD2  LEU  65          3HD2      LEU  65 -15.584 -13.081 -10.339
  516   2HD2  LEU  65          1HD2      LEU  65 -16.608 -12.072  -9.317
  517   3HD2  LEU  65          2HD2      LEU  65 -14.939 -11.598  -9.635
  518    H    GLU  66           H        GLU  66 -15.690 -17.549  -8.622
  519    HA   GLU  66           HA       GLU  66 -15.664 -19.439 -10.016
  520   1HB   GLU  66          1HB       GLU  66 -18.185 -18.225 -10.419
  521   2HB   GLU  66          2HB       GLU  66 -17.564 -18.603 -12.025
  522   1HG   GLU  66          1HG       GLU  66 -17.501 -20.886 -11.612
  523   2HG   GLU  66          2HG       GLU  66 -17.308 -20.671  -9.872
  524    H    MET  67           H        MET  67 -14.156 -19.867 -11.564
  525    HA   MET  67           HA       MET  67 -13.264 -17.638 -13.288
  526   1HB   MET  67          1HB       MET  67 -12.124 -20.261 -12.415
  527   2HB   MET  67          2HB       MET  67 -11.559 -19.579 -13.940
  528   1HG   MET  67          1HG       MET  67 -11.572 -17.406 -12.184
  529   2HG   MET  67          2HG       MET  67 -10.966 -18.744 -11.207
  530   1HE   MET  67          1HE       MET  67  -9.622 -20.641 -12.827
  531   2HE   MET  67          3HE       MET  67  -7.969 -20.099 -13.117
  532   3HE   MET  67          2HE       MET  67  -8.687 -19.919 -11.517
  533    H    SER  68           H        SER  68 -14.548 -20.942 -13.599
  534    HA   SER  68           HA       SER  68 -15.739 -20.268 -16.173
  535   1HB   SER  68          1HB       SER  68 -13.218 -21.865 -16.001
  536   2HB   SER  68          2HB       SER  68 -14.443 -22.385 -17.159
  537    HG   SER  68           HG       SER  68 -14.458 -20.091 -17.816
  538    H    SER   1           H        SER   1  -4.204  13.152  -6.727
  539    HA   SER   1           HA       SER   1  -6.981  13.638  -7.006
  540   1HB   SER   1          1HB       SER   1  -5.652  12.665  -9.429
  541   2HB   SER   1          2HB       SER   1  -6.974  11.620  -8.910
  542    HG   SER   1           HG       SER   1  -8.303  13.078  -9.571
  543    HA   PRO   2           HA       PRO   2  -5.451  10.032  -4.471
  544   1HB   PRO   2          1HB       PRO   2  -7.257  10.938  -2.409
  545   2HB   PRO   2          2HB       PRO   2  -5.491  10.911  -2.369
  546   1HG   PRO   2          1HG       PRO   2  -7.217  13.210  -2.618
  547   2HG   PRO   2          2HG       PRO   2  -5.450  13.183  -2.582
  548   1HD   PRO   2          1HD       PRO   2  -7.167  13.686  -4.846
  549   2HD   PRO   2          2HD       PRO   2  -5.394  13.660  -4.809
  550    H    TYR   3           H        TYR   3  -6.557   8.121  -4.696
  551    HA   TYR   3           HA       TYR   3  -9.496   8.290  -5.204
  552   1HB   TYR   3          1HB       TYR   3  -7.340   6.858  -6.492
  553   2HB   TYR   3          2HB       TYR   3  -8.545   5.719  -5.889
  554    HD1  TYR   3           HD2      TYR   3  -8.917   9.237  -7.157
  555    HD2  TYR   3           HD1      TYR   3  -9.856   5.064  -7.738
  556    HE1  TYR   3           HE2      TYR   3 -10.430   9.841  -9.043
  557    HE2  TYR   3           HE1      TYR   3 -11.369   5.667  -9.624
  558    HH   TYR   3           HH       TYR   3 -12.552   7.484 -10.530
  559    H    SER   4           H        SER   4  -7.077   6.122  -3.686
  560    HA   SER   4           HA       SER   4  -7.289   4.698  -1.832
  561   1HB   SER   4          1HB       SER   4  -9.615   6.207  -0.763
  562   2HB   SER   4          2HB       SER   4  -8.119   5.728   0.039
  563    HG   SER   4           HG       SER   4  -7.875   7.854  -0.212
  564    H    SER   5           H        SER   5  -8.187   3.130  -3.458
  565    HA   SER   5           HA       SER   5 -10.636   1.959  -2.479
  566   1HB   SER   5          1HB       SER   5 -11.918   2.184  -4.628
  567   2HB   SER   5          2HB       SER   5 -11.711   3.712  -3.772
  568    HG   SER   5           HG       SER   5 -11.231   3.768  -6.064
  569    H    ASP   6           H        ASP   6  -8.316   2.199  -5.149
  570    HA   ASP   6           HA       ASP   6  -8.575  -0.746  -5.586
  571   1HB   ASP   6          1HB       ASP   6  -7.447  -0.331  -7.727
  572   2HB   ASP   6          2HB       ASP   6  -8.815   0.765  -7.572
  573    H    THR   7           H        THR   7  -5.860  -0.825  -6.796
  574    HA   THR   7           HA       THR   7  -4.455  -1.298  -4.297
  575    HB   THR   7           HB       THR   7  -4.206  -2.825  -6.240
  576    HG1  THR   7           HG1      THR   7  -2.256  -3.205  -5.586
  577   1HG2  THR   7          1HG2      THR   7  -4.233  -0.763  -7.855
  578   2HG2  THR   7          2HG2      THR   7  -2.496  -0.726  -7.554
  579   3HG2  THR   7          3HG2      THR   7  -3.236  -2.158  -8.268
  580    H    THR   8           H        THR   8  -2.048  -0.492  -4.233
  581    HA   THR   8           HA       THR   8  -1.792   2.256  -5.331
  582    HB   THR   8           HB       THR   8  -1.288   1.667  -2.404
  583    HG1  THR   8           HG1      THR   8  -3.541   2.850  -3.655
  584   1HG2  THR   8          3HG2      THR   8  -0.199   3.626  -3.739
  585   2HG2  THR   8          1HG2      THR   8  -1.814   4.335  -3.700
  586   3HG2  THR   8          2HG2      THR   8  -0.966   3.987  -2.193
  587    HA   PRO   9           HA       PRO   9   2.188   0.375  -6.100
  588   1HB   PRO   9          1HB       PRO   9   3.214   2.956  -6.880
  589   2HB   PRO   9          2HB       PRO   9   2.761   1.609  -7.927
  590   1HG   PRO   9          2HG       PRO   9   1.343   4.097  -7.532
  591   2HG   PRO   9          1HG       PRO   9   0.897   2.755  -8.587
  592   1HD   PRO   9          1HD       PRO   9  -0.334   3.542  -6.129
  593   2HD   PRO   9          2HD       PRO   9  -0.769   2.197  -7.171
  594    H    CYS  10           H        CYS  10   3.704   0.049  -4.528
  595    HA   CYS  10           HA       CYS  10   5.032   2.215  -3.148
  596   1HB   CYS  10          2HB       CYS  10   2.958   2.318  -1.886
  597   2HB   CYS  10          1HB       CYS  10   2.966   0.593  -1.640
  598    H    CYS  11           H        CYS  11   6.849   1.474  -2.024
  599    HA   CYS  11           HA       CYS  11   7.666  -1.204  -2.777
  600   1HB   CYS  11          2HB       CYS  11   9.451   0.289  -2.901
  601   2HB   CYS  11          1HB       CYS  11   9.006   1.125  -1.446
  602    H    PHE  12           H        PHE  12   8.175  -2.907  -1.296
  603    HA   PHE  12           HA       PHE  12   6.735  -2.688   1.312
  604   1HB   PHE  12          2HB       PHE  12   5.868  -4.447  -0.159
  605   2HB   PHE  12          1HB       PHE  12   7.469  -5.117  -0.348
  606    HD1  PHE  12           HD2      PHE  12   5.910  -3.774   2.777
  607    HD2  PHE  12           HD1      PHE  12   7.268  -7.273   0.643
  608    HE1  PHE  12           HE2      PHE  12   5.573  -5.155   4.825
  609    HE2  PHE  12           HE1      PHE  12   6.929  -8.655   2.690
  610    HZ   PHE  12           HZ       PHE  12   6.081  -7.595   4.780
  611    H    ALA  13           H        ALA  13   9.794  -3.335  -0.231
  612    HA   ALA  13           HA       ALA  13  11.194  -3.081   2.313
  613   1HB   ALA  13          1HB       ALA  13  10.430  -5.653   1.649
  614   2HB   ALA  13          2HB       ALA  13  12.062  -5.553   0.984
  615   3HB   ALA  13          3HB       ALA  13  11.787  -5.240   2.698
  616    H    TYR  14           H        TYR  14  13.368  -2.535   1.997
  617    HA   TYR  14           HA       TYR  14  14.013  -1.982  -0.841
  618   1HB   TYR  14          1HB       TYR  14  16.000  -0.816   0.824
  619   2HB   TYR  14          2HB       TYR  14  14.764   0.009  -0.116
  620    HD1  TYR  14           HD2      TYR  14  15.623  -1.367   3.221
  621    HD2  TYR  14           HD1      TYR  14  12.741   0.875   0.917
  622    HE1  TYR  14           HE2      TYR  14  14.494  -0.653   5.326
  623    HE2  TYR  14           HE1      TYR  14  11.609   1.583   3.019
  624    HH   TYR  14           HH       TYR  14  11.441   1.133   5.265
  625    H    ILE  15           H        ILE  15  15.881  -2.813  -1.801
  626    HA   ILE  15           HA       ILE  15  16.991  -5.205  -0.593
  627    HB   ILE  15           HB       ILE  15  18.517  -5.130  -2.622
  628   1HG1  ILE  15          2HG1      ILE  15  16.760  -2.877  -3.573
  629   2HG1  ILE  15          1HG1      ILE  15  18.243  -2.532  -2.683
  630   1HG2  ILE  15          2HG2      ILE  15  16.136  -6.147  -2.470
  631   2HG2  ILE  15          3HG2      ILE  15  15.630  -4.741  -3.406
  632   3HG2  ILE  15          1HG2      ILE  15  16.809  -5.868  -4.076
  633   1HD1  ILE  15          3HD1      ILE  15  18.225  -4.385  -5.068
  634   2HD1  ILE  15          1HD1      ILE  15  18.417  -2.642  -5.254
  635   3HD1  ILE  15          2HD1      ILE  15  19.601  -3.565  -4.330
  636    H    ALA  16           H        ALA  16  19.554  -5.363  -0.714
  637    HA   ALA  16           HA       ALA  16  20.596  -3.018   0.817
  638   1HB   ALA  16          3HB       ALA  16  20.518  -5.216   2.014
  639   2HB   ALA  16          1HB       ALA  16  21.623  -5.869   0.806
  640   3HB   ALA  16          2HB       ALA  16  22.150  -4.564   1.869
  641    H    ARG  17           H        ARG  17  20.996  -2.042  -1.365
  642    HA   ARG  17           HA       ARG  17  23.723  -2.215  -2.125
  643   1HB   ARG  17          2HB       ARG  17  22.077  -4.272  -3.265
  644   2HB   ARG  17          1HB       ARG  17  22.601  -3.196  -4.537
  645   1HG   ARG  17          1HG       ARG  17  24.949  -3.394  -3.410
  646   2HG   ARG  17          2HG       ARG  17  24.273  -4.838  -2.654
  647   1HD   ARG  17          1HD       ARG  17  25.229  -5.684  -4.629
  648   2HD   ARG  17          2HD       ARG  17  23.537  -5.468  -5.076
  649    HE   ARG  17           HE       ARG  17  24.421  -3.147  -5.955
  650   1HH1  ARG  17          2HH1      ARG  17  27.333  -3.992  -5.512
  651   2HH1  ARG  17          1HH1      ARG  17  27.651  -5.085  -6.818
  652   1HH2  ARG  17          2HH2      ARG  17  24.674  -5.142  -8.200
  653   2HH2  ARG  17          1HH2      ARG  17  26.055  -4.224  -8.701
  654    HA   PRO  18           HA       PRO  18  21.690   1.634  -3.417
  655   1HB   PRO  18          2HB       PRO  18  24.299   2.592  -4.199
  656   2HB   PRO  18          1HB       PRO  18  23.310   3.113  -2.838
  657   1HG   PRO  18          2HG       PRO  18  25.677   1.458  -2.763
  658   2HG   PRO  18          1HG       PRO  18  24.729   2.044  -1.414
  659   1HD   PRO  18          1HD       PRO  18  24.858  -0.630  -2.359
  660   2HD   PRO  18          2HD       PRO  18  23.775  -0.006  -1.128
  661    H    LEU  19           H        LEU  19  20.765   1.749  -5.405
  662    HA   LEU  19           HA       LEU  19  21.971   0.373  -7.688
  663   1HB   LEU  19          1HB       LEU  19  19.590   2.205  -7.855
  664   2HB   LEU  19          2HB       LEU  19  19.946   0.801  -8.827
  665    HG   LEU  19           HG       LEU  19  19.193   0.778  -5.893
  666   1HD1  LEU  19          2HD1      LEU  19  17.399   1.251  -7.667
  667   2HD1  LEU  19          3HD1      LEU  19  17.684  -0.395  -8.233
  668   3HD1  LEU  19          1HD1      LEU  19  17.101  -0.115  -6.592
  669   1HD2  LEU  19          1HD2      LEU  19  20.689  -1.091  -7.398
  670   2HD2  LEU  19          2HD2      LEU  19  19.980  -1.329  -5.800
  671   3HD2  LEU  19          3HD2      LEU  19  19.067  -1.768  -7.244
  672    HA   PRO  20           HA       PRO  20  24.340   4.011  -8.800
  673   1HB   PRO  20          1HB       PRO  20  24.510   3.016 -11.526
  674   2HB   PRO  20          2HB       PRO  20  25.789   3.113 -10.310
  675   1HG   PRO  20          1HG       PRO  20  24.439   0.753 -11.234
  676   2HG   PRO  20          2HG       PRO  20  25.657   0.861  -9.959
  677   1HD   PRO  20          1HD       PRO  20  22.829   0.363  -9.669
  678   2HD   PRO  20          2HD       PRO  20  24.053   0.469  -8.389
  679    H    ARG  21           H        ARG  21  23.318   5.911  -9.242
  680    HA   ARG  21           HA       ARG  21  20.759   6.238 -10.276
  681   1HB   ARG  21          2HB       ARG  21  21.270   8.571 -10.609
  682   2HB   ARG  21          1HB       ARG  21  22.155   8.028  -9.185
  683   1HG   ARG  21          2HG       ARG  21  23.406   8.081 -11.937
  684   2HG   ARG  21          1HG       ARG  21  23.470   9.450 -10.856
  685   1HD   ARG  21          2HD       ARG  21  24.341   7.677  -9.124
  686   2HD   ARG  21          1HD       ARG  21  24.742   6.760 -10.554
  687    HE   ARG  21           HE       ARG  21  26.226   8.995  -9.593
  688   1HH1  ARG  21          1HH1      ARG  21  25.348  10.504 -11.923
  689   2HH1  ARG  21          2HH1      ARG  21  25.823   9.606 -13.325
  690   1HH2  ARG  21          2HH2      ARG  21  27.038   7.155 -12.473
  691   2HH2  ARG  21          1HH2      ARG  21  28.191   8.290 -11.854
  692    H    ALA  22           H        ALA  22  23.708   5.685 -12.060
  693    HA   ALA  22           HA       ALA  22  22.705   6.533 -14.631
  694   1HB   ALA  22          1HB       ALA  22  25.050   5.012 -13.619
  695   2HB   ALA  22          2HB       ALA  22  24.580   4.694 -15.289
  696   3HB   ALA  22          3HB       ALA  22  24.986   6.334 -14.784
  697    H    HIS  23           H        HIS  23  22.965   3.337 -13.056
  698    HA   HIS  23           HA       HIS  23  21.739   1.882 -15.193
  699   1HB   HIS  23          2HB       HIS  23  21.753   1.266 -12.222
  700   2HB   HIS  23          1HB       HIS  23  21.351   0.123 -13.502
  701    HD2  HIS  23           HD2      HIS  23  24.375   2.426 -14.298
  702    HE1  HIS  23           HE1      HIS  23  25.932  -1.334 -13.155
  703    HE2  HIS  23           HE2      HIS  23  26.511   0.937 -14.143
  704    H    ILE  24           H        ILE  24  20.421   3.834 -12.591
  705    HA   ILE  24           HA       ILE  24  17.718   2.786 -12.981
  706    HB   ILE  24           HB       ILE  24  18.409   5.324 -11.541
  707   1HG1  ILE  24          2HG1      ILE  24  18.513   2.503 -10.458
  708   2HG1  ILE  24          1HG1      ILE  24  19.891   3.551 -10.685
  709   1HG2  ILE  24          3HG2      ILE  24  16.075   3.585 -11.855
  710   2HG2  ILE  24          1HG2      ILE  24  16.435   3.965 -10.173
  711   3HG2  ILE  24          2HG2      ILE  24  16.160   5.266 -11.331
  712   1HD1  ILE  24          1HD1      ILE  24  17.899   4.968  -9.181
  713   2HD1  ILE  24          2HD1      ILE  24  18.173   3.399  -8.424
  714   3HD1  ILE  24          3HD1      ILE  24  19.523   4.506  -8.676
  715    H    LYS  25           H        LYS  25  15.926   4.216 -13.686
  716    HA   LYS  25           HA       LYS  25  16.864   6.281 -15.643
  717   1HB   LYS  25          1HB       LYS  25  14.526   4.360 -15.838
  718   2HB   LYS  25          2HB       LYS  25  14.806   5.691 -16.960
  719   1HG   LYS  25          1HG       LYS  25  17.087   3.839 -16.442
  720   2HG   LYS  25          2HG       LYS  25  15.755   3.225 -17.421
  721   1HD   LYS  25          1HD       LYS  25  16.495   5.935 -18.194
  722   2HD   LYS  25          2HD       LYS  25  17.863   4.829 -18.318
  723   1HE   LYS  25          1HE       LYS  25  16.759   4.671 -20.419
  724   2HE   LYS  25          2HE       LYS  25  16.247   3.235 -19.531
  725   1HZ   LYS  25          2HZ       LYS  25  14.316   4.714 -18.769
  726   2HZ   LYS  25          3HZ       LYS  25  14.735   5.706 -20.083
  727   3HZ   LYS  25          1HZ       LYS  25  14.278   4.092 -20.349
  728    H    GLU  26           H        GLU  26  14.760   5.535 -12.990
  729    HA   GLU  26           HA       GLU  26  14.045   8.301 -12.611
  730   1HB   GLU  26          1HB       GLU  26  11.466   7.514 -12.707
  731   2HB   GLU  26          2HB       GLU  26  12.275   8.215 -14.091
  732   1HG   GLU  26          2HG       GLU  26  12.648   5.310 -13.869
  733   2HG   GLU  26          1HG       GLU  26  10.984   5.786 -14.075
  734    H    TYR  27           H        TYR  27  11.800   7.870 -10.922
  735    HA   TYR  27           HA       TYR  27  12.307   5.593  -9.201
  736   1HB   TYR  27          2HB       TYR  27  13.138   6.728  -7.284
  737   2HB   TYR  27          1HB       TYR  27  14.115   7.329  -8.618
  738    HD1  TYR  27           HD2      TYR  27  13.649   9.594  -9.611
  739    HD2  TYR  27           HD1      TYR  27  11.643   8.167  -6.064
  740    HE1  TYR  27           HE2      TYR  27  12.931  11.922  -9.080
  741    HE2  TYR  27           HE1      TYR  27  10.921  10.492  -5.535
  742    HH   TYR  27           HH       TYR  27  10.591  12.613  -6.619
  743    H    PHE  28           H        PHE  28  10.827   6.028  -7.075
  744    HA   PHE  28           HA       PHE  28   8.530   7.680  -7.859
  745   1HB   PHE  28          2HB       PHE  28   7.822   5.728  -8.951
  746   2HB   PHE  28          1HB       PHE  28   8.501   4.678  -7.714
  747    HD1  PHE  28           HD1      PHE  28   6.209   7.657  -7.492
  748    HD2  PHE  28           HD2      PHE  28   6.770   3.445  -6.742
  749    HE1  PHE  28           HE1      PHE  28   4.072   7.600  -6.211
  750    HE2  PHE  28           HE2      PHE  28   4.631   3.381  -5.479
  751    HZ   PHE  28           HZ       PHE  28   3.274   5.458  -5.214
  752    H    TYR  29           H        TYR  29   9.273   8.842  -5.905
  753    HA   TYR  29           HA       TYR  29   9.461   7.677  -3.340
  754   1HB   TYR  29          1HB       TYR  29  10.109  10.005  -3.808
  755   2HB   TYR  29          2HB       TYR  29   8.432  10.428  -4.042
  756    HD1  TYR  29           HD1      TYR  29   6.850  10.500  -2.154
  757    HD2  TYR  29           HD2      TYR  29  11.013   9.511  -1.582
  758    HE1  TYR  29           HE1      TYR  29   6.592  10.832   0.303
  759    HE2  TYR  29           HE2      TYR  29  10.755   9.844   0.874
  760    HH   TYR  29           HH       TYR  29   7.850  11.224   2.253
  761    H    THR  30           H        THR  30   7.990   6.916  -1.952
  762    HA   THR  30           HA       THR  30   5.181   6.766  -2.823
  763    HB   THR  30           HB       THR  30   5.327   5.651  -0.273
  764    HG1  THR  30           HG1      THR  30   7.648   4.967  -1.741
  765   1HG2  THR  30          3HG2      THR  30   5.257   4.734  -3.087
  766   2HG2  THR  30          1HG2      THR  30   5.779   3.525  -1.913
  767   3HG2  THR  30          2HG2      THR  30   4.208   4.305  -1.736
  768    H    SER  31           H        SER  31   3.562   8.037  -2.042
  769    HA   SER  31           HA       SER  31   4.143  10.331  -0.424
  770   1HB   SER  31          1HB       SER  31   2.053   9.556  -2.042
  771   2HB   SER  31          2HB       SER  31   1.336   9.445  -0.435
  772    HG   SER  31           HG       SER  31   1.285  11.524  -0.381
  773    H    GLY  32           H        GLY  32   1.829  10.228   1.361
  774   1HA   GLY  32          1HA       GLY  32   3.057   8.589   3.494
  775   2HA   GLY  32          2HA       GLY  32   1.880   9.854   3.738
  776    H    LYS  33           H        LYS  33   1.364   7.466   1.247
  777    HA   LYS  33           HA       LYS  33  -1.136   6.649   2.504
  778   1HB   LYS  33          1HB       LYS  33   0.214   5.368   0.121
  779   2HB   LYS  33          2HB       LYS  33  -1.483   5.324   0.529
  780   1HG   LYS  33          2HG       LYS  33  -1.243   7.958   0.408
  781   2HG   LYS  33          1HG       LYS  33   0.123   7.571  -0.609
  782   1HD   LYS  33          2HD       LYS  33  -2.353   6.065  -1.191
  783   2HD   LYS  33          1HD       LYS  33  -2.421   7.775  -1.538
  784   1HE   LYS  33          1HE       LYS  33  -0.180   5.980  -2.490
  785   2HE   LYS  33          2HE       LYS  33  -1.604   6.352  -3.462
  786   1HZ   LYS  33          1HZ       LYS  33  -0.229   8.622  -2.280
  787   2HZ   LYS  33          2HZ       LYS  33   0.611   7.806  -3.511
  788   3HZ   LYS  33          3HZ       LYS  33  -0.928   8.453  -3.818
  789    H    CYS  34           H        CYS  34   1.521   4.580   1.296
  790    HA   CYS  34           HA       CYS  34   0.850   2.539   3.280
  791   1HB   CYS  34          1HB       CYS  34   2.881   1.362   2.327
  792   2HB   CYS  34          2HB       CYS  34   1.618   1.724   1.155
  793    H    SER  35           H        SER  35   2.602   1.660   4.747
  794    HA   SER  35           HA       SER  35   3.924   3.941   6.094
  795   1HB   SER  35          1HB       SER  35   4.224   1.250   7.261
  796   2HB   SER  35          2HB       SER  35   3.687   2.750   8.017
  797    HG   SER  35           HG       SER  35   2.228   0.788   6.689
  798    H    ASN  36           H        ASN  36   4.967   2.803   3.545
  799    HA   ASN  36           HA       ASN  36   7.680   2.072   4.557
  800   1HB   ASN  36          1HB       ASN  36   5.947   0.651   2.639
  801   2HB   ASN  36          2HB       ASN  36   7.590   0.883   2.094
  802   1HD2  ASN  36          1HD2      ASN  36   9.144  -1.276   3.841
  803   2HD2  ASN  36          2HD2      ASN  36   9.200   0.264   4.551
  804    HA   PRO  37           HA       PRO  37   7.501   5.838   1.728
  805   1HB   PRO  37          1HB       PRO  37   9.356   7.074   3.575
  806   2HB   PRO  37          2HB       PRO  37   7.710   7.582   3.179
  807   1HG   PRO  37          1HG       PRO  37   8.630   6.340   5.611
  808   2HG   PRO  37          2HG       PRO  37   6.979   6.819   5.204
  809   1HD   PRO  37          2HD       PRO  37   8.055   4.150   5.368
  810   2HD   PRO  37          1HD       PRO  37   6.400   4.632   4.951
  811    H    ALA  38           H        ALA  38   9.133   6.211   0.217
  812    HA   ALA  38           HA       ALA  38  11.926   5.845   0.619
  813   1HB   ALA  38          1HB       ALA  38  11.219   3.451   0.932
  814   2HB   ALA  38          2HB       ALA  38  10.567   3.467  -0.705
  815   3HB   ALA  38          3HB       ALA  38  12.299   3.671  -0.441
  816    H    VAL  39           H        VAL  39  12.095   4.496  -2.179
  817    HA   VAL  39           HA       VAL  39  10.741   6.416  -3.924
  818    HB   VAL  39           HB       VAL  39  13.057   6.911  -5.032
  819   1HG1  VAL  39          3HG1      VAL  39  11.430   8.276  -3.204
  820   2HG1  VAL  39          1HG1      VAL  39  13.076   8.506  -2.614
  821   3HG1  VAL  39          2HG1      VAL  39  12.654   8.979  -4.261
  822   1HG2  VAL  39          2HG2      VAL  39  14.172   5.303  -3.361
  823   2HG2  VAL  39          3HG2      VAL  39  14.964   6.851  -3.642
  824   3HG2  VAL  39          1HG2      VAL  39  14.001   6.604  -2.185
  825    H    VAL  40           H        VAL  40   9.832   4.679  -4.916
  826    HA   VAL  40           HA       VAL  40  11.216   2.264  -5.484
  827    HB   VAL  40           HB       VAL  40   8.624   3.493  -6.194
  828   1HG1  VAL  40          1HG1      VAL  40   9.431   2.761  -8.424
  829   2HG1  VAL  40          2HG1      VAL  40   9.744   1.157  -7.765
  830   3HG1  VAL  40          3HG1      VAL  40   8.092   1.764  -7.857
  831   1HG2  VAL  40          3HG2      VAL  40   9.726   0.908  -5.115
  832   2HG2  VAL  40          1HG2      VAL  40   8.632   2.054  -4.332
  833   3HG2  VAL  40          2HG2      VAL  40   8.039   1.013  -5.627
  834    H    PHE  41           H        PHE  41  12.943   2.146  -6.750
  835    HA   PHE  41           HA       PHE  41  13.408   4.084  -8.847
  836   1HB   PHE  41          1HB       PHE  41  14.871   1.677  -7.805
  837   2HB   PHE  41          2HB       PHE  41  15.339   2.374  -9.353
  838    HD1  PHE  41           HD2      PHE  41  14.975   5.257  -8.950
  839    HD2  PHE  41           HD1      PHE  41  16.511   2.276  -6.241
  840    HE1  PHE  41           HE2      PHE  41  16.352   7.000  -7.821
  841    HE2  PHE  41           HE1      PHE  41  17.875   4.016  -5.104
  842    HZ   PHE  41           HZ       PHE  41  17.817   6.377  -5.896
  843    H    VAL  42           H        VAL  42  13.470   3.746 -10.968
  844    HA   VAL  42           HA       VAL  42  12.154   1.283 -12.033
  845    HB   VAL  42           HB       VAL  42  11.608   3.393 -13.812
  846   1HG1  VAL  42          3HG2      VAL  42   9.949   1.977 -11.720
  847   2HG1  VAL  42          1HG2      VAL  42   9.251   2.979 -12.994
  848   3HG1  VAL  42          2HG2      VAL  42  10.136   1.513 -13.414
  849   1HG2  VAL  42          3HG1      VAL  42  10.950   4.190 -10.966
  850   2HG2  VAL  42          1HG1      VAL  42  12.062   5.022 -12.042
  851   3HG2  VAL  42          2HG1      VAL  42  10.345   4.992 -12.417
  852    H    THR  43           H        THR  43  14.421   0.625 -12.326
  853    HA   THR  43           HA       THR  43  16.247   2.320 -13.859
  854    HB   THR  43           HB       THR  43  17.908   0.702 -13.361
  855    HG1  THR  43           HG1      THR  43  17.438  -1.394 -12.948
  856   1HG2  THR  43          1HG2      THR  43  16.904   1.884 -11.370
  857   2HG2  THR  43          2HG2      THR  43  15.914   0.452 -11.094
  858   3HG2  THR  43          3HG2      THR  43  17.671   0.345 -10.986
  859    H    ARG  44           H        ARG  44  17.696   0.336 -15.259
  860    HA   ARG  44           HA       ARG  44  16.676   0.563 -17.819
  861   1HB   ARG  44          2HB       ARG  44  17.999  -1.667 -18.244
  862   2HB   ARG  44          1HB       ARG  44  18.868  -0.225 -17.793
  863   1HG   ARG  44          1HG       ARG  44  19.667  -1.244 -15.953
  864   2HG   ARG  44          2HG       ARG  44  18.029  -1.572 -15.394
  865   1HD   ARG  44          1HD       ARG  44  18.495  -3.755 -15.734
  866   2HD   ARG  44          2HD       ARG  44  18.387  -3.402 -17.457
  867    HE   ARG  44           HE       ARG  44  21.001  -2.722 -16.720
  868   1HH1  ARG  44          1HH2      ARG  44  20.466  -5.294 -14.897
  869   2HH1  ARG  44          2HH2      ARG  44  21.862  -5.952 -15.683
  870   1HH2  ARG  44          1HH1      ARG  44  21.593  -4.940 -18.587
  871   2HH2  ARG  44          2HH1      ARG  44  20.270  -5.995 -18.220
  872    H    LYS  45           H        LYS  45  16.437  -2.481 -15.910
  873    HA   LYS  45           HA       LYS  45  14.428  -3.670 -17.570
  874   1HB   LYS  45          2HB       LYS  45  15.601  -4.972 -15.831
  875   2HB   LYS  45          1HB       LYS  45  14.869  -3.971 -14.576
  876   1HG   LYS  45          1HG       LYS  45  12.725  -4.849 -14.951
  877   2HG   LYS  45          2HG       LYS  45  13.133  -5.410 -16.571
  878   1HD   LYS  45          1HD       LYS  45  14.798  -6.996 -15.423
  879   2HD   LYS  45          2HD       LYS  45  13.969  -6.596 -13.919
  880   1HE   LYS  45          1HE       LYS  45  12.335  -7.426 -16.292
  881   2HE   LYS  45          2HE       LYS  45  13.182  -8.667 -15.368
  882   1HZ   LYS  45          3HZ       LYS  45  11.710  -6.681 -13.833
  883   2HZ   LYS  45          1HZ       LYS  45  10.774  -7.780 -14.727
  884   3HZ   LYS  45          2HZ       LYS  45  11.880  -8.351 -13.572
  885    H    ASN  46           H        ASN  46  14.434  -1.291 -15.059
  886    HA   ASN  46           HA       ASN  46  12.930   0.318 -14.426
  887   1HB   ASN  46          1HB       ASN  46  12.064  -0.508 -17.076
  888   2HB   ASN  46          2HB       ASN  46  10.681  -0.113 -16.090
  889   1HD2  ASN  46          1HD2      ASN  46  11.355   2.897 -17.646
  890   2HD2  ASN  46          2HD2      ASN  46  12.262   1.652 -18.357
  891    H    ARG  47           H        ARG  47  12.702  -2.669 -13.659
  892    HA   ARG  47           HA       ARG  47   9.951  -3.083 -12.910
  893   1HB   ARG  47          1HB       ARG  47  11.086  -4.253 -10.851
  894   2HB   ARG  47          2HB       ARG  47  11.298  -4.979 -12.442
  895   1HG   ARG  47          1HG       ARG  47  13.529  -4.501 -12.478
  896   2HG   ARG  47          2HG       ARG  47  13.298  -2.919 -11.733
  897   1HD   ARG  47          1HD       ARG  47  13.625  -3.728  -9.631
  898   2HD   ARG  47          2HD       ARG  47  12.712  -5.202  -9.956
  899    HE   ARG  47           HE       ARG  47  15.212  -5.282 -11.368
  900   1HH1  ARG  47          1HH1      ARG  47  14.169  -7.603  -9.835
  901   2HH1  ARG  47          2HH1      ARG  47  15.068  -7.586  -8.355
  902   1HH2  ARG  47          2HH2      ARG  47  17.168  -5.559  -9.067
  903   2HH2  ARG  47          1HH2      ARG  47  16.002  -4.911  -7.962
  904    H    GLN  48           H        GLN  48   9.125  -2.544 -10.584
  905    HA   GLN  48           HA       GLN  48  10.105   0.160 -10.065
  906   1HB   GLN  48          2HB       GLN  48   7.627  -1.306  -9.438
  907   2HB   GLN  48          1HB       GLN  48   8.151  -0.143  -8.213
  908   1HG   GLN  48          2HG       GLN  48   8.395   1.573  -9.963
  909   2HG   GLN  48          1HG       GLN  48   7.903   0.436 -11.178
  910   1HE2  GLN  48          1HE2      GLN  48   5.604   1.646  -8.115
  911   2HE2  GLN  48          2HE2      GLN  48   6.213   2.883  -9.104
  912    H    VAL  49           H        VAL  49  12.110  -0.905  -9.509
  913    HA   VAL  49           HA       VAL  49  12.709  -2.458  -7.302
  914    HB   VAL  49           HB       VAL  49  14.545  -0.190  -7.619
  915   1HG1  VAL  49          3HG1      VAL  49  14.707  -3.193  -7.795
  916   2HG1  VAL  49          1HG1      VAL  49  16.109  -2.143  -8.003
  917   3HG1  VAL  49          2HG1      VAL  49  15.241  -2.160  -6.467
  918   1HG2  VAL  49          2HG2      VAL  49  13.732  -1.829 -10.044
  919   2HG2  VAL  49          3HG2      VAL  49  13.975  -0.089  -9.956
  920   3HG2  VAL  49          1HG2      VAL  49  15.360  -1.175  -9.898
  921    H    CYS  50           H        CYS  50  13.866  -1.464  -5.236
  922    HA   CYS  50           HA       CYS  50  12.113   0.729  -4.200
  923   1HB   CYS  50          1HB       CYS  50  11.608  -1.509  -3.236
  924   2HB   CYS  50          2HB       CYS  50  13.251  -1.616  -2.667
  925    H    ALA  51           H        ALA  51  13.107   2.234  -2.783
  926    HA   ALA  51           HA       ALA  51  15.952   1.924  -2.118
  927   1HB   ALA  51          1HB       ALA  51  15.059   3.554  -4.374
  928   2HB   ALA  51          2HB       ALA  51  15.936   4.502  -3.173
  929   3HB   ALA  51          3HB       ALA  51  16.693   3.087  -3.903
  930    H    ASN  52           H        ASN  52  15.764   2.215  -0.101
  931    HA   ASN  52           HA       ASN  52  13.944   3.458   1.492
  932   1HB   ASN  52          1HB       ASN  52  15.843   2.128   2.252
  933   2HB   ASN  52          2HB       ASN  52  16.958   3.383   1.727
  934   1HD2  ASN  52          1HD2      ASN  52  15.337   3.407   5.357
  935   2HD2  ASN  52          2HD2      ASN  52  14.246   2.902   4.159
  936    HA   PRO  53           HA       PRO  53  14.306   7.814   0.720
  937   1HB   PRO  53          1HB       PRO  53  13.236   8.641   3.192
  938   2HB   PRO  53          2HB       PRO  53  12.306   8.285   1.732
  939   1HG   PRO  53          1HG       PRO  53  12.503   6.730   4.210
  940   2HG   PRO  53          2HG       PRO  53  11.372   6.536   2.868
  941   1HD   PRO  53          1HD       PRO  53  13.647   4.904   3.477
  942   2HD   PRO  53          2HD       PRO  53  12.568   4.750   2.100
  943    H    GLU  54           H        GLU  54  15.189   6.706   4.017
  944    HA   GLU  54           HA       GLU  54  17.171   8.916   4.179
  945   1HB   GLU  54          1HB       GLU  54  16.375   6.991   6.372
  946   2HB   GLU  54          2HB       GLU  54  17.191   8.544   6.546
  947   1HG   GLU  54          1HG       GLU  54  14.411   8.234   5.380
  948   2HG   GLU  54          2HG       GLU  54  14.720   8.603   7.076
  949    H    LYS  55           H        LYS  55  18.060   7.028   2.417
  950    HA   LYS  55           HA       LYS  55  20.045   5.447   4.002
  951   1HB   LYS  55          1HB       LYS  55  18.368   4.653   1.866
  952   2HB   LYS  55          2HB       LYS  55  19.995   4.685   1.234
  953   1HG   LYS  55          1HG       LYS  55  20.782   3.197   2.950
  954   2HG   LYS  55          2HG       LYS  55  19.271   3.345   3.847
  955   1HD   LYS  55          1HD       LYS  55  18.168   1.873   2.490
  956   2HD   LYS  55          2HD       LYS  55  19.003   2.431   1.040
  957   1HE   LYS  55          1HE       LYS  55  20.492   0.747   1.183
  958   2HE   LYS  55          2HE       LYS  55  20.876   1.172   2.851
  959   1HZ   LYS  55          2HZ       LYS  55  18.393  -0.277   2.182
  960   2HZ   LYS  55          3HZ       LYS  55  19.859  -1.109   2.396
  961   3HZ   LYS  55          1HZ       LYS  55  19.208  -0.193   3.670
  962    H    LYS  56           H        LYS  56  20.078   8.329   3.123
  963    HA   LYS  56           HA       LYS  56  21.658   9.852   2.342
  964   1HB   LYS  56          1HB       LYS  56  23.343   7.364   2.628
  965   2HB   LYS  56          2HB       LYS  56  24.026   8.894   2.082
  966   1HG   LYS  56          1HG       LYS  56  22.318   9.146   4.465
  967   2HG   LYS  56          2HG       LYS  56  23.749   8.146   4.720
  968   1HD   LYS  56          1HD       LYS  56  25.125   9.993   3.691
  969   2HD   LYS  56          2HD       LYS  56  23.673  10.993   3.684
  970   1HE   LYS  56          1HE       LYS  56  24.548  11.613   5.732
  971   2HE   LYS  56          2HE       LYS  56  23.580  10.230   6.239
  972   1HZ   LYS  56          3HZ       LYS  56  26.353   9.813   5.357
  973   2HZ   LYS  56          1HZ       LYS  56  26.057  10.392   6.927
  974   3HZ   LYS  56          2HZ       LYS  56  25.417   8.896   6.439
  975    H    TRP  57           H        TRP  57  23.203   7.214   0.583
  976    HA   TRP  57           HA       TRP  57  23.423   8.501  -1.854
  977   1HB   TRP  57          1HB       TRP  57  23.744   6.335  -2.867
  978   2HB   TRP  57          2HB       TRP  57  24.464   6.314  -1.254
  979    HD1  TRP  57           HD1      TRP  57  23.511   4.519   0.395
  980    HE1  TRP  57           HE1      TRP  57  21.737   2.666   0.120
  981    HE3  TRP  57           HE3      TRP  57  21.465   6.004  -3.990
  982    HZ2  TRP  57           HZ2      TRP  57  19.590   2.002  -1.704
  983    HZ3  TRP  57           HZ3      TRP  57  19.655   4.735  -5.043
  984    HH2  TRP  57           HH2      TRP  57  18.703   2.726  -3.912
  985    H    VAL  58           H        VAL  58  20.566   6.621  -0.815
  986    HA   VAL  58           HA       VAL  58  19.150   6.623  -3.233
  987    HB   VAL  58           HB       VAL  58  17.062   6.936  -1.737
  988   1HG1  VAL  58          2HG1      VAL  58  17.908   4.771  -2.541
  989   2HG1  VAL  58          3HG1      VAL  58  19.017   4.708  -1.174
  990   3HG1  VAL  58          1HG1      VAL  58  17.283   4.633  -0.904
  991   1HG2  VAL  58          1HG2      VAL  58  19.177   7.521   0.133
  992   2HG2  VAL  58          2HG2      VAL  58  17.436   7.653   0.340
  993   3HG2  VAL  58          3HG2      VAL  58  18.248   6.125   0.658
  994    H    ARG  59           H        ARG  59  18.930   9.195  -0.733
  995    HA   ARG  59           HA       ARG  59  17.314  10.908  -2.367
  996   1HB   ARG  59          1HB       ARG  59  18.026  12.686  -0.728
  997   2HB   ARG  59          2HB       ARG  59  17.348  11.260   0.018
  998   1HG   ARG  59          2HG       ARG  59  19.506  10.440   0.635
  999   2HG   ARG  59          1HG       ARG  59  20.316  11.601  -0.388
 1000   1HD   ARG  59          1HD       ARG  59  18.804  12.134   2.172
 1001   2HD   ARG  59          2HD       ARG  59  20.506  12.452   1.838
 1002    HE   ARG  59           HE       ARG  59  18.232  14.008   0.689
 1003   1HH1  ARG  59          2HH2      ARG  59  21.061  13.881  -0.759
 1004   2HH1  ARG  59          1HH2      ARG  59  22.030  14.840   0.310
 1005   1HH2  ARG  59          2HH1      ARG  59  19.393  16.567   0.990
 1006   2HH2  ARG  59          1HH1      ARG  59  20.450  16.022   2.249
 1007    H    GLU  60           H        GLU  60  20.792  10.528  -1.993
 1008    HA   GLU  60           HA       GLU  60  21.425  12.905  -3.570
 1009   1HB   GLU  60          2HB       GLU  60  22.913  10.807  -2.156
 1010   2HB   GLU  60          1HB       GLU  60  23.672  11.306  -3.649
 1011   1HG   GLU  60          2HG       GLU  60  23.037  13.729  -2.687
 1012   2HG   GLU  60          1HG       GLU  60  23.178  12.873  -1.172
 1013    H    TYR  61           H        TYR  61  20.163   9.911  -4.348
 1014    HA   TYR  61           HA       TYR  61  21.472   9.791  -7.008
 1015   1HB   TYR  61          1HB       TYR  61  19.873   7.870  -5.338
 1016   2HB   TYR  61          2HB       TYR  61  19.957   7.640  -7.066
 1017    HD1  TYR  61           HD1      TYR  61  22.678   9.070  -4.947
 1018    HD2  TYR  61           HD2      TYR  61  21.265   5.637  -7.144
 1019    HE1  TYR  61           HE1      TYR  61  24.895   7.977  -4.659
 1020    HE2  TYR  61           HE2      TYR  61  23.487   4.542  -6.859
 1021    HH   TYR  61           HH       TYR  61  25.435   4.634  -5.562
 1022    H    ILE  62           H        ILE  62  18.411  10.333  -5.369
 1023    HA   ILE  62           HA       ILE  62  16.683  10.263  -7.634
 1024    HB   ILE  62           HB       ILE  62  16.522  11.910  -5.089
 1025   1HG1  ILE  62          2HG1      ILE  62  16.521   9.491  -4.707
 1026   2HG1  ILE  62          1HG1      ILE  62  14.928  10.138  -4.408
 1027   1HG2  ILE  62          2HG2      ILE  62  14.797  11.747  -7.477
 1028   2HG2  ILE  62          3HG2      ILE  62  13.953  11.539  -5.943
 1029   3HG2  ILE  62          1HG2      ILE  62  14.893  13.001  -6.241
 1030   1HD1  ILE  62          2HD1      ILE  62  14.884   9.544  -7.123
 1031   2HD1  ILE  62          3HD1      ILE  62  15.792   8.208  -6.417
 1032   3HD1  ILE  62          1HD1      ILE  62  14.164   8.568  -5.843
 1033    H    ASN  63           H        ASN  63  18.453  12.992  -6.148
 1034    HA   ASN  63           HA       ASN  63  17.594  14.883  -8.170
 1035   1HB   ASN  63          1HB       ASN  63  18.804  15.089  -5.703
 1036   2HB   ASN  63          2HB       ASN  63  20.115  15.482  -6.788
 1037   1HD2  ASN  63          2HD2      ASN  63  18.057  18.543  -6.002
 1038   2HD2  ASN  63          1HD2      ASN  63  19.338  17.649  -5.341
 1039    H    SER  64           H        SER  64  20.408  12.782  -7.752
 1040    HA   SER  64           HA       SER  64  21.933  13.925  -9.922
 1041   1HB   SER  64          1HB       SER  64  23.142  12.631  -8.324
 1042   2HB   SER  64          2HB       SER  64  22.041  11.263  -8.492
 1043    HG   SER  64           HG       SER  64  23.613  12.277 -10.614
 1044    H    LEU  65           H        LEU  65  19.199  11.823  -9.819
 1045    HA   LEU  65           HA       LEU  65  19.555  10.233 -12.115
 1046   1HB   LEU  65          1HB       LEU  65  17.206  11.356 -10.677
 1047   2HB   LEU  65          2HB       LEU  65  16.923  10.769 -12.298
 1048    HG   LEU  65           HG       LEU  65  18.302   9.170 -10.128
 1049   1HD1  LEU  65          3HD1      LEU  65  15.477   9.645 -10.719
 1050   2HD1  LEU  65          1HD1      LEU  65  15.897   7.934 -10.779
 1051   3HD1  LEU  65          2HD1      LEU  65  16.212   8.868  -9.316
 1052   1HD2  LEU  65          3HD2      LEU  65  17.874   8.830 -13.007
 1053   2HD2  LEU  65          1HD2      LEU  65  18.969   7.968 -11.927
 1054   3HD2  LEU  65          2HD2      LEU  65  17.285   7.463 -12.062
 1055    H    GLU  66           H        GLU  66  18.075  13.494 -11.941
 1056    HA   GLU  66           HA       GLU  66  17.946  15.170 -13.581
 1057   1HB   GLU  66          1HB       GLU  66  20.440  13.899 -13.979
 1058   2HB   GLU  66          2HB       GLU  66  19.712  14.053 -15.578
 1059   1HG   GLU  66          1HG       GLU  66  19.665  16.372 -15.482
 1060   2HG   GLU  66          2HG       GLU  66  19.590  16.401 -13.721
 1061    H    MET  67           H        MET  67  16.336  15.385 -15.069
 1062    HA   MET  67           HA       MET  67  15.340  12.939 -16.400
 1063   1HB   MET  67          1HB       MET  67  14.250  15.665 -15.830
 1064   2HB   MET  67          2HB       MET  67  13.587  14.779 -17.202
 1065   1HG   MET  67          1HG       MET  67  13.727  12.873 -15.164
 1066   2HG   MET  67          2HG       MET  67  13.182  14.336 -14.346
 1067   1HE   MET  67          1HE       MET  67  11.724  15.995 -16.121
 1068   2HE   MET  67          3HE       MET  67  10.058  15.425 -16.222
 1069   3HE   MET  67          2HE       MET  67  10.883  15.468 -14.664
 1070    H    SER  68           H        SER  68  16.586  16.163 -17.256
 1071    HA   SER  68           HA       SER  68  17.605  15.132 -19.784
 1072   1HB   SER  68          1HB       SER  68  15.093  16.748 -19.670
 1073   2HB   SER  68          2HB       SER  68  16.237  17.095 -20.967
 1074    HG   SER  68           HG       SER  68  16.218  14.731 -21.297
   
  No H/Q in entry =        1074
  Start of MODEL    6
    1    H    SER   1           H        SER   1  23.704 -13.062   2.114
    2    HA   SER   1           HA       SER   1  24.358 -14.005  -0.569
    3   1HB   SER   1          1HB       SER   1  22.076 -14.860  -1.059
    4   2HB   SER   1          2HB       SER   1  22.898 -15.838   0.157
    5    HG   SER   1           HG       SER   1  20.735 -14.109   0.408
    6    HA   PRO   2           HA       PRO   2  22.951  -9.981  -1.567
    7   1HB   PRO   2          1HB       PRO   2  21.585 -10.755  -3.993
    8   2HB   PRO   2          2HB       PRO   2  23.172  -9.995  -3.834
    9   1HG   PRO   2          1HG       PRO   2  22.590 -12.725  -4.563
   10   2HG   PRO   2          2HG       PRO   2  24.178 -11.968  -4.388
   11   1HD   PRO   2          1HD       PRO   2  22.931 -13.891  -2.636
   12   2HD   PRO   2          2HD       PRO   2  24.524 -13.129  -2.459
   13    H    TYR   3           H        TYR   3  20.585  -9.286  -2.984
   14    HA   TYR   3           HA       TYR   3  18.274 -10.643  -1.887
   15   1HB   TYR   3          1HB       TYR   3  19.548  -8.532  -0.313
   16   2HB   TYR   3          2HB       TYR   3  17.859  -8.176  -0.675
   17    HD1  TYR   3           HD2      TYR   3  16.458 -10.662  -0.678
   18    HD2  TYR   3           HD1      TYR   3  19.775  -9.471   1.819
   19    HE1  TYR   3           HE2      TYR   3  15.748 -12.310   1.053
   20    HE2  TYR   3           HE1      TYR   3  19.063 -11.119   3.550
   21    HH   TYR   3           HH       TYR   3  16.431 -12.269   4.026
   22    H    SER   4           H        SER   4  16.261  -9.149  -2.240
   23    HA   SER   4           HA       SER   4  16.670  -7.147  -4.377
   24   1HB   SER   4          1HB       SER   4  16.277  -9.684  -5.201
   25   2HB   SER   4          2HB       SER   4  14.596  -9.206  -4.958
   26    HG   SER   4           HG       SER   4  16.318  -8.499  -6.912
   27    H    SER   5           H        SER   5  14.548  -6.026  -4.868
   28    HA   SER   5           HA       SER   5  12.269  -6.444  -3.152
   29   1HB   SER   5          1HB       SER   5  14.391  -5.135  -1.898
   30   2HB   SER   5          2HB       SER   5  13.313  -3.830  -2.392
   31    HG   SER   5           HG       SER   5  12.767  -6.059  -0.754
   32    H    ASP   6           H        ASP   6  10.582  -5.602  -4.252
   33    HA   ASP   6           HA       ASP   6  11.017  -3.137  -5.885
   34   1HB   ASP   6          1HB       ASP   6   9.763  -4.111  -7.746
   35   2HB   ASP   6          2HB       ASP   6  11.121  -5.164  -7.362
   36    H    THR   7           H        THR   7   8.280  -3.210  -6.894
   37    HA   THR   7           HA       THR   7   7.021  -2.151  -4.489
   38    HB   THR   7           HB       THR   7   6.796  -1.003  -6.675
   39    HG1  THR   7           HG1      THR   7   4.751  -0.471  -6.300
   40   1HG2  THR   7          3HG2      THR   7   6.566  -3.422  -7.789
   41   2HG2  THR   7          1HG2      THR   7   4.848  -3.078  -7.587
   42   3HG2  THR   7          2HG2      THR   7   5.859  -1.992  -8.541
   43    H    THR   8           H        THR   8   4.595  -2.720  -4.175
   44    HA   THR   8           HA       THR   8   4.061  -5.606  -4.678
   45    HB   THR   8           HB       THR   8   3.673  -4.312  -1.963
   46    HG1  THR   8           HG1      THR   8   5.788  -5.843  -3.035
   47   1HG2  THR   8          1HG2      THR   8   2.702  -6.689  -3.158
   48   2HG2  THR   8          2HG2      THR   8   3.951  -7.182  -2.015
   49   3HG2  THR   8          3HG2      THR   8   2.581  -6.218  -1.463
   50    HA   PRO   9           HA       PRO   9   0.420  -3.199  -5.891
   51   1HB   PRO   9          1HB       PRO   9  -0.647  -5.617  -7.036
   52   2HB   PRO   9          2HB       PRO   9   0.033  -4.223  -7.885
   53   1HG   PRO   9          2HG       PRO   9   1.219  -6.841  -7.531
   54   2HG   PRO   9          1HG       PRO   9   1.880  -5.464  -8.412
   55   1HD   PRO   9          1HD       PRO   9   2.747  -6.512  -5.903
   56   2HD   PRO   9          2HD       PRO   9   3.384  -5.122  -6.770
   57    H    CYS  10           H        CYS  10  -0.740  -2.901  -4.005
   58    HA   CYS  10           HA       CYS  10  -2.799  -4.838  -3.342
   59   1HB   CYS  10          1HB       CYS  10  -2.112  -4.970  -0.905
   60   2HB   CYS  10          2HB       CYS  10  -1.124  -5.895  -2.005
   61    H    CYS  11           H        CYS  11  -4.497  -3.842  -2.180
   62    HA   CYS  11           HA       CYS  11  -4.221  -0.926  -2.158
   63   1HB   CYS  11          1HB       CYS  11  -6.659  -0.885  -1.766
   64   2HB   CYS  11          2HB       CYS  11  -6.187  -1.741  -3.222
   65    H    PHE  12           H        PHE  12  -4.780   0.392  -0.337
   66    HA   PHE  12           HA       PHE  12  -4.125  -0.930   2.235
   67   1HB   PHE  12          1HB       PHE  12  -3.764   1.410   3.042
   68   2HB   PHE  12          2HB       PHE  12  -2.737   0.980   1.698
   69    HD1  PHE  12           HD2      PHE  12  -5.664   2.972   2.762
   70    HD2  PHE  12           HD1      PHE  12  -3.061   1.954  -0.529
   71    HE1  PHE  12           HE2      PHE  12  -6.551   4.905   1.464
   72    HE2  PHE  12           HE1      PHE  12  -3.939   3.899  -1.822
   73    HZ   PHE  12           HZ       PHE  12  -5.687   5.369  -0.829
   74    H    ALA  13           H        ALA  13  -6.551   1.314   0.863
   75    HA   ALA  13           HA       ALA  13  -8.233   0.785   3.268
   76   1HB   ALA  13          1HB       ALA  13  -7.781   3.169   2.754
   77   2HB   ALA  13          2HB       ALA  13  -8.504   2.948   1.161
   78   3HB   ALA  13          3HB       ALA  13  -9.498   2.789   2.610
   79    H    TYR  14           H        TYR  14 -10.105  -0.299   3.091
   80    HA   TYR  14           HA       TYR  14 -10.756  -1.360   0.420
   81   1HB   TYR  14          2HB       TYR  14 -12.513  -2.272   2.560
   82   2HB   TYR  14          1HB       TYR  14 -11.534  -3.211   1.466
   83    HD1  TYR  14           HD2      TYR  14  -9.216  -3.858   2.043
   84    HD2  TYR  14           HD1      TYR  14 -11.662  -1.546   4.749
   85    HE1  TYR  14           HE2      TYR  14  -7.615  -4.324   3.890
   86    HE2  TYR  14           HE1      TYR  14 -10.058  -2.013   6.596
   87    HH   TYR  14           HH       TYR  14  -8.043  -4.316   6.753
   88    H    ILE  15           H        ILE  15 -12.412  -0.525  -0.753
   89    HA   ILE  15           HA       ILE  15 -13.841   1.784  -0.037
   90    HB   ILE  15           HB       ILE  15 -14.719  -0.426  -1.922
   91   1HG1  ILE  15          2HG1      ILE  15 -13.155   2.127  -2.420
   92   2HG1  ILE  15          1HG1      ILE  15 -12.483   0.496  -2.441
   93   1HG2  ILE  15          1HG2      ILE  15 -15.999   2.001  -1.061
   94   2HG2  ILE  15          2HG2      ILE  15 -15.554   2.156  -2.760
   95   3HG2  ILE  15          3HG2      ILE  15 -16.570   0.814  -2.234
   96   1HD1  ILE  15          2HD1      ILE  15 -14.288  -0.019  -4.218
   97   2HD1  ILE  15          3HD1      ILE  15 -14.472   1.730  -4.350
   98   3HD1  ILE  15          1HD1      ILE  15 -12.921   0.976  -4.721
   99    H    ALA  16           H        ALA  16 -15.617   2.137   1.222
  100    HA   ALA  16           HA       ALA  16 -16.717  -0.112   2.741
  101   1HB   ALA  16          2HB       ALA  16 -16.315   2.514   3.328
  102   2HB   ALA  16          3HB       ALA  16 -18.028   2.536   2.910
  103   3HB   ALA  16          1HB       ALA  16 -17.448   1.483   4.201
  104    H    ARG  17           H        ARG  17 -17.623  -1.216   0.818
  105    HA   ARG  17           HA       ARG  17 -20.390  -1.001   0.540
  106   1HB   ARG  17          2HB       ARG  17 -18.942   0.984  -1.059
  107   2HB   ARG  17          1HB       ARG  17 -20.011  -0.034  -2.025
  108   1HG   ARG  17          1HG       ARG  17 -21.404   0.653   0.368
  109   2HG   ARG  17          2HG       ARG  17 -20.714   2.137  -0.290
  110   1HD   ARG  17          1HD       ARG  17 -21.646   1.348  -2.562
  111   2HD   ARG  17          2HD       ARG  17 -22.601   0.195  -1.629
  112    HE   ARG  17           HE       ARG  17 -22.817   2.993  -0.748
  113   1HH1  ARG  17          1HH2      ARG  17 -24.942   0.938  -0.256
  114   2HH1  ARG  17          2HH2      ARG  17 -26.181   1.584  -1.278
  115   1HH2  ARG  17          1HH1      ARG  17 -24.182   3.517  -3.173
  116   2HH2  ARG  17          2HH1      ARG  17 -25.321   2.244  -3.458
  117    HA   PRO  18           HA       PRO  18 -18.681  -4.839  -1.153
  118   1HB   PRO  18          1HB       PRO  18 -21.404  -5.710  -1.571
  119   2HB   PRO  18          2HB       PRO  18 -20.261  -6.297  -0.400
  120   1HG   PRO  18          1HG       PRO  18 -22.536  -4.594   0.074
  121   2HG   PRO  18          2HG       PRO  18 -21.399  -5.237   1.263
  122   1HD   PRO  18          2HD       PRO  18 -21.620  -2.535   0.387
  123   2HD   PRO  18          1HD       PRO  18 -20.384  -3.204   1.440
  124    H    LEU  19           H        LEU  19 -17.926  -4.413  -3.203
  125    HA   LEU  19           HA       LEU  19 -19.359  -3.073  -5.265
  126   1HB   LEU  19          1HB       LEU  19 -17.223  -5.171  -5.730
  127   2HB   LEU  19          2HB       LEU  19 -17.629  -3.806  -6.766
  128    HG   LEU  19           HG       LEU  19 -16.379  -3.664  -4.006
  129   1HD1  LEU  19          1HD1      LEU  19 -14.931  -4.325  -5.976
  130   2HD1  LEU  19          2HD1      LEU  19 -15.308  -2.756  -6.686
  131   3HD1  LEU  19          3HD1      LEU  19 -14.433  -2.843  -5.158
  132   1HD2  LEU  19          2HD2      LEU  19 -17.847  -1.696  -5.614
  133   2HD2  LEU  19          3HD2      LEU  19 -17.379  -1.631  -3.914
  134   3HD2  LEU  19          1HD2      LEU  19 -16.227  -1.159  -5.164
  135    HA   PRO  20           HA       PRO  20 -22.212  -6.072  -6.747
  136   1HB   PRO  20          1HB       PRO  20 -21.635  -5.550  -9.538
  137   2HB   PRO  20          2HB       PRO  20 -23.032  -5.018  -8.595
  138   1HG   PRO  20          1HG       PRO  20 -20.827  -3.413  -9.514
  139   2HG   PRO  20          2HG       PRO  20 -22.194  -2.894  -8.523
  140   1HD   PRO  20          1HD       PRO  20 -19.447  -3.271  -7.710
  141   2HD   PRO  20          2HD       PRO  20 -20.815  -2.726  -6.719
  142    H    ARG  21           H        ARG  21 -21.563  -8.182  -6.545
  143    HA   ARG  21           HA       ARG  21 -19.097  -9.300  -7.212
  144   1HB   ARG  21          1HB       ARG  21 -20.819 -10.458  -5.869
  145   2HB   ARG  21          2HB       ARG  21 -21.791 -10.688  -7.321
  146   1HG   ARG  21          1HG       ARG  21 -18.948 -11.609  -7.389
  147   2HG   ARG  21          2HG       ARG  21 -20.102 -12.573  -6.466
  148   1HD   ARG  21          2HD       ARG  21 -21.200 -11.773  -9.042
  149   2HD   ARG  21          1HD       ARG  21 -19.696 -12.675  -9.234
  150    HE   ARG  21           HE       ARG  21 -21.351 -14.029  -7.336
  151   1HH1  ARG  21          1HH2      ARG  21 -23.573 -13.662  -9.186
  152   2HH1  ARG  21          2HH2      ARG  21 -23.142 -14.460 -10.662
  153   1HH2  ARG  21          1HH1      ARG  21 -20.758 -16.198  -9.098
  154   2HH2  ARG  21          2HH1      ARG  21 -20.831 -15.505 -10.683
  155    H    ALA  22           H        ALA  22 -21.959  -9.004  -9.313
  156    HA   ALA  22           HA       ALA  22 -20.741 -10.465 -11.498
  157   1HB   ALA  22          2HB       ALA  22 -23.275  -9.861 -11.006
  158   2HB   ALA  22          3HB       ALA  22 -22.890  -8.434 -11.969
  159   3HB   ALA  22          1HB       ALA  22 -22.702 -10.044 -12.663
  160    H    HIS  23           H        HIS  23 -20.845  -7.071 -10.551
  161    HA   HIS  23           HA       HIS  23 -19.836  -6.059 -13.055
  162   1HB   HIS  23          2HB       HIS  23 -19.821  -4.907 -10.261
  163   2HB   HIS  23          1HB       HIS  23 -19.245  -4.035 -11.660
  164    HD2  HIS  23           HD2      HIS  23 -22.459  -6.233 -12.075
  165    HE1  HIS  23           HE1      HIS  23 -23.643  -2.174 -12.105
  166    HE2  HIS  23           HE2      HIS  23 -24.428  -4.567 -12.470
  167    H    ILE  24           H        ILE  24 -18.291  -7.464 -10.216
  168    HA   ILE  24           HA       ILE  24 -15.652  -6.483 -10.979
  169    HB   ILE  24           HB       ILE  24 -16.150  -8.800  -9.145
  170   1HG1  ILE  24          2HG1      ILE  24 -16.061  -5.904  -8.319
  171   2HG1  ILE  24          1HG1      ILE  24 -17.559  -6.789  -8.501
  172   1HG2  ILE  24          3HG2      ILE  24 -13.905  -7.052  -9.878
  173   2HG2  ILE  24          1HG2      ILE  24 -14.107  -7.275  -8.144
  174   3HG2  ILE  24          2HG2      ILE  24 -13.887  -8.676  -9.192
  175   1HD1  ILE  24          1HD1      ILE  24 -15.508  -8.177  -6.899
  176   2HD1  ILE  24          2HD1      ILE  24 -16.081  -6.669  -6.186
  177   3HD1  ILE  24          3HD1      ILE  24 -17.228  -7.955  -6.566
  178    H    LYS  25           H        LYS  25 -13.867  -8.076 -11.480
  179    HA   LYS  25           HA       LYS  25 -14.917 -10.368 -13.086
  180   1HB   LYS  25          2HB       LYS  25 -14.136  -8.673 -14.618
  181   2HB   LYS  25          1HB       LYS  25 -12.644  -8.478 -13.749
  182   1HG   LYS  25          1HG       LYS  25 -11.817 -10.567 -14.473
  183   2HG   LYS  25          2HG       LYS  25 -13.428 -11.157 -14.880
  184   1HD   LYS  25          1HD       LYS  25 -13.437  -9.174 -16.591
  185   2HD   LYS  25          2HD       LYS  25 -11.686  -9.225 -16.391
  186   1HE   LYS  25          1HE       LYS  25 -12.974 -11.856 -16.801
  187   2HE   LYS  25          2HE       LYS  25 -13.058 -10.761 -18.181
  188   1HZ   LYS  25          2HZ       LYS  25 -10.555 -10.401 -17.588
  189   2HZ   LYS  25          3HZ       LYS  25 -10.711 -11.936 -16.877
  190   3HZ   LYS  25          1HZ       LYS  25 -11.040 -11.728 -18.530
  191    H    GLU  26           H        GLU  26 -12.054  -9.115 -11.311
  192    HA   GLU  26           HA       GLU  26 -11.552 -11.860 -10.371
  193   1HB   GLU  26          1HB       GLU  26 -10.002 -12.030 -11.999
  194   2HB   GLU  26          2HB       GLU  26 -10.007 -10.337 -12.344
  195   1HG   GLU  26          1HG       GLU  26  -7.867 -10.556 -11.623
  196   2HG   GLU  26          2HG       GLU  26  -8.584 -10.247 -10.082
  197    H    TYR  27           H        TYR  27  -9.601 -11.621  -8.689
  198    HA   TYR  27           HA       TYR  27  -9.748  -9.012  -7.338
  199   1HB   TYR  27          2HB       TYR  27 -10.263  -9.984  -5.197
  200   2HB   TYR  27          1HB       TYR  27 -11.443 -10.597  -6.323
  201    HD1  TYR  27           HD2      TYR  27 -11.247 -12.914  -7.262
  202    HD2  TYR  27           HD1      TYR  27  -8.640 -11.464  -4.140
  203    HE1  TYR  27           HE2      TYR  27 -10.560 -15.254  -6.750
  204    HE2  TYR  27           HE1      TYR  27  -7.952 -13.805  -3.629
  205    HH   TYR  27           HH       TYR  27  -8.995 -16.517  -5.653
  206    H    PHE  28           H        PHE  28  -7.958  -9.123  -5.440
  207    HA   PHE  28           HA       PHE  28  -5.802 -10.932  -6.273
  208   1HB   PHE  28          1HB       PHE  28  -5.416  -9.009  -7.699
  209   2HB   PHE  28          2HB       PHE  28  -5.535  -7.921  -6.321
  210    HD1  PHE  28           HD1      PHE  28  -3.453 -10.500  -7.985
  211    HD2  PHE  28           HD2      PHE  28  -3.707  -7.678  -4.727
  212    HE1  PHE  28           HE1      PHE  28  -1.020 -10.803  -7.529
  213    HE2  PHE  28           HE2      PHE  28  -1.289  -8.005  -4.251
  214    HZ   PHE  28           HZ       PHE  28   0.064  -9.553  -5.663
  215    H    TYR  29           H        TYR  29  -6.044 -11.867  -4.166
  216    HA   TYR  29           HA       TYR  29  -5.944 -10.290  -1.777
  217   1HB   TYR  29          1HB       TYR  29  -6.785 -12.590  -1.765
  218   2HB   TYR  29          2HB       TYR  29  -5.211 -13.189  -2.218
  219    HD1  TYR  29           HD2      TYR  29  -7.090 -11.413   0.466
  220    HD2  TYR  29           HD1      TYR  29  -3.485 -13.538  -0.599
  221    HE1  TYR  29           HE2      TYR  29  -6.451 -11.537   2.871
  222    HE2  TYR  29           HE1      TYR  29  -2.849 -13.665   1.806
  223    HH   TYR  29           HH       TYR  29  -4.369 -11.812   4.219
  224    H    THR  30           H        THR  30  -4.266  -9.356  -0.829
  225    HA   THR  30           HA       THR  30  -1.573  -9.687  -1.994
  226    HB   THR  30           HB       THR  30  -2.245  -7.415  -1.560
  227    HG1  THR  30           HG1      THR  30  -0.582  -6.801  -0.207
  228   1HG2  THR  30          3HG2      THR  30  -2.973  -8.525   1.148
  229   2HG2  THR  30          1HG2      THR  30  -2.673  -6.800   0.927
  230   3HG2  THR  30          2HG2      THR  30  -3.974  -7.589   0.035
  231    H    SER  31           H        SER  31   0.285  -9.704  -0.265
  232    HA   SER  31           HA       SER  31  -0.259 -12.015   1.504
  233   1HB   SER  31          1HB       SER  31   2.396 -10.667   0.957
  234   2HB   SER  31          2HB       SER  31   2.130 -12.278   1.622
  235    HG   SER  31           HG       SER  31   1.315 -12.938  -0.335
  236    H    GLY  32           H        GLY  32   1.862 -11.458   3.370
  237   1HA   GLY  32          2HA       GLY  32   0.447  -9.455   5.044
  238   2HA   GLY  32          1HA       GLY  32   1.595 -10.657   5.633
  239    H    LYS  33           H        LYS  33   2.174  -8.608   2.824
  240    HA   LYS  33           HA       LYS  33   4.227  -7.132   4.425
  241   1HB   LYS  33          1HB       LYS  33   5.564  -7.078   2.270
  242   2HB   LYS  33          2HB       LYS  33   5.437  -8.652   3.016
  243   1HG   LYS  33          1HG       LYS  33   3.488  -9.147   1.507
  244   2HG   LYS  33          2HG       LYS  33   3.801  -7.617   0.688
  245   1HD   LYS  33          1HD       LYS  33   4.868  -9.514  -0.493
  246   2HD   LYS  33          2HD       LYS  33   6.059  -8.384   0.102
  247   1HE   LYS  33          1HE       LYS  33   6.826  -9.826   1.736
  248   2HE   LYS  33          2HE       LYS  33   5.267 -10.636   1.892
  249   1HZ   LYS  33          2HZ       LYS  33   6.962 -10.867  -0.527
  250   2HZ   LYS  33          3HZ       LYS  33   7.072 -11.950   0.777
  251   3HZ   LYS  33          1HZ       LYS  33   5.622 -11.819  -0.098
  252    H    CYS  34           H        CYS  34   1.483  -6.364   3.808
  253    HA   CYS  34           HA       CYS  34   2.053  -3.941   2.153
  254   1HB   CYS  34          2HB       CYS  34   0.602  -5.701   1.019
  255   2HB   CYS  34          1HB       CYS  34  -0.608  -5.380   2.258
  256    H    SER  35           H        SER  35   1.353  -5.019   5.208
  257    HA   SER  35           HA       SER  35   0.382  -4.030   7.102
  258   1HB   SER  35          1HB       SER  35   2.095  -2.328   6.558
  259   2HB   SER  35          2HB       SER  35   0.938  -1.512   5.505
  260    HG   SER  35           HG       SER  35   1.145  -1.510   8.235
  261    H    ASN  36           H        ASN  36  -1.334  -4.710   4.736
  262    HA   ASN  36           HA       ASN  36  -3.833  -3.753   5.729
  263   1HB   ASN  36          1HB       ASN  36  -2.477  -2.065   3.730
  264   2HB   ASN  36          2HB       ASN  36  -4.124  -2.520   3.294
  265   1HD2  ASN  36          1HD2      ASN  36  -5.164  -1.584   6.677
  266   2HD2  ASN  36          2HD2      ASN  36  -5.917  -1.792   5.169
  267    HA   PRO  37           HA       PRO  37  -3.554  -7.451   2.885
  268   1HB   PRO  37          1HB       PRO  37  -5.411  -8.702   4.730
  269   2HB   PRO  37          2HB       PRO  37  -3.758  -9.191   4.344
  270   1HG   PRO  37          1HG       PRO  37  -4.688  -7.948   6.760
  271   2HG   PRO  37          2HG       PRO  37  -3.041  -8.384   6.354
  272   1HD   PRO  37          2HD       PRO  37  -4.176  -5.742   6.500
  273   2HD   PRO  37          1HD       PRO  37  -2.512  -6.185   6.077
  274    H    ALA  38           H        ALA  38  -5.358  -8.283   1.604
  275    HA   ALA  38           HA       ALA  38  -8.093  -7.614   1.972
  276   1HB   ALA  38          1HB       ALA  38  -6.738  -5.287   1.492
  277   2HB   ALA  38          2HB       ALA  38  -7.062  -5.785  -0.168
  278   3HB   ALA  38          3HB       ALA  38  -8.397  -5.549   0.961
  279    H    VAL  39           H        VAL  39  -8.731  -7.069  -0.747
  280    HA   VAL  39           HA       VAL  39  -7.396  -9.143  -2.360
  281    HB   VAL  39           HB       VAL  39  -9.859  -9.914  -2.996
  282   1HG1  VAL  39          1HG1      VAL  39  -7.762 -10.908  -1.383
  283   2HG1  VAL  39          2HG1      VAL  39  -9.258 -11.253  -0.515
  284   3HG1  VAL  39          3HG1      VAL  39  -9.041 -11.835  -2.166
  285   1HG2  VAL  39          1HG2      VAL  39 -10.898  -8.304  -1.386
  286   2HG2  VAL  39          2HG2      VAL  39 -11.360  -9.979  -1.097
  287   3HG2  VAL  39          3HG2      VAL  39 -10.155  -9.208  -0.056
  288    H    VAL  40           H        VAL  40  -6.746  -7.448  -3.597
  289    HA   VAL  40           HA       VAL  40  -8.327  -5.239  -4.343
  290    HB   VAL  40           HB       VAL  40  -5.755  -6.435  -5.150
  291   1HG1  VAL  40          3HG1      VAL  40  -6.812  -6.055  -7.370
  292   2HG1  VAL  40          1HG1      VAL  40  -7.118  -4.380  -6.912
  293   3HG1  VAL  40          2HG1      VAL  40  -5.460  -4.961  -7.079
  294   1HG2  VAL  40          1HG2      VAL  40  -6.925  -3.914  -4.109
  295   2HG2  VAL  40          2HG2      VAL  40  -5.450  -4.756  -3.623
  296   3HG2  VAL  40          3HG2      VAL  40  -5.454  -3.747  -5.071
  297    H    PHE  41           H        PHE  41 -10.102  -5.216  -5.511
  298    HA   PHE  41           HA       PHE  41 -10.772  -7.412  -7.283
  299   1HB   PHE  41          2HB       PHE  41 -12.111  -4.866  -6.441
  300   2HB   PHE  41          1HB       PHE  41 -12.704  -5.722  -7.842
  301    HD1  PHE  41           HD2      PHE  41 -12.291  -8.567  -7.087
  302    HD2  PHE  41           HD1      PHE  41 -13.713  -5.223  -4.755
  303    HE1  PHE  41           HE2      PHE  41 -13.592 -10.126  -5.642
  304    HE2  PHE  41           HE1      PHE  41 -15.028  -6.778  -3.330
  305    HZ   PHE  41           HZ       PHE  41 -14.983  -9.229  -3.774
  306    H    VAL  42           H        VAL  42 -11.503  -6.965  -9.434
  307    HA   VAL  42           HA       VAL  42 -10.147  -4.788 -10.902
  308    HB   VAL  42           HB       VAL  42  -9.714  -6.889 -12.583
  309   1HG1  VAL  42          2HG2      VAL  42  -8.238  -4.934 -11.487
  310   2HG1  VAL  42          3HG2      VAL  42  -7.544  -6.316 -10.637
  311   3HG1  VAL  42          1HG2      VAL  42  -7.513  -6.259 -12.400
  312   1HG2  VAL  42          3HG1      VAL  42  -9.305  -7.908  -9.778
  313   2HG2  VAL  42          1HG1      VAL  42 -10.156  -8.684 -11.113
  314   3HG2  VAL  42          2HG1      VAL  42  -8.400  -8.543 -11.148
  315    H    THR  43           H        THR  43 -12.457  -4.192 -11.021
  316    HA   THR  43           HA       THR  43 -14.366  -6.118 -12.121
  317    HB   THR  43           HB       THR  43 -16.031  -4.518 -11.652
  318    HG1  THR  43           HG1      THR  43 -15.501  -2.310 -11.401
  319   1HG2  THR  43          3HG2      THR  43 -14.750  -5.323  -9.634
  320   2HG2  THR  43          1HG2      THR  43 -13.825  -3.823  -9.696
  321   3HG2  THR  43          2HG2      THR  43 -15.564  -3.776  -9.405
  322    H    ARG  44           H        ARG  44 -15.977  -4.292 -13.635
  323    HA   ARG  44           HA       ARG  44 -15.156  -4.885 -16.205
  324   1HB   ARG  44          2HB       ARG  44 -16.564  -2.811 -16.884
  325   2HB   ARG  44          1HB       ARG  44 -17.373  -4.086 -16.009
  326   1HG   ARG  44          1HG       ARG  44 -16.318  -2.413 -14.012
  327   2HG   ARG  44          2HG       ARG  44 -16.959  -1.322 -15.236
  328   1HD   ARG  44          1HD       ARG  44 -18.607  -3.681 -14.390
  329   2HD   ARG  44          2HD       ARG  44 -18.534  -2.269 -13.336
  330    HE   ARG  44           HE       ARG  44 -19.621  -0.973 -15.060
  331   1HH1  ARG  44          1HH1      ARG  44 -18.996  -1.553 -17.651
  332   2HH1  ARG  44          2HH1      ARG  44 -20.352  -2.493 -18.178
  333   1HH2  ARG  44          1HH2      ARG  44 -20.739  -4.003 -15.069
  334   2HH2  ARG  44          2HH2      ARG  44 -21.342  -3.928 -16.691
  335    H    LYS  45           H        LYS  45 -14.690  -1.657 -14.663
  336    HA   LYS  45           HA       LYS  45 -12.873  -0.705 -16.678
  337   1HB   LYS  45          2HB       LYS  45 -13.592   0.070 -13.895
  338   2HB   LYS  45          1HB       LYS  45 -11.996   0.577 -14.447
  339   1HG   LYS  45          1HG       LYS  45 -14.260   0.995 -16.336
  340   2HG   LYS  45          2HG       LYS  45 -14.211   2.036 -14.914
  341   1HD   LYS  45          1HD       LYS  45 -12.284   3.090 -15.583
  342   2HD   LYS  45          2HD       LYS  45 -11.644   1.648 -16.371
  343   1HE   LYS  45          1HE       LYS  45 -13.457   1.963 -18.135
  344   2HE   LYS  45          2HE       LYS  45 -13.757   3.546 -17.418
  345   1HZ   LYS  45          3HZ       LYS  45 -10.996   2.839 -18.077
  346   2HZ   LYS  45          1HZ       LYS  45 -12.041   3.224 -19.360
  347   3HZ   LYS  45          2HZ       LYS  45 -11.769   4.351 -18.119
  348    H    ASN  46           H        ASN  46 -12.642  -2.730 -13.870
  349    HA   ASN  46           HA       ASN  46 -11.064  -4.256 -13.186
  350   1HB   ASN  46          1HB       ASN  46 -10.570  -3.888 -15.981
  351   2HB   ASN  46          2HB       ASN  46  -9.019  -3.926 -15.186
  352   1HD2  ASN  46          1HD2      ASN  46  -9.463  -7.433 -15.691
  353   2HD2  ASN  46          2HD2      ASN  46  -8.406  -6.110 -15.806
  354    H    ARG  47           H        ARG  47 -10.792  -1.184 -12.852
  355    HA   ARG  47           HA       ARG  47  -7.994  -0.670 -12.433
  356   1HB   ARG  47          2HB       ARG  47 -10.552   0.356 -11.230
  357   2HB   ARG  47          1HB       ARG  47  -9.036   0.719 -10.419
  358   1HG   ARG  47          1HG       ARG  47  -8.431   1.282 -13.047
  359   2HG   ARG  47          2HG       ARG  47 -10.119   1.783 -12.942
  360   1HD   ARG  47          1HD       ARG  47  -9.656   3.501 -11.504
  361   2HD   ARG  47          2HD       ARG  47  -8.389   2.598 -10.675
  362    HE   ARG  47           HE       ARG  47  -7.237   3.087 -13.106
  363   1HH1  ARG  47          2HH2      ARG  47  -8.756   5.440 -13.756
  364   2HH1  ARG  47          1HH2      ARG  47  -8.299   6.676 -12.632
  365   1HH2  ARG  47          1HH1      ARG  47  -6.870   5.224 -10.418
  366   2HH2  ARG  47          2HH1      ARG  47  -5.789   5.598 -11.718
  367    H    GLN  48           H        GLN  48  -6.843  -1.050 -10.277
  368    HA   GLN  48           HA       GLN  48  -7.825  -3.596  -9.256
  369   1HB   GLN  48          2HB       GLN  48  -5.262  -2.151  -9.138
  370   2HB   GLN  48          1HB       GLN  48  -5.628  -3.165  -7.757
  371   1HG   GLN  48          1HG       GLN  48  -6.133  -5.050  -9.256
  372   2HG   GLN  48          2HG       GLN  48  -5.828  -4.036 -10.657
  373   1HE2  GLN  48          1HE2      GLN  48  -2.993  -4.367  -7.886
  374   2HE2  GLN  48          2HE2      GLN  48  -3.723  -5.885  -8.106
  375    H    VAL  49           H        VAL  49  -9.695  -2.723  -8.453
  376    HA   VAL  49           HA       VAL  49 -10.011  -0.735  -6.506
  377    HB   VAL  49           HB       VAL  49 -11.874  -2.945  -6.141
  378   1HG1  VAL  49          2HG1      VAL  49 -11.995  -0.049  -6.941
  379   2HG1  VAL  49          3HG1      VAL  49 -13.443  -1.056  -6.902
  380   3HG1  VAL  49          1HG1      VAL  49 -12.511  -0.793  -5.427
  381   1HG2  VAL  49          3HG2      VAL  49 -11.403  -1.931  -8.980
  382   2HG2  VAL  49          1HG2      VAL  49 -11.519  -3.605  -8.450
  383   3HG2  VAL  49          2HG2      VAL  49 -12.956  -2.585  -8.466
  384    H    CYS  50           H        CYS  50 -11.332  -1.956  -4.348
  385    HA   CYS  50           HA       CYS  50  -9.226  -3.600  -3.017
  386   1HB   CYS  50          1HB       CYS  50  -9.286  -0.983  -2.565
  387   2HB   CYS  50          2HB       CYS  50 -10.640  -1.412  -1.526
  388    H    ALA  51           H        ALA  51 -10.040  -4.994  -1.414
  389    HA   ALA  51           HA       ALA  51 -12.841  -4.798  -0.570
  390   1HB   ALA  51          2HB       ALA  51 -12.096  -6.537  -2.760
  391   2HB   ALA  51          3HB       ALA  51 -12.636  -7.489  -1.375
  392   3HB   ALA  51          1HB       ALA  51 -13.686  -6.248  -2.051
  393    H    ASN  52           H        ASN  52 -12.718  -5.081   1.440
  394    HA   ASN  52           HA       ASN  52 -10.651  -5.842   3.034
  395   1HB   ASN  52          2HB       ASN  52 -13.067  -5.052   3.517
  396   2HB   ASN  52          1HB       ASN  52 -13.462  -6.731   3.546
  397   1HD2  ASN  52          1HD2      ASN  52 -10.818  -5.493   6.453
  398   2HD2  ASN  52          2HD2      ASN  52 -10.840  -4.678   4.965
  399    HA   PRO  53           HA       PRO  53 -10.199 -10.164   2.255
  400   1HB   PRO  53          2HB       PRO  53  -8.551 -10.720   4.396
  401   2HB   PRO  53          1HB       PRO  53  -8.000 -10.048   2.885
  402   1HG   PRO  53          2HG       PRO  53  -8.267  -8.719   5.508
  403   2HG   PRO  53          1HG       PRO  53  -7.332  -8.219   4.097
  404   1HD   PRO  53          2HD       PRO  53  -9.843  -7.162   4.958
  405   2HD   PRO  53          1HD       PRO  53  -8.979  -6.760   3.480
  406    H    GLU  54           H        GLU  54 -11.895  -8.857   4.895
  407    HA   GLU  54           HA       GLU  54 -12.870 -11.565   5.627
  408   1HB   GLU  54          1HB       GLU  54 -10.960 -10.682   7.174
  409   2HB   GLU  54          2HB       GLU  54 -12.218  -9.638   7.837
  410   1HG   GLU  54          1HG       GLU  54 -12.429 -11.515   9.202
  411   2HG   GLU  54          2HG       GLU  54 -13.604 -11.881   7.939
  412    H    LYS  55           H        LYS  55 -13.951  -8.853   4.424
  413    HA   LYS  55           HA       LYS  55 -16.059  -8.227   6.392
  414   1HB   LYS  55          2HB       LYS  55 -15.270  -7.092   3.748
  415   2HB   LYS  55          1HB       LYS  55 -16.902  -6.847   4.294
  416   1HG   LYS  55          1HG       LYS  55 -15.104  -6.373   6.485
  417   2HG   LYS  55          2HG       LYS  55 -14.589  -5.422   5.093
  418   1HD   LYS  55          1HD       LYS  55 -16.532  -4.175   5.052
  419   2HD   LYS  55          2HD       LYS  55 -17.507  -5.481   5.725
  420   1HE   LYS  55          1HE       LYS  55 -17.109  -4.830   7.865
  421   2HE   LYS  55          2HE       LYS  55 -15.409  -4.493   7.541
  422   1HZ   LYS  55          2HZ       LYS  55 -16.239  -2.473   6.302
  423   2HZ   LYS  55          3HZ       LYS  55 -17.746  -2.753   7.033
  424   3HZ   LYS  55          1HZ       LYS  55 -16.384  -2.430   7.994
  425    H    LYS  56           H        LYS  56 -16.171 -10.931   5.608
  426    HA   LYS  56           HA       LYS  56 -17.635 -12.547   4.779
  427   1HB   LYS  56          1HB       LYS  56 -19.240 -10.258   5.706
  428   2HB   LYS  56          2HB       LYS  56 -20.088 -11.341   4.601
  429   1HG   LYS  56          1HG       LYS  56 -18.512 -12.382   6.962
  430   2HG   LYS  56          2HG       LYS  56 -20.208 -11.923   7.104
  431   1HD   LYS  56          1HD       LYS  56 -19.984 -13.526   4.771
  432   2HD   LYS  56          2HD       LYS  56 -19.091 -14.355   6.046
  433   1HE   LYS  56          1HE       LYS  56 -21.200 -13.766   7.508
  434   2HE   LYS  56          2HE       LYS  56 -22.002 -13.615   5.945
  435   1HZ   LYS  56          1HZ       LYS  56 -20.884 -15.881   5.488
  436   2HZ   LYS  56          2HZ       LYS  56 -20.772 -15.986   7.180
  437   3HZ   LYS  56          3HZ       LYS  56 -22.291 -15.829   6.437
  438    H    TRP  57           H        TRP  57 -19.545  -9.992   3.279
  439    HA   TRP  57           HA       TRP  57 -19.971 -11.163   0.835
  440   1HB   TRP  57          1HB       TRP  57 -20.486  -8.996  -0.042
  441   2HB   TRP  57          2HB       TRP  57 -20.920  -8.975   1.668
  442    HD1  TRP  57           HD1      TRP  57 -19.755  -7.136   3.097
  443    HE1  TRP  57           HE1      TRP  57 -17.992  -5.327   2.555
  444    HE3  TRP  57           HE3      TRP  57 -18.340  -8.733  -1.489
  445    HZ2  TRP  57           HZ2      TRP  57 -16.146  -4.694   0.406
  446    HZ3  TRP  57           HZ3      TRP  57 -16.709  -7.495  -2.830
  447    HH2  TRP  57           HH2      TRP  57 -15.583  -5.480  -1.882
  448    H    VAL  58           H        VAL  58 -17.055  -9.308   1.651
  449    HA   VAL  58           HA       VAL  58 -15.871  -9.134  -0.879
  450    HB   VAL  58           HB       VAL  58 -13.652  -9.520   0.479
  451   1HG1  VAL  58          1HG1      VAL  58 -14.611  -7.351  -0.293
  452   2HG1  VAL  58          2HG1      VAL  58 -15.506  -7.267   1.223
  453   3HG1  VAL  58          3HG1      VAL  58 -13.747  -7.237   1.236
  454   1HG2  VAL  58          1HG2      VAL  58 -15.520 -10.331   2.384
  455   2HG2  VAL  58          2HG2      VAL  58 -13.819  -9.972   2.669
  456   3HG2  VAL  58          3HG2      VAL  58 -15.040  -8.719   2.880
  457    H    ARG  59           H        ARG  59 -15.371 -11.870   1.402
  458    HA   ARG  59           HA       ARG  59 -14.019 -13.468  -0.566
  459   1HB   ARG  59          2HB       ARG  59 -15.379 -14.174   2.048
  460   2HB   ARG  59          1HB       ARG  59 -14.500 -15.348   1.068
  461   1HG   ARG  59          2HG       ARG  59 -12.449 -14.099   1.301
  462   2HG   ARG  59          1HG       ARG  59 -13.283 -12.760   2.052
  463   1HD   ARG  59          1HD       ARG  59 -12.533 -13.804   3.963
  464   2HD   ARG  59          2HD       ARG  59 -14.040 -14.694   3.749
  465    HE   ARG  59           HE       ARG  59 -12.709 -16.510   2.702
  466   1HH1  ARG  59          1HH2      ARG  59 -10.916 -14.339   4.960
  467   2HH1  ARG  59          2HH2      ARG  59 -10.512 -15.913   5.557
  468   1HH2  ARG  59          1HH1      ARG  59 -10.344 -16.730   2.018
  469   2HH2  ARG  59          2HH1      ARG  59  -9.275 -16.622   3.377
  470    H    GLU  60           H        GLU  60 -17.371 -12.987   0.311
  471    HA   GLU  60           HA       GLU  60 -18.515 -15.306  -0.863
  472   1HB   GLU  60          2HB       GLU  60 -19.561 -12.488  -0.559
  473   2HB   GLU  60          1HB       GLU  60 -20.532 -13.778  -1.225
  474   1HG   GLU  60          2HG       GLU  60 -19.130 -14.175   1.401
  475   2HG   GLU  60          1HG       GLU  60 -20.655 -13.291   1.344
  476    H    TYR  61           H        TYR  61 -16.986 -12.541  -2.282
  477    HA   TYR  61           HA       TYR  61 -18.051 -13.285  -4.965
  478   1HB   TYR  61          1HB       TYR  61 -16.447 -10.838  -4.160
  479   2HB   TYR  61          2HB       TYR  61 -17.213 -11.118  -5.721
  480    HD1  TYR  61           HD2      TYR  61 -19.705 -12.532  -4.139
  481    HD2  TYR  61           HD1      TYR  61 -17.744  -8.683  -4.024
  482    HE1  TYR  61           HE2      TYR  61 -21.809 -11.481  -3.317
  483    HE2  TYR  61           HE1      TYR  61 -19.856  -7.634  -3.221
  484    HH   TYR  61           HH       TYR  61 -22.523  -8.410  -3.495
  485    H    ILE  62           H        ILE  62 -15.172 -13.146  -2.979
  486    HA   ILE  62           HA       ILE  62 -13.185 -13.415  -4.995
  487    HB   ILE  62           HB       ILE  62 -13.308 -14.517  -2.171
  488   1HG1  ILE  62          1HG1      ILE  62 -11.735 -12.182  -3.281
  489   2HG1  ILE  62          2HG1      ILE  62 -13.343 -12.004  -2.581
  490   1HG2  ILE  62          3HG2      ILE  62 -11.469 -15.146  -4.271
  491   2HG2  ILE  62          1HG2      ILE  62 -10.632 -14.135  -3.093
  492   3HG2  ILE  62          2HG2      ILE  62 -11.400 -15.636  -2.578
  493   1HD1  ILE  62          2HD1      ILE  62 -12.086 -13.503  -0.664
  494   2HD1  ILE  62          3HD1      ILE  62 -10.754 -12.509  -1.254
  495   3HD1  ILE  62          1HD1      ILE  62 -12.211 -11.745  -0.620
  496    H    ASN  63           H        ASN  63 -15.464 -15.730  -3.659
  497    HA   ASN  63           HA       ASN  63 -14.169 -17.923  -5.200
  498   1HB   ASN  63          2HB       ASN  63 -14.827 -18.292  -2.796
  499   2HB   ASN  63          1HB       ASN  63 -16.496 -18.090  -3.271
  500   1HD2  ASN  63          2HD2      ASN  63 -15.516 -21.282  -2.653
  501   2HD2  ASN  63          1HD2      ASN  63 -14.037 -20.951  -3.418
  502    H    SER  64           H        SER  64 -17.290 -16.247  -4.826
  503    HA   SER  64           HA       SER  64 -18.797 -17.709  -6.708
  504   1HB   SER  64          1HB       SER  64 -18.858 -14.849  -5.797
  505   2HB   SER  64          2HB       SER  64 -19.908 -15.366  -7.094
  506    HG   SER  64           HG       SER  64 -20.826 -16.869  -5.747
  507    H    LEU  65           H        LEU  65 -16.161 -15.500  -7.212
  508    HA   LEU  65           HA       LEU  65 -16.685 -14.690  -9.886
  509   1HB   LEU  65          2HB       LEU  65 -14.186 -15.056  -8.266
  510   2HB   LEU  65          1HB       LEU  65 -14.058 -14.711  -9.974
  511    HG   LEU  65           HG       LEU  65 -15.886 -13.038  -8.289
  512   1HD1  LEU  65          3HD1      LEU  65 -13.552 -13.257  -7.209
  513   2HD1  LEU  65          1HD1      LEU  65 -12.955 -12.388  -8.623
  514   3HD1  LEU  65          2HD1      LEU  65 -14.129 -11.626  -7.550
  515   1HD2  LEU  65          2HD2      LEU  65 -14.767 -13.032 -10.965
  516   2HD2  LEU  65          3HD2      LEU  65 -16.068 -12.042 -10.303
  517   3HD2  LEU  65          1HD2      LEU  65 -14.391 -11.525 -10.129
  518    H    GLU  66           H        GLU  66 -17.178 -16.120 -11.486
  519    HA   GLU  66           HA       GLU  66 -15.258 -18.293 -12.053
  520   1HB   GLU  66          1HB       GLU  66 -17.339 -19.013 -10.533
  521   2HB   GLU  66          2HB       GLU  66 -18.141 -19.077 -12.102
  522   1HG   GLU  66          1HG       GLU  66 -16.605 -20.693 -12.936
  523   2HG   GLU  66          2HG       GLU  66 -15.473 -20.411 -11.613
  524    H    MET  67           H        MET  67 -18.518 -17.170 -13.050
  525    HA   MET  67           HA       MET  67 -17.417 -16.828 -15.803
  526   1HB   MET  67          1HB       MET  67 -19.354 -18.764 -14.956
  527   2HB   MET  67          2HB       MET  67 -20.157 -17.588 -15.998
  528   1HG   MET  67          1HG       MET  67 -17.482 -18.692 -16.807
  529   2HG   MET  67          2HG       MET  67 -18.932 -19.661 -17.068
  530   1HE   MET  67          2HE       MET  67 -16.624 -18.222 -18.699
  531   2HE   MET  67          1HE       MET  67 -17.632 -19.031 -19.900
  532   3HE   MET  67          3HE       MET  67 -17.252 -17.318 -20.078
  533    H    SER  68           H        SER  68 -18.475 -15.165 -17.029
  534    HA   SER  68           HA       SER  68 -20.454 -13.512 -15.538
  535   1HB   SER  68          1HB       SER  68 -19.226 -11.522 -15.780
  536   2HB   SER  68          2HB       SER  68 -17.982 -12.696 -15.351
  537    HG   SER  68           HG       SER  68 -17.641 -12.962 -17.636
  538    H    SER   1           H        SER   1 -20.477  10.833   1.935
  539    HA   SER   1           HA       SER   1 -21.339  11.307  -0.821
  540   1HB   SER   1          1HB       SER   1 -19.097  12.050  -1.602
  541   2HB   SER   1          2HB       SER   1 -19.831  13.217  -0.504
  542    HG   SER   1           HG       SER   1 -17.656  11.526  -0.130
  543    HA   PRO   2           HA       PRO   2 -19.971   7.175  -1.312
  544   1HB   PRO   2          1HB       PRO   2 -18.773   7.579  -3.911
  545   2HB   PRO   2          2HB       PRO   2 -20.346   6.866  -3.538
  546   1HG   PRO   2          1HG       PRO   2 -19.813   9.455  -4.692
  547   2HG   PRO   2          2HG       PRO   2 -21.386   8.748  -4.307
  548   1HD   PRO   2          1HD       PRO   2 -20.024  10.889  -2.936
  549   2HD   PRO   2          2HD       PRO   2 -21.603  10.181  -2.551
  550    H    TYR   3           H        TYR   3 -17.701   6.281  -2.789
  551    HA   TYR   3           HA       TYR   3 -15.326   7.764  -2.053
  552   1HB   TYR   3          1HB       TYR   3 -16.478   5.900  -0.113
  553   2HB   TYR   3          2HB       TYR   3 -14.816   5.490  -0.536
  554    HD1  TYR   3           HD2      TYR   3 -13.431   7.943  -0.983
  555    HD2  TYR   3           HD1      TYR   3 -16.565   7.132   1.874
  556    HE1  TYR   3           HE2      TYR   3 -12.613   9.816   0.445
  557    HE2  TYR   3           HE1      TYR   3 -15.747   9.004   3.303
  558    HH   TYR   3           HH       TYR   3 -13.094  10.198   3.434
  559    H    SER   4           H        SER   4 -13.333   6.224  -2.324
  560    HA   SER   4           HA       SER   4 -13.875   3.942  -4.128
  561   1HB   SER   4          1HB       SER   4 -13.549   6.336  -5.325
  562   2HB   SER   4          2HB       SER   4 -11.853   5.889  -5.128
  563    HG   SER   4           HG       SER   4 -13.697   4.922  -6.846
  564    H    SER   5           H        SER   5 -11.784   2.753  -4.596
  565    HA   SER   5           HA       SER   5  -9.398   3.400  -3.112
  566   1HB   SER   5          1HB       SER   5 -11.424   2.290  -1.549
  567   2HB   SER   5          2HB       SER   5 -10.376   0.923  -1.926
  568    HG   SER   5           HG       SER   5  -9.729   3.358  -0.659
  569    H    ASP   6           H        ASP   6  -7.780   2.401  -4.187
  570    HA   ASP   6           HA       ASP   6  -8.307  -0.266  -5.426
  571   1HB   ASP   6          1HB       ASP   6  -7.189   0.432  -7.488
  572   2HB   ASP   6          2HB       ASP   6  -8.524   1.532  -7.165
  573    H    THR   7           H        THR   7  -5.651  -0.352  -6.618
  574    HA   THR   7           HA       THR   7  -4.223  -1.063  -4.182
  575    HB   THR   7           HB       THR   7  -4.143  -2.509  -6.195
  576    HG1  THR   7           HG1      THR   7  -2.076  -2.994  -5.887
  577   1HG2  THR   7          3HG2      THR   7  -4.002  -0.274  -7.652
  578   2HG2  THR   7          1HG2      THR   7  -2.273  -0.594  -7.520
  579   3HG2  THR   7          2HG2      THR   7  -3.339  -1.799  -8.239
  580    H    THR   8           H        THR   8  -1.789  -0.465  -4.111
  581    HA   THR   8           HA       THR   8  -1.303   2.318  -5.055
  582    HB   THR   8           HB       THR   8  -0.730   1.418  -2.216
  583    HG1  THR   8           HG1      THR   8  -2.916   2.794  -3.353
  584   1HG2  THR   8          1HG2      THR   8   0.151   3.596  -3.799
  585   2HG2  THR   8          2HG2      THR   8  -1.021   4.252  -2.655
  586   3HG2  THR   8          3HG2      THR   8   0.386   3.368  -2.065
  587    HA   PRO   9           HA       PRO   9   2.259  -0.254  -6.157
  588   1HB   PRO   9          1HB       PRO   9   3.235   1.975  -7.699
  589   2HB   PRO   9          2HB       PRO   9   2.509   0.479  -8.296
  590   1HG   PRO   9          2HG       PRO   9   1.335   3.126  -8.237
  591   2HG   PRO   9          1HG       PRO   9   0.624   1.640  -8.870
  592   1HD   PRO   9          2HD       PRO   9  -0.080   3.034  -6.482
  593   2HD   PRO   9          1HD       PRO   9  -0.765   1.538  -7.100
  594    H    CYS  10           H        CYS  10   3.547  -0.290  -4.332
  595    HA   CYS  10           HA       CYS  10   5.636   1.712  -4.086
  596   1HB   CYS  10          2HB       CYS  10   5.109   2.197  -1.653
  597   2HB   CYS  10          1HB       CYS  10   4.042   2.957  -2.806
  598    H    CYS  11           H        CYS  11   7.415   0.878  -2.922
  599    HA   CYS  11           HA       CYS  11   7.158  -2.004  -2.466
  600   1HB   CYS  11          1HB       CYS  11   9.617  -1.993  -2.233
  601   2HB   CYS  11          2HB       CYS  11   9.044  -1.352  -3.760
  602    H    PHE  12           H        PHE  12   7.833  -3.055  -0.518
  603    HA   PHE  12           HA       PHE  12   7.342  -1.384   1.883
  604   1HB   PHE  12          2HB       PHE  12   7.057  -3.588   3.034
  605   2HB   PHE  12          1HB       PHE  12   5.939  -3.356   1.714
  606    HD1  PHE  12           HD2      PHE  12   8.942  -5.178   2.852
  607    HD2  PHE  12           HD1      PHE  12   6.125  -4.627  -0.371
  608    HE1  PHE  12           HE2      PHE  12   9.753  -7.280   1.785
  609    HE2  PHE  12           HE1      PHE  12   6.925  -6.737  -1.432
  610    HZ   PHE  12           HZ       PHE  12   8.743  -8.060  -0.355
  611    H    ALA  13           H        ALA  13   9.690  -3.803   0.679
  612    HA   ALA  13           HA       ALA  13  11.523  -2.942   2.868
  613   1HB   ALA  13          1HB       ALA  13  11.055  -5.373   2.731
  614   2HB   ALA  13          2HB       ALA  13  11.668  -5.384   1.078
  615   3HB   ALA  13          3HB       ALA  13  12.755  -5.022   2.419
  616    H    TYR  14           H        TYR  14  13.376  -1.906   2.417
  617    HA   TYR  14           HA       TYR  14  13.843  -1.233  -0.414
  618   1HB   TYR  14          1HB       TYR  14  15.734  -0.037   1.456
  619   2HB   TYR  14          2HB       TYR  14  14.680   0.743   0.309
  620    HD1  TYR  14           HD2      TYR  14  12.399   1.471   0.942
  621    HD2  TYR  14           HD1      TYR  14  15.034  -0.444   3.777
  622    HE1  TYR  14           HE2      TYR  14  10.917   2.193   2.809
  623    HE2  TYR  14           HE1      TYR  14  13.550   0.280   5.643
  624    HH   TYR  14           HH       TYR  14  11.539   2.590   5.609
  625    H    ILE  15           H        ILE  15  15.418  -2.236  -1.567
  626    HA   ILE  15           HA       ILE  15  16.904  -4.427  -0.630
  627    HB   ILE  15           HB       ILE  15  17.642  -2.508  -2.864
  628   1HG1  ILE  15          2HG1      ILE  15  16.063  -5.099  -2.890
  629   2HG1  ILE  15          1HG1      ILE  15  15.382  -3.486  -3.097
  630   1HG2  ILE  15          1HG2      ILE  15  18.991  -4.795  -1.755
  631   2HG2  ILE  15          2HG2      ILE  15  18.433  -5.187  -3.382
  632   3HG2  ILE  15          3HG2      ILE  15  19.475  -3.789  -3.120
  633   1HD1  ILE  15          2HD1      ILE  15  17.061  -3.235  -5.045
  634   2HD1  ILE  15          3HD1      ILE  15  17.245  -4.985  -4.941
  635   3HD1  ILE  15          1HD1      ILE  15  15.670  -4.285  -5.310
  636    H    ALA  16           H        ALA  16  18.762  -4.607   0.543
  637    HA   ALA  16           HA       ALA  16  19.951  -2.171   1.653
  638   1HB   ALA  16          2HB       ALA  16  19.602  -4.687   2.630
  639   2HB   ALA  16          3HB       ALA  16  21.284  -4.775   2.106
  640   3HB   ALA  16          1HB       ALA  16  20.786  -3.548   3.271
  641    H    ARG  17           H        ARG  17  20.721  -1.353  -0.464
  642    HA   ARG  17           HA       ARG  17  23.463  -1.619  -0.893
  643   1HB   ARG  17          2HB       ARG  17  21.920  -3.802  -2.095
  644   2HB   ARG  17          1HB       ARG  17  22.918  -2.937  -3.265
  645   1HG   ARG  17          1HG       ARG  17  24.473  -3.284  -0.898
  646   2HG   ARG  17          2HG       ARG  17  23.747  -4.843  -1.292
  647   1HD   ARG  17          1HD       ARG  17  24.520  -4.387  -3.710
  648   2HD   ARG  17          2HD       ARG  17  25.530  -3.119  -3.016
  649    HE   ARG  17           HE       ARG  17  25.819  -5.765  -1.764
  650   1HH1  ARG  17          1HH2      ARG  17  27.961  -3.672  -1.712
  651   2HH1  ARG  17          2HH2      ARG  17  29.132  -4.463  -2.714
  652   1HH2  ARG  17          1HH1      ARG  17  27.021  -6.634  -4.177
  653   2HH2  ARG  17          2HH1      ARG  17  28.130  -5.417  -4.716
  654    HA   PRO  18           HA       PRO  18  21.629   1.953  -2.993
  655   1HB   PRO  18          2HB       PRO  18  24.317   2.739  -3.708
  656   2HB   PRO  18          1HB       PRO  18  23.250   3.494  -2.560
  657   1HG   PRO  18          1HG       PRO  18  25.558   1.863  -2.000
  658   2HG   PRO  18          2HG       PRO  18  24.497   2.671  -0.842
  659   1HD   PRO  18          1HD       PRO  18  24.674  -0.127  -1.342
  660   2HD   PRO  18          2HD       PRO  18  23.507   0.688  -0.314
  661    H    LEU  19           H        LEU  19  20.741   1.246  -4.907
  662    HA   LEU  19           HA       LEU  19  22.037  -0.379  -6.850
  663   1HB   LEU  19          1HB       LEU  19  19.864   1.642  -7.457
  664   2HB   LEU  19          2HB       LEU  19  20.206   0.146  -8.319
  665    HG   LEU  19           HG       LEU  19  19.149   0.389  -5.486
  666   1HD1  LEU  19          1HD1      LEU  19  17.567   0.780  -7.426
  667   2HD1  LEU  19          2HD1      LEU  19  17.901  -0.875  -7.936
  668   3HD1  LEU  19          3HD1      LEU  19  17.132  -0.570  -6.378
  669   1HD2  LEU  19          2HD2      LEU  19  20.512  -1.788  -6.906
  670   2HD2  LEU  19          3HD2      LEU  19  20.163  -1.616  -5.185
  671   3HD2  LEU  19          1HD2      LEU  19  18.929  -2.250  -6.277
  672    HA   PRO  20           HA       PRO  20  24.774   2.363  -8.932
  673   1HB   PRO  20          1HB       PRO  20  24.019   1.451 -11.576
  674   2HB   PRO  20          2HB       PRO  20  25.475   1.049 -10.658
  675   1HG   PRO  20          1HG       PRO  20  23.217  -0.654 -11.195
  676   2HG   PRO  20          2HG       PRO  20  24.648  -1.036 -10.230
  677   1HD   PRO  20          1HD       PRO  20  21.960  -0.529  -9.300
  678   2HD   PRO  20          2HD       PRO  20  23.391  -0.937  -8.334
  679    H    ARG  21           H        ARG  21  24.107   4.481  -8.964
  680    HA   ARG  21           HA       ARG  21  21.611   5.510  -9.636
  681   1HB   ARG  21          1HB       ARG  21  23.416   6.835  -8.587
  682   2HB   ARG  21          2HB       ARG  21  24.286   6.854 -10.120
  683   1HG   ARG  21          1HG       ARG  21  21.442   7.771 -10.125
  684   2HG   ARG  21          2HG       ARG  21  22.651   8.848  -9.426
  685   1HD   ARG  21          2HD       ARG  21  23.577   7.690 -11.933
  686   2HD   ARG  21          1HD       ARG  21  22.059   8.563 -12.147
  687    HE   ARG  21           HE       ARG  21  23.829  10.163 -10.574
  688   1HH1  ARG  21          1HH2      ARG  21  25.924   9.528 -12.499
  689   2HH1  ARG  21          2HH2      ARG  21  25.390  10.111 -14.041
  690   1HH2  ARG  21          1HH1      ARG  21  23.109  12.066 -12.580
  691   2HH2  ARG  21          2HH1      ARG  21  23.080  11.155 -14.053
  692    H    ALA  22           H        ALA  22  24.326   4.899 -11.865
  693    HA   ALA  22           HA       ALA  22  22.959   6.048 -14.145
  694   1HB   ALA  22          2HB       ALA  22  25.521   5.498 -13.746
  695   2HB   ALA  22          3HB       ALA  22  25.075   3.953 -14.469
  696   3HB   ALA  22          1HB       ALA  22  24.836   5.449 -15.371
  697    H    HIS  23           H        HIS  23  23.158   2.805 -12.764
  698    HA   HIS  23           HA       HIS  23  21.961   1.457 -15.014
  699   1HB   HIS  23          1HB       HIS  23  22.139   0.723 -12.087
  700   2HB   HIS  23          2HB       HIS  23  21.483  -0.340 -13.307
  701    HD2  HIS  23           HD2      HIS  23  24.652   1.770 -14.230
  702    HE1  HIS  23           HE1      HIS  23  25.854  -2.257 -13.765
  703    HE2  HIS  23           HE2      HIS  23  26.601   0.058 -14.513
  704    H    ILE  24           H        ILE  24  20.618   3.266 -12.301
  705    HA   ILE  24           HA       ILE  24  17.933   2.210 -12.733
  706    HB   ILE  24           HB       ILE  24  18.542   4.762 -11.295
  707   1HG1  ILE  24          1HG1      ILE  24  18.661   1.981 -10.118
  708   2HG1  ILE  24          2HG1      ILE  24  20.060   2.967 -10.458
  709   1HG2  ILE  24          3HG2      ILE  24  16.276   2.922 -11.589
  710   2HG2  ILE  24          1HG2      ILE  24  16.617   3.366  -9.920
  711   3HG2  ILE  24          2HG2      ILE  24  16.289   4.620 -11.116
  712   1HD1  ILE  24          1HD1      ILE  24  18.025   4.412  -8.937
  713   2HD1  ILE  24          2HD1      ILE  24  18.622   2.987  -8.086
  714   3HD1  ILE  24          3HD1      ILE  24  19.750   4.239  -8.610
  715    H    LYS  25           H        LYS  25  16.112   3.744 -13.306
  716    HA   LYS  25           HA       LYS  25  17.029   5.770 -15.304
  717   1HB   LYS  25          1HB       LYS  25  16.125   3.822 -16.475
  718   2HB   LYS  25          2HB       LYS  25  14.672   3.880 -15.510
  719   1HG   LYS  25          1HG       LYS  25  13.905   5.849 -16.532
  720   2HG   LYS  25          2HG       LYS  25  15.514   6.279 -17.112
  721   1HD   LYS  25          1HD       LYS  25  15.356   4.092 -18.508
  722   2HD   LYS  25          2HD       LYS  25  13.626   4.182 -18.179
  723   1HE   LYS  25          1HE       LYS  25  14.857   6.717 -19.076
  724   2HE   LYS  25          2HE       LYS  25  14.845   5.430 -20.282
  725   1HZ   LYS  25          2HZ       LYS  25  12.398   5.167 -19.461
  726   2HZ   LYS  25          3HZ       LYS  25  12.592   6.785 -18.985
  727   3HZ   LYS  25          1HZ       LYS  25  12.799   6.349 -20.613
  728    H    GLU  26           H        GLU  26  14.291   4.796 -13.191
  729    HA   GLU  26           HA       GLU  26  13.804   7.654 -12.629
  730   1HB   GLU  26          2HB       GLU  26  12.156   7.479 -14.216
  731   2HB   GLU  26          1HB       GLU  26  12.144   5.751 -14.160
  732   1HG   GLU  26          2HG       GLU  26  10.057   6.202 -13.378
  733   2HG   GLU  26          1HG       GLU  26  10.891   6.123 -11.869
  734    H    TYR  27           H        TYR  27  12.002   7.644 -10.775
  735    HA   TYR  27           HA       TYR  27  12.266   5.247  -9.080
  736   1HB   TYR  27          1HB       TYR  27  12.867   6.532  -7.122
  737   2HB   TYR  27          2HB       TYR  27  14.011   6.941  -8.375
  738    HD1  TYR  27           HD2      TYR  27  13.752   9.104  -9.667
  739    HD2  TYR  27           HD1      TYR  27  11.357   8.159  -6.201
  740    HE1  TYR  27           HE2      TYR  27  13.105  11.504  -9.458
  741    HE2  TYR  27           HE1      TYR  27  10.711  10.557  -5.992
  742    HH   TYR  27           HH       TYR  27  11.611  12.929  -8.458
  743    H    PHE  28           H        PHE  28  10.607   5.634  -7.107
  744    HA   PHE  28           HA       PHE  28   8.391   7.314  -8.044
  745   1HB   PHE  28          1HB       PHE  28   7.925   5.210  -9.155
  746   2HB   PHE  28          2HB       PHE  28   8.141   4.328  -7.648
  747    HD1  PHE  28           HD1      PHE  28   5.940   6.656  -9.515
  748    HD2  PHE  28           HD2      PHE  28   6.428   4.319  -5.918
  749    HE1  PHE  28           HE1      PHE  28   3.543   7.034  -8.942
  750    HE2  PHE  28           HE2      PHE  28   4.046   4.726  -5.327
  751    HZ   PHE  28           HZ       PHE  28   2.594   6.065  -6.850
  752    H    TYR  29           H        TYR  29   8.776   8.536  -6.113
  753    HA   TYR  29           HA       TYR  29   8.848   7.313  -3.525
  754   1HB   TYR  29          2HB       TYR  29   9.677   9.588  -3.894
  755   2HB   TYR  29          1HB       TYR  29   8.074  10.125  -4.320
  756    HD1  TYR  29           HD2      TYR  29  10.137   8.739  -1.545
  757    HD2  TYR  29           HD1      TYR  29   6.459  10.708  -2.654
  758    HE1  TYR  29           HE2      TYR  29   9.662   9.203   0.856
  759    HE2  TYR  29           HE1      TYR  29   5.985  11.175  -0.253
  760    HH   TYR  29           HH       TYR  29   7.674   9.675   2.289
  761    H    THR  30           H        THR  30   7.243   6.530  -2.344
  762    HA   THR  30           HA       THR  30   4.475   6.708  -3.357
  763    HB   THR  30           HB       THR  30   5.186   4.516  -2.652
  764    HG1  THR  30           HG1      THR  30   3.620   4.108  -1.119
  765   1HG2  THR  30          3HG2      THR  30   6.090   5.994  -0.185
  766   2HG2  THR  30          1HG2      THR  30   5.785   4.257  -0.139
  767   3HG2  THR  30          2HG2      THR  30   7.018   4.907  -1.219
  768    H    SER  31           H        SER  31   2.738   6.978  -1.527
  769    HA   SER  31           HA       SER  31   3.390   9.512  -0.143
  770   1HB   SER  31          1HB       SER  31   0.710   8.113  -0.314
  771   2HB   SER  31          2HB       SER  31   1.014   9.802   0.097
  772    HG   SER  31           HG       SER  31   1.690  10.176  -1.983
  773    H    GLY  32           H        GLY  32   1.403   9.236   1.921
  774   1HA   GLY  32          2HA       GLY  32   2.935   7.483   3.762
  775   2HA   GLY  32          1HA       GLY  32   1.825   8.760   4.252
  776    H    LYS  33           H        LYS  33   1.064   6.340   1.805
  777    HA   LYS  33           HA       LYS  33  -0.868   5.114   3.733
  778   1HB   LYS  33          2HB       LYS  33  -2.350   4.768   1.705
  779   2HB   LYS  33          1HB       LYS  33  -2.175   6.432   2.210
  780   1HG   LYS  33          1HG       LYS  33  -0.337   6.691   0.517
  781   2HG   LYS  33          2HG       LYS  33  -0.703   5.064  -0.055
  782   1HD   LYS  33          2HD       LYS  33  -1.854   6.777  -1.418
  783   2HD   LYS  33          1HD       LYS  33  -3.003   5.762  -0.580
  784   1HE   LYS  33          1HE       LYS  33  -3.639   7.443   0.880
  785   2HE   LYS  33          2HE       LYS  33  -2.074   8.250   0.790
  786   1HZ   LYS  33          2HZ       LYS  33  -3.942   8.127  -1.504
  787   2HZ   LYS  33          3HZ       LYS  33  -3.973   9.389  -0.368
  788   3HZ   LYS  33          1HZ       LYS  33  -2.584   9.130  -1.312
  789    H    CYS  34           H        CYS  34   1.831   4.252   3.048
  790    HA   CYS  34           HA       CYS  34   1.164   1.622   1.791
  791   1HB   CYS  34          2HB       CYS  34   2.529   3.199   0.326
  792   2HB   CYS  34          1HB       CYS  34   3.819   3.051   1.516
  793    H    SER  35           H        SER  35   2.061   3.116   4.612
  794    HA   SER  35           HA       SER  35   3.164   2.400   6.555
  795   1HB   SER  35          1HB       SER  35   1.426   0.648   6.375
  796   2HB   SER  35          2HB       SER  35   2.511  -0.315   5.371
  797    HG   SER  35           HG       SER  35   2.491   0.069   8.082
  798    H    ASN  36           H        ASN  36   4.713   2.730   4.005
  799    HA   ASN  36           HA       ASN  36   7.278   1.911   4.954
  800   1HB   ASN  36          1HB       ASN  36   5.800  -0.037   3.312
  801   2HB   ASN  36          2HB       ASN  36   7.410   0.344   2.703
  802   1HD2  ASN  36          1HD2      ASN  36   8.680  -0.105   6.108
  803   2HD2  ASN  36          2HD2      ASN  36   9.328  -0.116   4.539
  804    HA   PRO  37           HA       PRO  37   6.793   5.169   1.638
  805   1HB   PRO  37          1HB       PRO  37   8.762   6.663   3.159
  806   2HB   PRO  37          2HB       PRO  37   7.082   7.098   2.818
  807   1HG   PRO  37          2HG       PRO  37   8.182   6.205   5.318
  808   2HG   PRO  37          1HG       PRO  37   6.509   6.588   4.969
  809   1HD   PRO  37          2HD       PRO  37   7.664   3.988   5.410
  810   2HD   PRO  37          1HD       PRO  37   5.972   4.374   5.041
  811    H    ALA  38           H        ALA  38   8.503   5.807   0.134
  812    HA   ALA  38           HA       ALA  38  11.260   5.187   0.408
  813   1HB   ALA  38          1HB       ALA  38   9.887   2.821   0.351
  814   2HB   ALA  38          2HB       ALA  38  10.107   3.076  -1.379
  815   3HB   ALA  38          3HB       ALA  38  11.509   2.997  -0.310
  816    H    VAL  39           H        VAL  39  11.723   4.258  -2.245
  817    HA   VAL  39           HA       VAL  39  10.270   6.091  -4.043
  818    HB   VAL  39           HB       VAL  39  12.657   6.752  -4.969
  819   1HG1  VAL  39          1HG1      VAL  39  10.725   7.969  -3.311
  820   2HG1  VAL  39          2HG1      VAL  39  12.292   8.387  -2.618
  821   3HG1  VAL  39          3HG1      VAL  39  11.940   8.774  -4.303
  822   1HG2  VAL  39          1HG2      VAL  39  13.828   5.319  -3.265
  823   2HG2  VAL  39          2HG2      VAL  39  14.346   7.004  -3.259
  824   3HG2  VAL  39          3HG2      VAL  39  13.242   6.416  -2.016
  825    H    VAL  40           H        VAL  40   9.535   4.235  -4.975
  826    HA   VAL  40           HA       VAL  40  11.073   1.935  -5.505
  827    HB   VAL  40           HB       VAL  40   8.449   3.018  -6.302
  828   1HG1  VAL  40          3HG1      VAL  40   9.362   2.326  -8.511
  829   2HG1  VAL  40          1HG1      VAL  40   9.702   0.731  -7.844
  830   3HG1  VAL  40          2HG1      VAL  40   8.036   1.293  -7.984
  831   1HG2  VAL  40          1HG2      VAL  40   9.695   0.664  -4.997
  832   2HG2  VAL  40          2HG2      VAL  40   8.252   1.572  -4.538
  833   3HG2  VAL  40          3HG2      VAL  40   8.165   0.370  -5.826
  834    H    PHE  41           H        PHE  41  12.770   1.739  -6.775
  835    HA   PHE  41           HA       PHE  41  13.312   3.668  -8.872
  836   1HB   PHE  41          1HB       PHE  41  14.714   1.259  -7.774
  837   2HB   PHE  41          2HB       PHE  41  15.207   1.898  -9.322
  838    HD1  PHE  41           HD2      PHE  41  14.845   4.824  -8.968
  839    HD2  PHE  41           HD1      PHE  41  16.423   1.847  -6.267
  840    HE1  PHE  41           HE2      PHE  41  16.231   6.570  -7.849
  841    HE2  PHE  41           HE1      PHE  41  17.820   3.585  -5.169
  842    HZ   PHE  41           HZ       PHE  41  17.738   5.946  -5.959
  843    H    VAL  42           H        VAL  42  13.900   2.926 -10.988
  844    HA   VAL  42           HA       VAL  42  12.448   0.581 -12.054
  845    HB   VAL  42           HB       VAL  42  11.915   2.475 -13.967
  846   1HG1  VAL  42          2HG2      VAL  42  10.517   0.655 -12.550
  847   2HG1  VAL  42          3HG2      VAL  42   9.858   2.136 -11.852
  848   3HG1  VAL  42          1HG2      VAL  42   9.736   1.849 -13.589
  849   1HG2  VAL  42          3HG1      VAL  42  11.657   3.801 -11.281
  850   2HG2  VAL  42          1HG1      VAL  42  12.434   4.404 -12.744
  851   3HG2  VAL  42          2HG1      VAL  42  10.680   4.275 -12.668
  852    H    THR  43           H        THR  43  14.746  -0.050 -12.244
  853    HA   THR  43           HA       THR  43  16.575   1.689 -13.727
  854    HB   THR  43           HB       THR  43  18.273   0.167 -13.141
  855    HG1  THR  43           HG1      THR  43  17.776  -1.980 -12.547
  856   1HG2  THR  43          3HG2      THR  43  17.149   1.251 -11.174
  857   2HG2  THR  43          1HG2      THR  43  16.194  -0.217 -10.971
  858   3HG2  THR  43          2HG2      THR  43  17.947  -0.271 -10.784
  859    H    ARG  44           H        ARG  44  18.096  -0.340 -15.061
  860    HA   ARG  44           HA       ARG  44  17.121  -0.133 -17.639
  861   1HB   ARG  44          1HB       ARG  44  18.508  -2.263 -18.092
  862   2HB   ARG  44          2HB       ARG  44  19.348  -0.883 -17.441
  863   1HG   ARG  44          1HG       ARG  44  18.424  -2.259 -15.182
  864   2HG   ARG  44          2HG       ARG  44  18.983  -3.518 -16.278
  865   1HD   ARG  44          1HD       ARG  44  20.681  -1.076 -15.869
  866   2HD   ARG  44          2HD       ARG  44  20.682  -2.338 -14.638
  867    HE   ARG  44           HE       ARG  44  21.661  -3.853 -16.242
  868   1HH1  ARG  44          1HH1      ARG  44  20.845  -3.630 -18.837
  869   2HH1  ARG  44          2HH1      ARG  44  22.158  -2.782 -19.582
  870   1HH2  ARG  44          1HH2      ARG  44  22.745  -0.851 -16.751
  871   2HH2  ARG  44          2HH2      ARG  44  23.238  -1.155 -18.382
  872    H    LYS  45           H        LYS  45  16.755  -3.089 -15.607
  873    HA   LYS  45           HA       LYS  45  14.818  -4.309 -17.352
  874   1HB   LYS  45          2HB       LYS  45  15.721  -4.690 -14.541
  875   2HB   LYS  45          1HB       LYS  45  14.093  -5.258 -14.910
  876   1HG   LYS  45          1HG       LYS  45  16.228  -5.953 -16.866
  877   2HG   LYS  45          2HG       LYS  45  16.277  -6.783 -15.311
  878   1HD   LYS  45          1HD       LYS  45  14.314  -7.909 -15.697
  879   2HD   LYS  45          2HD       LYS  45  13.618  -6.587 -16.634
  880   1HE   LYS  45          1HE       LYS  45  15.308  -7.155 -18.456
  881   2HE   LYS  45          2HE       LYS  45  15.664  -8.623 -17.546
  882   1HZ   LYS  45          3HZ       LYS  45  12.861  -8.004 -18.109
  883   2HZ   LYS  45          1HZ       LYS  45  13.819  -8.570 -19.393
  884   3HZ   LYS  45          2HZ       LYS  45  13.636  -9.510 -17.990
  885    H    ASN  46           H        ASN  46  14.764  -1.910 -14.847
  886    HA   ASN  46           HA       ASN  46  13.230  -0.292 -14.282
  887   1HB   ASN  46          2HB       ASN  46  12.554  -1.046 -16.959
  888   2HB   ASN  46          1HB       ASN  46  11.057  -0.892 -16.077
  889   1HD2  ASN  46          1HD2      ASN  46  11.446   2.508 -17.096
  890   2HD2  ASN  46          2HD2      ASN  46  10.389   1.186 -16.952
  891    H    ARG  47           H        ARG  47  12.992  -3.284 -13.501
  892    HA   ARG  47           HA       ARG  47  10.230  -3.717 -12.829
  893   1HB   ARG  47          2HB       ARG  47  12.866  -4.578 -11.665
  894   2HB   ARG  47          1HB       ARG  47  11.408  -4.814 -10.712
  895   1HG   ARG  47          1HG       ARG  47  10.633  -5.740 -13.188
  896   2HG   ARG  47          2HG       ARG  47  12.325  -6.228 -13.127
  897   1HD   ARG  47          1HD       ARG  47  11.969  -7.724 -11.434
  898   2HD   ARG  47          2HD       ARG  47  10.755  -6.708 -10.657
  899    HE   ARG  47           HE       ARG  47   9.446  -7.530 -12.911
  900   1HH1  ARG  47          2HH2      ARG  47  10.929  -9.958 -13.323
  901   2HH1  ARG  47          1HH2      ARG  47  10.553 -11.022 -12.010
  902   1HH2  ARG  47          1HH1      ARG  47   9.270  -9.266  -9.931
  903   2HH2  ARG  47          2HH1      ARG  47   8.105  -9.815 -11.090
  904    H    GLN  48           H        GLN  48   9.222  -3.030 -10.679
  905    HA   GLN  48           HA       GLN  48  10.258  -0.372 -10.092
  906   1HB   GLN  48          1HB       GLN  48   7.718  -1.775  -9.607
  907   2HB   GLN  48          2HB       GLN  48   8.167  -0.582  -8.406
  908   1HG   GLN  48          1HG       GLN  48   8.564   1.075 -10.183
  909   2HG   GLN  48          2HG       GLN  48   8.169  -0.122 -11.406
  910   1HE2  GLN  48          1HE2      GLN  48   5.525   0.604  -8.524
  911   2HE2  GLN  48          2HE2      GLN  48   6.231   2.072  -9.003
  912    H    VAL  49           H        VAL  49  12.182  -1.131  -9.297
  913    HA   VAL  49           HA       VAL  49  12.632  -2.827  -7.115
  914    HB   VAL  49           HB       VAL  49  14.509  -0.598  -7.194
  915   1HG1  VAL  49          2HG1      VAL  49  14.586  -3.578  -7.579
  916   2HG1  VAL  49          3HG1      VAL  49  16.030  -2.586  -7.780
  917   3HG1  VAL  49          1HG1      VAL  49  15.198  -2.630  -6.224
  918   1HG2  VAL  49          3HG2      VAL  49  13.846  -2.008  -9.817
  919   2HG2  VAL  49          1HG2      VAL  49  13.996  -0.275  -9.545
  920   3HG2  VAL  49          2HG2      VAL  49  15.430  -1.298  -9.513
  921    H    CYS  50           H        CYS  50  14.098  -1.310  -5.250
  922    HA   CYS  50           HA       CYS  50  12.078   0.511  -4.023
  923   1HB   CYS  50          1HB       CYS  50  12.184  -2.016  -3.209
  924   2HB   CYS  50          2HB       CYS  50  13.600  -1.450  -2.334
  925    H    ALA  51           H        ALA  51  12.992   2.101  -2.670
  926    HA   ALA  51           HA       ALA  51  15.845   2.025  -2.006
  927   1HB   ALA  51          2HB       ALA  51  14.929   3.460  -4.357
  928   2HB   ALA  51          3HB       ALA  51  15.586   4.576  -3.159
  929   3HB   ALA  51          1HB       ALA  51  16.570   3.240  -3.746
  930    H    ASN  52           H        ASN  52  15.819   2.548  -0.044
  931    HA   ASN  52           HA       ASN  52  13.834   3.543   1.526
  932   1HB   ASN  52          1HB       ASN  52  16.104   2.657   2.149
  933   2HB   ASN  52          2HB       ASN  52  16.759   4.224   1.778
  934   1HD2  ASN  52          1HD2      ASN  52  14.315   3.826   5.075
  935   2HD2  ASN  52          2HD2      ASN  52  14.155   2.746   3.775
  936    HA   PRO  53           HA       PRO  53  13.336   7.743   0.257
  937   1HB   PRO  53          1HB       PRO  53  11.916   8.583   2.516
  938   2HB   PRO  53          2HB       PRO  53  11.211   7.818   1.105
  939   1HG   PRO  53          2HG       PRO  53  11.622   6.707   3.792
  940   2HG   PRO  53          1HG       PRO  53  10.620   6.088   2.480
  941   1HD   PRO  53          1HD       PRO  53  13.167   5.099   3.329
  942   2HD   PRO  53          2HD       PRO  53  12.216   4.540   1.961
  943    H    GLU  54           H        GLU  54  15.233   6.808   2.926
  944    HA   GLU  54           HA       GLU  54  16.267   9.582   3.159
  945   1HB   GLU  54          1HB       GLU  54  14.474   8.944   4.954
  946   2HB   GLU  54          2HB       GLU  54  15.787   8.012   5.674
  947   1HG   GLU  54          1HG       GLU  54  16.076  10.072   6.723
  948   2HG   GLU  54          2HG       GLU  54  17.152  10.245   5.336
  949    H    LYS  55           H        LYS  55  17.270   6.745   2.265
  950    HA   LYS  55           HA       LYS  55  19.507   6.368   4.151
  951   1HB   LYS  55          1HB       LYS  55  18.518   4.894   1.757
  952   2HB   LYS  55          2HB       LYS  55  20.192   4.706   2.201
  953   1HG   LYS  55          1HG       LYS  55  18.558   4.560   4.566
  954   2HG   LYS  55          2HG       LYS  55  17.958   3.420   3.363
  955   1HD   LYS  55          1HD       LYS  55  19.904   2.178   3.366
  956   2HD   LYS  55          2HD       LYS  55  20.912   3.565   3.780
  957   1HE   LYS  55          1HE       LYS  55  20.662   3.224   6.014
  958   2HE   LYS  55          2HE       LYS  55  18.945   2.852   5.855
  959   1HZ   LYS  55          2HZ       LYS  55  19.701   0.673   4.865
  960   2HZ   LYS  55          3HZ       LYS  55  21.254   1.047   5.446
  961   3HZ   LYS  55          1HZ       LYS  55  19.959   0.870   6.532
  962    H    LYS  56           H        LYS  56  19.545   8.938   2.994
  963    HA   LYS  56           HA       LYS  56  20.940  10.420   1.852
  964   1HB   LYS  56          1HB       LYS  56  22.618   8.280   2.982
  965   2HB   LYS  56          2HB       LYS  56  23.383   9.192   1.681
  966   1HG   LYS  56          1HG       LYS  56  21.962  10.563   3.969
  967   2HG   LYS  56          2HG       LYS  56  23.666  10.120   4.062
  968   1HD   LYS  56          1HD       LYS  56  23.281  11.378   1.547
  969   2HD   LYS  56          2HD       LYS  56  22.472  12.384   2.748
  970   1HE   LYS  56          1HE       LYS  56  24.676  11.997   4.134
  971   2HE   LYS  56          2HE       LYS  56  25.372  11.624   2.558
  972   1HZ   LYS  56          1HZ       LYS  56  24.214  13.807   1.861
  973   2HZ   LYS  56          2HZ       LYS  56  24.215  14.149   3.525
  974   3HZ   LYS  56          3HZ       LYS  56  25.682  13.883   2.711
  975    H    TRP  57           H        TRP  57  22.759   7.672   0.602
  976    HA   TRP  57           HA       TRP  57  23.024   8.483  -2.003
  977   1HB   TRP  57          1HB       TRP  57  23.485   6.211  -2.597
  978   2HB   TRP  57          2HB       TRP  57  24.027   6.427  -0.931
  979    HD1  TRP  57           HD1      TRP  57  22.965   4.810   0.809
  980    HE1  TRP  57           HE1      TRP  57  21.173   2.957   0.640
  981    HE3  TRP  57           HE3      TRP  57  21.247   5.766  -3.852
  982    HZ2  TRP  57           HZ2      TRP  57  19.194   2.042  -1.275
  983    HZ3  TRP  57           HZ3      TRP  57  19.532   4.366  -4.897
  984    HH2  TRP  57           HH2      TRP  57  18.476   2.510  -3.611
  985    H    VAL  58           H        VAL  58  20.160   6.795  -0.749
  986    HA   VAL  58           HA       VAL  58  18.834   6.279  -3.162
  987    HB   VAL  58           HB       VAL  58  16.696   6.898  -1.774
  988   1HG1  VAL  58          1HG1      VAL  58  17.586   4.613  -2.291
  989   2HG1  VAL  58          2HG1      VAL  58  18.570   4.715  -0.832
  990   3HG1  VAL  58          3HG1      VAL  58  16.813   4.711  -0.712
  991   1HG2  VAL  58          1HG2      VAL  58  18.669   7.902  -0.071
  992   2HG2  VAL  58          2HG2      VAL  58  16.982   7.609   0.344
  993   3HG2  VAL  58          3HG2      VAL  58  18.199   6.373   0.652
  994    H    ARG  59           H        ARG  59  18.466   9.299  -1.249
  995    HA   ARG  59           HA       ARG  59  16.983  10.620  -3.324
  996   1HB   ARG  59          2HB       ARG  59  18.512  11.670  -0.929
  997   2HB   ARG  59          1HB       ARG  59  17.561  12.702  -1.997
  998   1HG   ARG  59          1HG       ARG  59  15.538  11.498  -1.460
  999   2HG   ARG  59          2HG       ARG  59  16.430  10.275  -0.588
 1000   1HD   ARG  59          1HD       ARG  59  15.796  11.575   1.204
 1001   2HD   ARG  59          2HD       ARG  59  17.280  12.425   0.772
 1002    HE   ARG  59           HE       ARG  59  15.870  14.079  -0.431
 1003   1HH1  ARG  59          1HH2      ARG  59  14.245  12.250   2.225
 1004   2HH1  ARG  59          2HH2      ARG  59  13.874  13.895   2.622
 1005   1HH2  ARG  59          1HH1      ARG  59  13.462  14.205  -0.977
 1006   2HH2  ARG  59          2HH1      ARG  59  12.488  14.294   0.452
 1007    H    GLU  60           H        GLU  60  20.387  10.242  -2.615
 1008    HA   GLU  60           HA       GLU  60  21.442  12.363  -4.182
 1009   1HB   GLU  60          1HB       GLU  60  22.512   9.608  -3.554
 1010   2HB   GLU  60          2HB       GLU  60  23.434  10.788  -4.452
 1011   1HG   GLU  60          2HG       GLU  60  22.203  11.550  -1.821
 1012   2HG   GLU  60          1HG       GLU  60  23.726  10.661  -1.853
 1013    H    TYR  61           H        TYR  61  19.830   9.435  -5.084
 1014    HA   TYR  61           HA       TYR  61  20.704   9.777  -7.913
 1015   1HB   TYR  61          1HB       TYR  61  19.168   7.481  -6.656
 1016   2HB   TYR  61          2HB       TYR  61  19.824   7.530  -8.290
 1017    HD1  TYR  61           HD2      TYR  61  22.412   9.141  -7.096
 1018    HD2  TYR  61           HD1      TYR  61  20.479   5.357  -6.307
 1019    HE1  TYR  61           HE2      TYR  61  24.572   8.206  -6.278
 1020    HE2  TYR  61           HE1      TYR  61  22.646   4.421  -5.508
 1021    HH   TYR  61           HH       TYR  61  25.284   5.135  -6.067
 1022    H    ILE  62           H        ILE  62  17.966   9.944  -5.738
 1023    HA   ILE  62           HA       ILE  62  15.846   9.927  -7.632
 1024    HB   ILE  62           HB       ILE  62  16.151  11.416  -5.006
 1025   1HG1  ILE  62          1HG1      ILE  62  14.520   8.953  -5.665
 1026   2HG1  ILE  62          2HG1      ILE  62  16.172   8.870  -5.057
 1027   1HG2  ILE  62          3HG2      ILE  62  14.171  11.749  -7.045
 1028   2HG2  ILE  62          1HG2      ILE  62  13.421  10.919  -5.683
 1029   3HG2  ILE  62          2HG2      ILE  62  14.214  12.474  -5.437
 1030   1HD1  ILE  62          2HD1      ILE  62  15.046  10.629  -3.289
 1031   2HD1  ILE  62          3HD1      ILE  62  13.676   9.578  -3.643
 1032   3HD1  ILE  62          1HD1      ILE  62  15.172   8.891  -3.008
 1033    H    ASN  63           H        ASN  63  18.194  12.396  -6.790
 1034    HA   ASN  63           HA       ASN  63  16.789  14.357  -8.534
 1035   1HB   ASN  63          1HB       ASN  63  17.605  15.056  -6.254
 1036   2HB   ASN  63          2HB       ASN  63  19.239  14.781  -6.807
 1037   1HD2  ASN  63          2HD2      ASN  63  18.286  18.033  -6.580
 1038   2HD2  ASN  63          1HD2      ASN  63  16.761  17.605  -7.190
 1039    H    SER  64           H        SER  64  19.934  12.733  -8.138
 1040    HA   SER  64           HA       SER  64  21.305  13.908 -10.303
 1041   1HB   SER  64          2HB       SER  64  21.440  11.205  -9.005
 1042   2HB   SER  64          1HB       SER  64  22.400  11.529 -10.428
 1043    HG   SER  64           HG       SER  64  23.399  13.202  -9.370
 1044    H    LEU  65           H        LEU  65  18.652  11.663 -10.311
 1045    HA   LEU  65           HA       LEU  65  18.999  10.479 -12.873
 1046   1HB   LEU  65          1HB       LEU  65  16.613  11.083 -11.156
 1047   2HB   LEU  65          2HB       LEU  65  16.371  10.501 -12.785
 1048    HG   LEU  65           HG       LEU  65  18.318   9.073 -11.008
 1049   1HD1  LEU  65          3HD1      LEU  65  16.061   9.452  -9.817
 1050   2HD1  LEU  65          1HD1      LEU  65  15.375   8.396 -11.051
 1051   3HD1  LEU  65          2HD1      LEU  65  16.621   7.787  -9.962
 1052   1HD2  LEU  65          2HD2      LEU  65  17.022   8.695 -13.577
 1053   2HD2  LEU  65          3HD2      LEU  65  18.368   7.802 -12.871
 1054   3HD2  LEU  65          1HD2      LEU  65  16.709   7.324 -12.514
 1055    H    GLU  66           H        GLU  66  19.378  11.668 -14.688
 1056    HA   GLU  66           HA       GLU  66  17.414  13.748 -15.425
 1057   1HB   GLU  66          1HB       GLU  66  19.587  14.664 -14.166
 1058   2HB   GLU  66          2HB       GLU  66  20.282  14.503 -15.779
 1059   1HG   GLU  66          1HG       GLU  66  18.685  15.993 -16.727
 1060   2HG   GLU  66          2HG       GLU  66  17.647  15.906 -15.304
 1061    H    MET  67           H        MET  67  20.603  12.481 -16.472
 1062    HA   MET  67           HA       MET  67  19.322  11.759 -19.069
 1063   1HB   MET  67          1HB       MET  67  21.302  13.786 -18.635
 1064   2HB   MET  67          2HB       MET  67  22.039  12.472 -19.553
 1065   1HG   MET  67          1HG       MET  67  19.310  13.462 -20.328
 1066   2HG   MET  67          2HG       MET  67  20.735  14.379 -20.819
 1067   1HE   MET  67          2HE       MET  67  18.330  12.733 -22.073
 1068   2HE   MET  67          1HE       MET  67  19.249  13.360 -23.440
 1069   3HE   MET  67          3HE       MET  67  18.869  11.642 -23.348
 1070    H    SER  68           H        SER  68  20.305   9.937 -20.118
 1071    HA   SER  68           HA       SER  68  22.387   8.500 -18.545
 1072   1HB   SER  68          1HB       SER  68  21.156   6.502 -18.420
 1073   2HB   SER  68          2HB       SER  68  19.937   7.730 -18.078
 1074    HG   SER  68           HG       SER  68  19.441   7.671 -20.350
   
  No H/Q in entry =        1074
  Start of MODEL    7
    1    H    SER   1           H        SER   1  20.209 -14.415   2.305
    2    HA   SER   1           HA       SER   1  17.545 -15.561   2.547
    3   1HB   SER   1          1HB       SER   1  18.036 -12.722   3.496
    4   2HB   SER   1          2HB       SER   1  16.441 -13.401   3.170
    5    HG   SER   1           HG       SER   1  16.561 -14.589   4.918
    6    HA   PRO   2           HA       PRO   2  17.362 -14.222  -1.621
    7   1HB   PRO   2          1HB       PRO   2  14.588 -13.440  -1.550
    8   2HB   PRO   2          2HB       PRO   2  15.275 -14.943  -2.180
    9   1HG   PRO   2          1HG       PRO   2  13.749 -14.572   0.245
   10   2HG   PRO   2          2HG       PRO   2  14.426 -16.076  -0.389
   11   1HD   PRO   2          1HD       PRO   2  15.336 -14.542   1.878
   12   2HD   PRO   2          2HD       PRO   2  16.017 -16.050   1.241
   13    H    TYR   3           H        TYR   3  18.090 -12.284  -2.393
   14    HA   TYR   3           HA       TYR   3  17.673  -9.821  -0.910
   15   1HB   TYR   3          1HB       TYR   3  18.897 -10.354  -3.634
   16   2HB   TYR   3          2HB       TYR   3  18.914  -8.786  -2.829
   17    HD1  TYR   3           HD1      TYR   3  20.111  -8.506  -0.634
   18    HD2  TYR   3           HD2      TYR   3  20.379 -12.132  -2.965
   19    HE1  TYR   3           HE1      TYR   3  22.121  -9.195   0.670
   20    HE2  TYR   3           HE2      TYR   3  22.389 -12.821  -1.661
   21    HH   TYR   3           HH       TYR   3  24.015 -10.647   0.505
   22    H    SER   4           H        SER   4  15.341  -9.614  -0.958
   23    HA   SER   4           HA       SER   4  14.257  -8.877  -3.647
   24   1HB   SER   4          1HB       SER   4  13.212 -10.848  -2.382
   25   2HB   SER   4          2HB       SER   4  12.610  -9.652  -1.234
   26    HG   SER   4           HG       SER   4  11.026  -9.600  -2.636
   27    H    SER   5           H        SER   5  13.384  -6.843  -3.885
   28    HA   SER   5           HA       SER   5  12.490  -5.220  -1.669
   29   1HB   SER   5          1HB       SER   5  14.297  -3.453  -1.977
   30   2HB   SER   5          2HB       SER   5  14.818  -4.925  -1.157
   31    HG   SER   5           HG       SER   5  16.286  -4.353  -2.778
   32    H    ASP   6           H        ASP   6  10.739  -4.469  -2.818
   33    HA   ASP   6           HA       ASP   6  11.135  -2.544  -4.929
   34   1HB   ASP   6          2HB       ASP   6  10.184  -3.791  -6.789
   35   2HB   ASP   6          1HB       ASP   6  11.565  -4.686  -6.164
   36    H    THR   7           H        THR   7   8.499  -3.140  -6.164
   37    HA   THR   7           HA       THR   7   6.927  -1.698  -4.245
   38    HB   THR   7           HB       THR   7   6.643  -1.430  -6.687
   39    HG1  THR   7           HG1      THR   7   4.245  -2.552  -5.753
   40   1HG2  THR   7          1HG2      THR   7   5.627  -4.281  -6.510
   41   2HG2  THR   7          2HG2      THR   7   5.421  -3.243  -7.920
   42   3HG2  THR   7          3HG2      THR   7   7.039  -3.717  -7.403
   43    H    THR   8           H        THR   8   4.564  -2.576  -3.845
   44    HA   THR   8           HA       THR   8   4.447  -5.480  -3.381
   45    HB   THR   8           HB       THR   8   4.228  -3.516  -1.075
   46    HG1  THR   8           HG1      THR   8   6.339  -3.718  -1.346
   47   1HG2  THR   8          1HG2      THR   8   3.900  -6.503  -1.363
   48   2HG2  THR   8          2HG2      THR   8   4.315  -5.776   0.188
   49   3HG2  THR   8          3HG2      THR   8   2.803  -5.346  -0.610
   50    HA   PRO   9           HA       PRO   9   0.426  -3.987  -4.785
   51   1HB   PRO   9          1HB       PRO   9  -0.470  -6.741  -4.519
   52   2HB   PRO   9          2HB       PRO   9  -0.224  -5.804  -5.998
   53   1HG   PRO   9          2HG       PRO   9   1.442  -7.917  -4.964
   54   2HG   PRO   9          1HG       PRO   9   1.716  -6.948  -6.412
   55   1HD   PRO   9          1HD       PRO   9   3.153  -6.848  -3.946
   56   2HD   PRO   9          2HD       PRO   9   3.392  -5.841  -5.385
   57    H    CYS  10           H        CYS  10  -0.190  -2.887  -2.881
   58    HA   CYS  10           HA       CYS  10  -1.599  -4.571  -0.859
   59   1HB   CYS  10          1HB       CYS  10   0.725  -3.492  -0.218
   60   2HB   CYS  10          2HB       CYS  10  -0.226  -2.041  -0.043
   61    H    CYS  11           H        CYS  11  -3.408  -3.607   0.101
   62    HA   CYS  11           HA       CYS  11  -4.339  -1.205  -1.365
   63   1HB   CYS  11          2HB       CYS  11  -6.330  -2.179  -1.739
   64   2HB   CYS  11          1HB       CYS  11  -5.574  -3.685  -1.257
   65    H    PHE  12           H        PHE  12  -5.060   0.569  -0.139
   66    HA   PHE  12           HA       PHE  12  -4.501   0.331   2.777
   67   1HB   PHE  12          2HB       PHE  12  -3.725   2.243   0.912
   68   2HB   PHE  12          1HB       PHE  12  -5.024   3.024   1.783
   69    HD1  PHE  12           HD1      PHE  12  -2.156   0.723   2.583
   70    HD2  PHE  12           HD2      PHE  12  -4.372   4.269   3.656
   71    HE1  PHE  12           HE1      PHE  12  -0.697   1.030   4.584
   72    HE2  PHE  12           HE2      PHE  12  -2.904   4.586   5.647
   73    HZ   PHE  12           HZ       PHE  12  -1.070   2.963   6.113
   74    H    ALA  13           H        ALA  13  -6.840   2.042   0.660
   75    HA   ALA  13           HA       ALA  13  -8.780   1.969   2.904
   76   1HB   ALA  13          3HB       ALA  13  -8.484   3.579   0.405
   77   2HB   ALA  13          1HB       ALA  13 -10.112   3.334   1.039
   78   3HB   ALA  13          2HB       ALA  13  -8.883   4.110   2.038
   79    H    TYR  14           H        TYR  14 -10.124   0.291   3.007
   80    HA   TYR  14           HA       TYR  14 -11.002  -0.893   0.435
   81   1HB   TYR  14          1HB       TYR  14 -11.455  -2.978   1.944
   82   2HB   TYR  14          2HB       TYR  14  -9.816  -2.666   1.383
   83    HD1  TYR  14           HD1      TYR  14 -12.118  -2.567   4.259
   84    HD2  TYR  14           HD2      TYR  14  -8.087  -1.826   2.909
   85    HE1  TYR  14           HE1      TYR  14 -11.383  -2.271   6.615
   86    HE2  TYR  14           HE2      TYR  14  -7.354  -1.528   5.260
   87    HH   TYR  14           HH       TYR  14  -8.172  -1.113   7.421
   88    H    ILE  15           H        ILE  15 -13.025   0.022   0.137
   89    HA   ILE  15           HA       ILE  15 -15.220  -0.826   1.740
   90    HB   ILE  15           HB       ILE  15 -14.271   0.669   3.459
   91   1HG1  ILE  15          2HG1      ILE  15 -16.643   2.118   2.317
   92   2HG1  ILE  15          1HG1      ILE  15 -16.817   0.485   2.915
   93   1HG2  ILE  15          1HG2      ILE  15 -13.616   2.255   1.234
   94   2HG2  ILE  15          2HG2      ILE  15 -14.826   3.181   2.121
   95   3HG2  ILE  15          3HG2      ILE  15 -13.350   2.656   2.930
   96   1HD1  ILE  15          2HD1      ILE  15 -15.856   1.192   5.092
   97   2HD1  ILE  15          3HD1      ILE  15 -15.747   2.844   4.485
   98   3HD1  ILE  15          1HD1      ILE  15 -17.325   2.086   4.701
   99    H    ALA  16           H        ALA  16 -16.987  -0.608   0.454
  100    HA   ALA  16           HA       ALA  16 -17.765   1.694  -0.973
  101   1HB   ALA  16          1HB       ALA  16 -15.616   0.249  -2.251
  102   2HB   ALA  16          2HB       ALA  16 -17.064   0.183  -3.257
  103   3HB   ALA  16          3HB       ALA  16 -16.401   1.742  -2.764
  104    H    ARG  17           H        ARG  17 -18.899  -0.594   0.482
  105    HA   ARG  17           HA       ARG  17 -20.835  -1.886   0.344
  106   1HB   ARG  17          2HB       ARG  17 -21.200  -0.887  -2.484
  107   2HB   ARG  17          1HB       ARG  17 -22.439  -1.388  -1.333
  108   1HG   ARG  17          1HG       ARG  17 -21.371   0.604   0.099
  109   2HG   ARG  17          2HG       ARG  17 -20.938   1.188  -1.508
  110   1HD   ARG  17          1HD       ARG  17 -23.040   1.975  -1.711
  111   2HD   ARG  17          2HD       ARG  17 -23.604   0.304  -1.721
  112    HE   ARG  17           HE       ARG  17 -23.193   1.649   0.900
  113   1HH1  ARG  17          2HH2      ARG  17 -24.748  -1.003  -0.189
  114   2HH1  ARG  17          1HH2      ARG  17 -26.345  -0.347  -0.345
  115   1HH2  ARG  17          1HH1      ARG  17 -25.452   2.266   1.729
  116   2HH2  ARG  17          2HH1      ARG  17 -26.711   1.826   0.625
  117    HA   PRO  18           HA       PRO  18 -19.126  -5.557  -1.367
  118   1HB   PRO  18          2HB       PRO  18 -21.782  -6.661  -1.804
  119   2HB   PRO  18          1HB       PRO  18 -20.570  -7.157  -0.656
  120   1HG   PRO  18          2HG       PRO  18 -22.955  -5.722  -0.070
  121   2HG   PRO  18          1HG       PRO  18 -21.631  -6.079   1.046
  122   1HD   PRO  18          2HD       PRO  18 -22.336  -3.531  -0.070
  123   2HD   PRO  18          1HD       PRO  18 -21.042  -3.896   1.056
  124    H    LEU  19           H        LEU  19 -18.318  -4.898  -3.323
  125    HA   LEU  19           HA       LEU  19 -19.526  -3.825  -5.548
  126   1HB   LEU  19          1HB       LEU  19 -17.377  -5.948  -5.516
  127   2HB   LEU  19          2HB       LEU  19 -17.732  -4.915  -6.879
  128    HG   LEU  19           HG       LEU  19 -16.810  -4.003  -4.142
  129   1HD1  LEU  19          3HD1      LEU  19 -15.363  -4.955  -6.368
  130   2HD1  LEU  19          1HD1      LEU  19 -15.183  -3.201  -6.392
  131   3HD1  LEU  19          2HD1      LEU  19 -14.716  -4.116  -4.959
  132   1HD2  LEU  19          3HD2      LEU  19 -17.951  -2.590  -6.496
  133   2HD2  LEU  19          1HD2      LEU  19 -18.014  -2.161  -4.786
  134   3HD2  LEU  19          2HD2      LEU  19 -16.555  -1.837  -5.724
  135    HA   PRO  20           HA       PRO  20 -22.469  -7.029  -6.674
  136   1HB   PRO  20          1HB       PRO  20 -22.862  -5.778  -9.242
  137   2HB   PRO  20          2HB       PRO  20 -23.941  -5.739  -7.843
  138   1HG   PRO  20          1HG       PRO  20 -22.312  -3.593  -8.875
  139   2HG   PRO  20          2HG       PRO  20 -23.385  -3.558  -7.472
  140   1HD   PRO  20          1HD       PRO  20 -20.499  -3.582  -7.498
  141   2HD   PRO  20          2HD       PRO  20 -21.576  -3.528  -6.091
  142    H    ARG  21           H        ARG  21 -22.459  -8.794  -8.236
  143    HA   ARG  21           HA       ARG  21 -19.811  -9.407  -9.251
  144   1HB   ARG  21          2HB       ARG  21 -21.325 -11.165  -8.412
  145   2HB   ARG  21          1HB       ARG  21 -22.448 -10.827  -9.706
  146   1HG   ARG  21          1HG       ARG  21 -21.137 -11.835 -11.300
  147   2HG   ARG  21          2HG       ARG  21 -19.635 -11.364 -10.504
  148   1HD   ARG  21          2HD       ARG  21 -19.505 -13.350  -9.448
  149   2HD   ARG  21          1HD       ARG  21 -21.144 -13.175  -8.822
  150    HE   ARG  21           HE       ARG  21 -20.366 -14.748 -11.142
  151   1HH1  ARG  21          1HH2      ARG  21 -23.245 -13.180  -9.562
  152   2HH1  ARG  21          2HH2      ARG  21 -23.720 -14.844  -9.626
  153   1HH2  ARG  21          2HH1      ARG  21 -22.077 -15.102 -12.738
  154   2HH2  ARG  21          1HH1      ARG  21 -23.640 -14.445 -12.384
  155    H    ALA  22           H        ALA  22 -22.520  -7.753 -10.583
  156    HA   ALA  22           HA       ALA  22 -21.738  -8.375 -13.356
  157   1HB   ALA  22          1HB       ALA  22 -23.939  -6.739 -12.104
  158   2HB   ALA  22          2HB       ALA  22 -23.596  -6.632 -13.829
  159   3HB   ALA  22          3HB       ALA  22 -24.081  -8.172 -13.121
  160    H    HIS  23           H        HIS  23 -20.396  -6.436 -11.096
  161    HA   HIS  23           HA       HIS  23 -19.697  -4.376 -13.146
  162   1HB   HIS  23          2HB       HIS  23 -19.709  -3.962 -10.145
  163   2HB   HIS  23          1HB       HIS  23 -19.465  -2.737 -11.389
  164    HD2  HIS  23           HD2      HIS  23 -22.462  -5.368 -11.090
  165    HE1  HIS  23           HE1      HIS  23 -24.034  -1.465 -11.480
  166    HE2  HIS  23           HE2      HIS  23 -24.628  -3.932 -11.303
  167    H    ILE  24           H        ILE  24 -18.518  -6.904 -11.169
  168    HA   ILE  24           HA       ILE  24 -15.797  -5.715 -11.156
  169    HB   ILE  24           HB       ILE  24 -16.601  -8.328  -9.906
  170   1HG1  ILE  24          1HG1      ILE  24 -16.545  -5.584  -8.645
  171   2HG1  ILE  24          2HG1      ILE  24 -17.970  -6.543  -8.936
  172   1HG2  ILE  24          2HG2      ILE  24 -14.241  -6.470  -9.677
  173   2HG2  ILE  24          3HG2      ILE  24 -14.581  -7.694  -8.456
  174   3HG2  ILE  24          1HG2      ILE  24 -14.245  -8.175 -10.117
  175   1HD1  ILE  24          1HD1      ILE  24 -16.247  -8.266  -7.566
  176   2HD1  ILE  24          2HD1      ILE  24 -16.080  -6.715  -6.745
  177   3HD1  ILE  24          3HD1      ILE  24 -17.669  -7.463  -6.902
  178    H    LYS  25           H        LYS  25 -13.980  -7.160 -11.784
  179    HA   LYS  25           HA       LYS  25 -14.774  -8.925 -14.062
  180   1HB   LYS  25          1HB       LYS  25 -12.977  -6.787 -13.997
  181   2HB   LYS  25          2HB       LYS  25 -11.947  -8.218 -13.937
  182   1HG   LYS  25          1HG       LYS  25 -12.215  -8.110 -16.217
  183   2HG   LYS  25          2HG       LYS  25 -13.681  -9.015 -15.840
  184   1HD   LYS  25          1HD       LYS  25 -15.038  -7.259 -16.350
  185   2HD   LYS  25          2HD       LYS  25 -13.957  -6.085 -15.600
  186   1HE   LYS  25          1HE       LYS  25 -12.410  -6.657 -17.666
  187   2HE   LYS  25          2HE       LYS  25 -13.930  -7.174 -18.396
  188   1HZ   LYS  25          2HZ       LYS  25 -14.846  -4.969 -17.734
  189   2HZ   LYS  25          3HZ       LYS  25 -13.272  -4.497 -17.303
  190   3HZ   LYS  25          1HZ       LYS  25 -13.628  -4.897 -18.915
  191    H    GLU  26           H        GLU  26 -11.809  -8.720 -12.060
  192    HA   GLU  26           HA       GLU  26 -12.170 -11.580 -11.392
  193   1HB   GLU  26          2HB       GLU  26 -10.300 -10.688 -13.054
  194   2HB   GLU  26          1HB       GLU  26  -9.488 -10.259 -11.550
  195   1HG   GLU  26          1HG       GLU  26  -8.981 -12.369 -11.139
  196   2HG   GLU  26          2HG       GLU  26 -10.642 -12.886 -11.371
  197    H    TYR  27           H        TYR  27  -9.675 -11.283  -9.684
  198    HA   TYR  27           HA       TYR  27 -10.324  -9.277  -7.710
  199   1HB   TYR  27          1HB       TYR  27 -10.762 -10.867  -5.870
  200   2HB   TYR  27          2HB       TYR  27 -11.993 -11.010  -7.128
  201    HD1  TYR  27           HD2      TYR  27 -11.772 -12.868  -8.866
  202    HD2  TYR  27           HD1      TYR  27  -9.342 -12.700  -5.299
  203    HE1  TYR  27           HE2      TYR  27 -11.189 -15.275  -9.149
  204    HE2  TYR  27           HE1      TYR  27  -8.759 -15.108  -5.584
  205    HH   TYR  27           HH       TYR  27 -10.374 -17.207  -7.280
  206    H    PHE  28           H        PHE  28  -8.694  -9.823  -5.686
  207    HA   PHE  28           HA       PHE  28  -6.403 -11.380  -6.561
  208   1HB   PHE  28          2HB       PHE  28  -6.031  -9.402  -7.920
  209   2HB   PHE  28          1HB       PHE  28  -6.233  -8.361  -6.534
  210    HD1  PHE  28           HD1      PHE  28  -4.005 -10.809  -8.185
  211    HD2  PHE  28           HD2      PHE  28  -4.486  -8.112  -4.848
  212    HE1  PHE  28           HE1      PHE  28  -1.577 -11.022  -7.661
  213    HE2  PHE  28           HE2      PHE  28  -2.066  -8.338  -4.314
  214    HZ   PHE  28           HZ       PHE  28  -0.606  -9.789  -5.723
  215    H    TYR  29           H        TYR  29  -6.564 -12.374  -4.486
  216    HA   TYR  29           HA       TYR  29  -6.741 -10.947  -2.020
  217   1HB   TYR  29          2HB       TYR  29  -7.150 -13.351  -2.128
  218   2HB   TYR  29          1HB       TYR  29  -5.483 -13.635  -2.616
  219    HD1  TYR  29           HD2      TYR  29  -7.425 -11.919   0.117
  220    HD2  TYR  29           HD1      TYR  29  -3.918 -14.191  -0.969
  221    HE1  TYR  29           HE2      TYR  29  -6.728 -11.989   2.509
  222    HE2  TYR  29           HE1      TYR  29  -3.220 -14.257   1.422
  223    HH   TYR  29           HH       TYR  29  -3.989 -13.941   3.576
  224    H    THR  30           H        THR  30  -5.243  -9.845  -0.911
  225    HA   THR  30           HA       THR  30  -2.724  -9.136  -2.071
  226    HB   THR  30           HB       THR  30  -2.245  -8.062   0.090
  227    HG1  THR  30           HG1      THR  30  -2.974  -9.117   1.740
  228   1HG2  THR  30          3HG2      THR  30  -4.852  -7.803  -1.297
  229   2HG2  THR  30          1HG2      THR  30  -4.759  -7.043   0.292
  230   3HG2  THR  30          2HG2      THR  30  -3.622  -6.580  -0.975
  231    H    SER  31           H        SER  31  -0.683  -9.402  -0.399
  232    HA   SER  31           HA       SER  31  -0.346 -12.353  -0.166
  233   1HB   SER  31          1HB       SER  31   1.993 -11.995  -0.396
  234   2HB   SER  31          2HB       SER  31   1.254 -10.884  -1.548
  235    HG   SER  31           HG       SER  31   2.945 -10.090   0.017
  236    H    GLY  32           H        GLY  32   1.934 -12.132   1.634
  237   1HA   GLY  32          1HA       GLY  32   0.507 -11.313   4.129
  238   2HA   GLY  32          2HA       GLY  32   1.518 -12.734   4.048
  239    H    LYS  33           H        LYS  33   2.626  -9.995   2.275
  240    HA   LYS  33           HA       LYS  33   4.827  -9.653   4.243
  241   1HB   LYS  33          2HB       LYS  33   4.492  -9.214   1.323
  242   2HB   LYS  33          1HB       LYS  33   5.523  -8.076   2.155
  243   1HG   LYS  33          2HG       LYS  33   6.748 -10.047   3.157
  244   2HG   LYS  33          1HG       LYS  33   5.812 -11.084   2.079
  245   1HD   LYS  33          2HD       LYS  33   6.673  -9.754   0.143
  246   2HD   LYS  33          1HD       LYS  33   7.678  -8.847   1.247
  247   1HE   LYS  33          1HE       LYS  33   7.876 -11.803   1.425
  248   2HE   LYS  33          2HE       LYS  33   8.546 -11.058  -0.025
  249   1HZ   LYS  33          2HZ       LYS  33   9.193 -10.240   2.754
  250   2HZ   LYS  33          3HZ       LYS  33  10.170 -11.236   1.785
  251   3HZ   LYS  33          1HZ       LYS  33   9.889  -9.623   1.333
  252    H    CYS  34           H        CYS  34   2.661  -7.646   2.249
  253    HA   CYS  34           HA       CYS  34   3.251  -5.163   3.482
  254   1HB   CYS  34          1HB       CYS  34   2.006  -5.411   1.360
  255   2HB   CYS  34          2HB       CYS  34   0.644  -6.093   2.248
  256    H    SER  35           H        SER  35   1.944  -3.938   5.019
  257    HA   SER  35           HA       SER  35   0.832  -5.690   7.142
  258   1HB   SER  35          1HB       SER  35   0.942  -2.784   7.628
  259   2HB   SER  35          2HB       SER  35   1.538  -4.114   8.622
  260    HG   SER  35           HG       SER  35   3.409  -3.475   7.927
  261    H    ASN  36           H        ASN  36  -0.905  -5.750   5.135
  262    HA   ASN  36           HA       ASN  36  -3.267  -4.450   6.200
  263   1HB   ASN  36          1HB       ASN  36  -1.747  -2.994   4.267
  264   2HB   ASN  36          2HB       ASN  36  -3.228  -3.512   3.503
  265   1HD2  ASN  36          2HD2      ASN  36  -3.203  -0.928   6.657
  266   2HD2  ASN  36          1HD2      ASN  36  -2.027  -0.954   5.433
  267    HA   PRO  37           HA       PRO  37  -3.630  -8.424   3.754
  268   1HB   PRO  37          1HB       PRO  37  -5.500  -9.250   5.809
  269   2HB   PRO  37          2HB       PRO  37  -3.937  -9.968   5.402
  270   1HG   PRO  37          2HG       PRO  37  -4.590  -8.383   7.715
  271   2HG   PRO  37          1HG       PRO  37  -3.015  -9.063   7.284
  272   1HD   PRO  37          2HD       PRO  37  -3.835  -6.297   7.194
  273   2HD   PRO  37          1HD       PRO  37  -2.255  -6.979   6.760
  274    H    ALA  38           H        ALA  38  -5.444  -8.895   2.428
  275    HA   ALA  38           HA       ALA  38  -8.119  -8.084   2.910
  276   1HB   ALA  38          3HB       ALA  38  -6.486  -5.872   2.440
  277   2HB   ALA  38          1HB       ALA  38  -7.232  -6.182   0.874
  278   3HB   ALA  38          2HB       ALA  38  -8.243  -5.909   2.294
  279    H    VAL  39           H        VAL  39  -8.803  -7.279   0.277
  280    HA   VAL  39           HA       VAL  39  -7.720  -9.370  -1.489
  281    HB   VAL  39           HB       VAL  39 -10.009  -9.831   0.006
  282   1HG1  VAL  39          1HG1      VAL  39 -11.106  -8.108  -1.589
  283   2HG1  VAL  39          2HG1      VAL  39 -11.043  -9.415  -2.772
  284   3HG1  VAL  39          3HG1      VAL  39 -11.937  -9.627  -1.265
  285   1HG2  VAL  39          3HG2      VAL  39  -8.705 -11.017  -2.354
  286   2HG2  VAL  39          1HG2      VAL  39  -9.132 -11.745  -0.802
  287   3HG2  VAL  39          2HG2      VAL  39 -10.363 -11.537  -2.051
  288    H    VAL  40           H        VAL  40  -8.117  -8.735  -3.734
  289    HA   VAL  40           HA       VAL  40  -9.118  -5.935  -3.863
  290    HB   VAL  40           HB       VAL  40  -6.633  -7.069  -5.143
  291   1HG1  VAL  40          1HG1      VAL  40  -8.254  -5.101  -6.247
  292   2HG1  VAL  40          2HG1      VAL  40  -7.081  -4.180  -5.314
  293   3HG1  VAL  40          3HG1      VAL  40  -6.535  -5.305  -6.554
  294   1HG2  VAL  40          1HG2      VAL  40  -6.561  -6.467  -2.737
  295   2HG2  VAL  40          2HG2      VAL  40  -5.540  -5.412  -3.716
  296   3HG2  VAL  40          3HG2      VAL  40  -7.114  -4.844  -3.151
  297    H    PHE  41           H        PHE  41 -10.794  -5.753  -5.145
  298    HA   PHE  41           HA       PHE  41 -11.219  -7.699  -7.285
  299   1HB   PHE  41          2HB       PHE  41 -12.858  -5.461  -6.112
  300   2HB   PHE  41          1HB       PHE  41 -13.342  -6.240  -7.595
  301    HD1  PHE  41           HD1      PHE  41 -13.002  -9.008  -7.382
  302    HD2  PHE  41           HD2      PHE  41 -13.935  -6.238  -4.207
  303    HE1  PHE  41           HE1      PHE  41 -14.037 -10.859  -6.072
  304    HE2  PHE  41           HE2      PHE  41 -14.963  -8.087  -2.900
  305    HZ   PHE  41           HZ       PHE  41 -15.029 -10.396  -3.830
  306    H    VAL  42           H        VAL  42 -10.946  -7.346  -9.351
  307    HA   VAL  42           HA       VAL  42  -9.901  -4.677 -10.196
  308    HB   VAL  42           HB       VAL  42  -9.578  -6.299 -12.360
  309   1HG1  VAL  42          2HG2      VAL  42  -7.966  -4.769 -11.111
  310   2HG1  VAL  42          3HG2      VAL  42  -7.587  -6.164 -10.101
  311   3HG1  VAL  42          1HG2      VAL  42  -7.248  -6.210 -11.832
  312   1HG2  VAL  42          2HG1      VAL  42 -10.335  -8.269 -10.929
  313   2HG2  VAL  42          3HG1      VAL  42  -8.782  -8.453 -11.741
  314   3HG2  VAL  42          1HG1      VAL  42  -8.838  -8.053 -10.025
  315    H    THR  43           H        THR  43 -12.155  -3.880 -10.152
  316    HA   THR  43           HA       THR  43 -14.222  -5.187 -11.703
  317    HB   THR  43           HB       THR  43 -15.684  -3.554 -10.872
  318    HG1  THR  43           HG1      THR  43 -14.749  -1.525 -10.074
  319   1HG2  THR  43          1HG2      THR  43 -13.801  -4.672  -9.118
  320   2HG2  THR  43          2HG2      THR  43 -13.915  -2.978  -8.644
  321   3HG2  THR  43          3HG2      THR  43 -15.364  -3.981  -8.686
  322    H    ARG  44           H        ARG  44 -15.579  -2.971 -12.791
  323    HA   ARG  44           HA       ARG  44 -14.842  -3.060 -15.440
  324   1HB   ARG  44          2HB       ARG  44 -15.946  -0.681 -15.556
  325   2HB   ARG  44          1HB       ARG  44 -16.918  -2.060 -15.113
  326   1HG   ARG  44          1HG       ARG  44 -17.401  -1.123 -13.125
  327   2HG   ARG  44          2HG       ARG  44 -15.688  -1.005 -12.736
  328   1HD   ARG  44          1HD       ARG  44 -15.876   1.232 -12.919
  329   2HD   ARG  44          2HD       ARG  44 -16.157   1.010 -14.645
  330    HE   ARG  44           HE       ARG  44 -18.633   0.776 -13.977
  331   1HH1  ARG  44          2HH1      ARG  44 -16.978   1.804 -11.133
  332   2HH1  ARG  44          1HH1      ARG  44 -18.558   2.386 -10.727
  333   1HH2  ARG  44          1HH2      ARG  44 -19.666   3.259 -13.515
  334   2HH2  ARG  44          2HH2      ARG  44 -18.232   4.159 -13.150
  335    H    LYS  45           H        LYS  45 -14.081  -0.193 -13.392
  336    HA   LYS  45           HA       LYS  45 -12.183   0.935 -15.199
  337   1HB   LYS  45          1HB       LYS  45 -13.079   1.531 -12.610
  338   2HB   LYS  45          2HB       LYS  45 -11.368   1.238 -12.420
  339   1HG   LYS  45          1HG       LYS  45 -12.487   3.046 -14.569
  340   2HG   LYS  45          2HG       LYS  45 -11.997   3.637 -12.982
  341   1HD   LYS  45          1HD       LYS  45  -9.943   3.868 -13.928
  342   2HD   LYS  45          2HD       LYS  45  -9.823   2.122 -13.713
  343   1HE   LYS  45          1HE       LYS  45 -10.119   1.697 -15.941
  344   2HE   LYS  45          2HE       LYS  45 -11.270   3.018 -16.143
  345   1HZ   LYS  45          2HZ       LYS  45  -8.552   3.814 -15.530
  346   2HZ   LYS  45          3HZ       LYS  45  -8.762   3.080 -17.046
  347   3HZ   LYS  45          1HZ       LYS  45  -9.654   4.469 -16.644
  348    H    ASN  46           H        ASN  46 -12.082  -1.655 -12.923
  349    HA   ASN  46           HA       ASN  46 -10.668  -3.425 -12.643
  350   1HB   ASN  46          1HB       ASN  46 -10.045  -2.421 -15.307
  351   2HB   ASN  46          2HB       ASN  46  -8.621  -3.076 -14.542
  352   1HD2  ASN  46          1HD2      ASN  46 -10.790  -5.669 -16.309
  353   2HD2  ASN  46          2HD2      ASN  46  -9.520  -4.605 -16.679
  354    H    ARG  47           H        ARG  47  -9.946  -0.401 -11.861
  355    HA   ARG  47           HA       ARG  47  -7.107  -0.519 -11.356
  356   1HB   ARG  47          1HB       ARG  47  -9.315   0.791  -9.722
  357   2HB   ARG  47          2HB       ARG  47  -7.589   1.074  -9.496
  358   1HG   ARG  47          1HG       ARG  47  -7.394   2.297 -11.450
  359   2HG   ARG  47          2HG       ARG  47  -8.725   1.447 -12.238
  360   1HD   ARG  47          1HD       ARG  47 -10.271   2.911 -11.451
  361   2HD   ARG  47          2HD       ARG  47  -9.537   2.957  -9.847
  362    HE   ARG  47           HE       ARG  47  -7.978   4.383 -11.860
  363   1HH1  ARG  47          2HH2      ARG  47  -8.786   5.283  -8.712
  364   2HH1  ARG  47          1HH2      ARG  47  -8.185   6.704  -9.499
  365   1HH2  ARG  47          1HH1      ARG  47 -10.759   5.638 -11.883
  366   2HH2  ARG  47          2HH1      ARG  47 -10.264   7.065 -11.035
  367    H    GLN  48           H        GLN  48  -6.249  -1.166  -9.057
  368    HA   GLN  48           HA       GLN  48  -7.612  -3.667  -8.453
  369   1HB   GLN  48          2HB       GLN  48  -4.943  -2.538  -7.901
  370   2HB   GLN  48          1HB       GLN  48  -5.579  -3.637  -6.672
  371   1HG   GLN  48          2HG       GLN  48  -6.054  -5.309  -8.400
  372   2HG   GLN  48          1HG       GLN  48  -5.543  -4.217  -9.649
  373   1HE2  GLN  48          1HE2      GLN  48  -2.155  -4.124  -8.254
  374   2HE2  GLN  48          2HE2      GLN  48  -3.009  -3.710  -9.660
  375    H    VAL  49           H        VAL  49  -9.482  -2.750  -7.742
  376    HA   VAL  49           HA       VAL  49  -9.709  -0.957  -5.530
  377    HB   VAL  49           HB       VAL  49 -11.921  -2.840  -6.092
  378   1HG1  VAL  49          2HG1      VAL  49 -11.651   0.158  -5.838
  379   2HG1  VAL  49          3HG1      VAL  49 -13.182  -0.705  -5.994
  380   3HG1  VAL  49          1HG1      VAL  49 -12.174  -0.951  -4.566
  381   1HG2  VAL  49          1HG2      VAL  49 -10.805  -0.924  -8.160
  382   2HG2  VAL  49          2HG2      VAL  49 -11.298  -2.598  -8.407
  383   3HG2  VAL  49          3HG2      VAL  49 -12.514  -1.347  -8.141
  384    H    CYS  50           H        CYS  50 -10.550  -1.565  -3.365
  385    HA   CYS  50           HA       CYS  50  -9.646  -4.306  -2.613
  386   1HB   CYS  50          1HB       CYS  50  -8.783  -1.950  -1.573
  387   2HB   CYS  50          2HB       CYS  50 -10.098  -2.319  -0.484
  388    H    ALA  51           H        ALA  51 -10.881  -4.675  -0.238
  389    HA   ALA  51           HA       ALA  51 -13.527  -3.805   0.098
  390   1HB   ALA  51          3HB       ALA  51 -13.195  -5.874  -1.995
  391   2HB   ALA  51          1HB       ALA  51 -14.464  -6.192  -0.816
  392   3HB   ALA  51          2HB       ALA  51 -14.497  -4.708  -1.765
  393    H    ASN  52           H        ASN  52 -11.204  -4.826   1.606
  394    HA   ASN  52           HA       ASN  52 -10.911  -6.007   3.601
  395   1HB   ASN  52          1HB       ASN  52 -13.227  -5.086   4.015
  396   2HB   ASN  52          2HB       ASN  52 -13.872  -6.588   3.354
  397   1HD2  ASN  52          2HD2      ASN  52 -12.684  -6.192   7.112
  398   2HD2  ASN  52          1HD2      ASN  52 -11.496  -5.616   6.044
  399    HA   PRO  53           HA       PRO  53 -10.531 -10.097   1.971
  400   1HB   PRO  53          2HB       PRO  53  -9.201 -11.224   4.053
  401   2HB   PRO  53          1HB       PRO  53  -8.436 -10.123   2.938
  402   1HG   PRO  53          1HG       PRO  53  -9.261  -9.614   5.749
  403   2HG   PRO  53          2HG       PRO  53  -8.008  -8.826   4.807
  404   1HD   PRO  53          1HD       PRO  53 -10.617  -7.813   5.328
  405   2HD   PRO  53          2HD       PRO  53  -9.443  -7.140   4.203
  406    H    GLU  54           H        GLU  54 -11.445  -9.870   5.446
  407    HA   GLU  54           HA       GLU  54 -13.088 -12.335   5.122
  408   1HB   GLU  54          1HB       GLU  54 -12.312 -10.913   7.681
  409   2HB   GLU  54          2HB       GLU  54 -13.029 -12.517   7.536
  410   1HG   GLU  54          1HG       GLU  54 -11.032 -13.479   7.074
  411   2HG   GLU  54          2HG       GLU  54 -10.594 -12.207   5.934
  412    H    LYS  55           H        LYS  55 -14.224 -10.008   4.012
  413    HA   LYS  55           HA       LYS  55 -16.208  -9.063   6.004
  414   1HB   LYS  55          1HB       LYS  55 -15.100  -8.006   3.551
  415   2HB   LYS  55          2HB       LYS  55 -16.844  -7.987   3.495
  416   1HG   LYS  55          1HG       LYS  55 -15.540  -7.083   6.020
  417   2HG   LYS  55          2HG       LYS  55 -15.453  -6.003   4.628
  418   1HD   LYS  55          1HD       LYS  55 -18.007  -6.438   4.410
  419   2HD   LYS  55          2HD       LYS  55 -17.896  -7.021   6.071
  420   1HE   LYS  55          1HE       LYS  55 -16.822  -4.852   6.710
  421   2HE   LYS  55          2HE       LYS  55 -17.091  -4.275   5.065
  422   1HZ   LYS  55          3HZ       LYS  55 -19.350  -5.368   6.591
  423   2HZ   LYS  55          1HZ       LYS  55 -18.821  -3.787   6.918
  424   3HZ   LYS  55          2HZ       LYS  55 -19.346  -4.202   5.357
  425    H    LYS  56           H        LYS  56 -16.157 -11.855   4.983
  426    HA   LYS  56           HA       LYS  56 -17.707 -13.479   4.368
  427   1HB   LYS  56          1HB       LYS  56 -19.612 -11.161   4.771
  428   2HB   LYS  56          2HB       LYS  56 -20.125 -12.822   4.485
  429   1HG   LYS  56          1HG       LYS  56 -19.962 -13.140   6.713
  430   2HG   LYS  56          2HG       LYS  56 -18.214 -13.026   6.517
  431   1HD   LYS  56          1HD       LYS  56 -18.147 -11.003   7.523
  432   2HD   LYS  56          2HD       LYS  56 -19.485 -10.397   6.548
  433   1HE   LYS  56          1HE       LYS  56 -21.094 -11.093   8.079
  434   2HE   LYS  56          2HE       LYS  56 -20.062 -12.362   8.739
  435   1HZ   LYS  56          3HZ       LYS  56 -18.606 -10.345   9.448
  436   2HZ   LYS  56          1HZ       LYS  56 -20.063  -9.483   9.308
  437   3HZ   LYS  56          2HZ       LYS  56 -19.953 -10.795  10.380
  438    H    TRP  57           H        TRP  57 -19.617 -10.928   2.850
  439    HA   TRP  57           HA       TRP  57 -20.050 -12.184   0.431
  440   1HB   TRP  57          1HB       TRP  57 -20.580 -10.025  -0.505
  441   2HB   TRP  57          2HB       TRP  57 -21.124 -10.069   1.174
  442    HD1  TRP  57           HD1      TRP  57 -20.088  -8.270   2.764
  443    HE1  TRP  57           HE1      TRP  57 -18.559  -6.243   2.299
  444    HE3  TRP  57           HE3      TRP  57 -18.465  -9.525  -1.860
  445    HZ2  TRP  57           HZ2      TRP  57 -16.780  -5.321   0.212
  446    HZ3  TRP  57           HZ3      TRP  57 -16.958  -8.058  -3.124
  447    HH2  TRP  57           HH2      TRP  57 -16.081  -5.966  -2.090
  448    H    VAL  58           H        VAL  58 -17.208 -10.138   1.139
  449    HA   VAL  58           HA       VAL  58 -16.064 -10.102  -1.426
  450    HB   VAL  58           HB       VAL  58 -13.813 -10.401  -0.065
  451   1HG1  VAL  58          2HG1      VAL  58 -15.156  -8.312  -1.013
  452   2HG1  VAL  58          3HG1      VAL  58 -15.321  -7.962   0.705
  453   3HG1  VAL  58          1HG1      VAL  58 -13.719  -8.120  -0.018
  454   1HG2  VAL  58          3HG2      VAL  58 -15.588 -11.014   1.921
  455   2HG2  VAL  58          1HG2      VAL  58 -13.931 -10.470   2.168
  456   3HG2  VAL  58          2HG2      VAL  58 -15.258  -9.312   2.217
  457    H    ARG  59           H        ARG  59 -15.665 -12.670   1.038
  458    HA   ARG  59           HA       ARG  59 -14.050 -14.343  -0.653
  459   1HB   ARG  59          2HB       ARG  59 -15.606 -14.750   1.875
  460   2HB   ARG  59          1HB       ARG  59 -15.034 -16.153   1.007
  461   1HG   ARG  59          2HG       ARG  59 -12.746 -14.893   0.960
  462   2HG   ARG  59          1HG       ARG  59 -13.436 -13.947   2.279
  463   1HD   ARG  59          1HD       ARG  59 -13.342 -16.976   2.267
  464   2HD   ARG  59          2HD       ARG  59 -12.109 -15.968   3.024
  465    HE   ARG  59           HE       ARG  59 -14.837 -15.373   3.909
  466   1HH1  ARG  59          1HH2      ARG  59 -11.761 -15.860   5.375
  467   2HH1  ARG  59          2HH2      ARG  59 -12.838 -15.657   6.716
  468   1HH2  ARG  59          2HH1      ARG  59 -15.172 -17.464   5.887
  469   2HH2  ARG  59          1HH1      ARG  59 -13.821 -18.427   5.390
  470    H    GLU  60           H        GLU  60 -17.512 -13.996  -0.123
  471    HA   GLU  60           HA       GLU  60 -18.305 -16.319  -1.644
  472   1HB   GLU  60          1HB       GLU  60 -19.760 -13.763  -0.941
  473   2HB   GLU  60          2HB       GLU  60 -20.516 -15.094  -1.780
  474   1HG   GLU  60          2HG       GLU  60 -19.160 -16.179   0.469
  475   2HG   GLU  60          1HG       GLU  60 -20.071 -14.799   1.031
  476    H    TYR  61           H        TYR  61 -16.989 -13.294  -2.500
  477    HA   TYR  61           HA       TYR  61 -18.095 -13.339  -5.242
  478   1HB   TYR  61          1HB       TYR  61 -16.720 -11.368  -3.508
  479   2HB   TYR  61          2HB       TYR  61 -16.286 -11.299  -5.198
  480    HD1  TYR  61           HD1      TYR  61 -19.181 -11.243  -2.844
  481    HD2  TYR  61           HD2      TYR  61 -17.768 -10.399  -6.831
  482    HE1  TYR  61           HE1      TYR  61 -21.304 -10.042  -3.336
  483    HE2  TYR  61           HE2      TYR  61 -19.889  -9.196  -7.325
  484    HH   TYR  61           HH       TYR  61 -22.403  -9.397  -6.304
  485    H    ILE  62           H        ILE  62 -15.181 -13.956  -3.403
  486    HA   ILE  62           HA       ILE  62 -13.321 -14.080  -5.568
  487    HB   ILE  62           HB       ILE  62 -13.388 -15.523  -2.899
  488   1HG1  ILE  62          1HG1      ILE  62 -11.767 -13.131  -3.813
  489   2HG1  ILE  62          2HG1      ILE  62 -13.276 -13.002  -2.912
  490   1HG2  ILE  62          1HG2      ILE  62 -11.669 -15.891  -5.187
  491   2HG2  ILE  62          2HG2      ILE  62 -10.742 -15.230  -3.840
  492   3HG2  ILE  62          3HG2      ILE  62 -11.643 -16.731  -3.637
  493   1HD1  ILE  62          3HD1      ILE  62 -11.907 -14.814  -1.388
  494   2HD1  ILE  62          1HD1      ILE  62 -10.588 -13.805  -1.983
  495   3HD1  ILE  62          2HD1      ILE  62 -11.919 -13.076  -1.083
  496    H    ASN  63           H        ASN  63 -15.720 -16.344  -4.363
  497    HA   ASN  63           HA       ASN  63 -14.682 -18.511  -6.082
  498   1HB   ASN  63          1HB       ASN  63 -17.002 -18.336  -4.153
  499   2HB   ASN  63          2HB       ASN  63 -16.700 -19.743  -5.141
  500   1HD2  ASN  63          2HD2      ASN  63 -14.680 -18.633  -1.888
  501   2HD2  ASN  63          1HD2      ASN  63 -16.184 -19.419  -1.926
  502    H    SER  64           H        SER  64 -17.332 -16.190  -5.960
  503    HA   SER  64           HA       SER  64 -18.946 -17.322  -8.027
  504   1HB   SER  64          2HB       SER  64 -19.161 -15.141  -6.383
  505   2HB   SER  64          1HB       SER  64 -18.824 -14.373  -7.936
  506    HG   SER  64           HG       SER  64 -21.085 -14.818  -7.482
  507    H    LEU  65           H        LEU  65 -15.999 -15.427  -8.111
  508    HA   LEU  65           HA       LEU  65 -16.228 -14.871 -10.984
  509   1HB   LEU  65          1HB       LEU  65 -13.882 -14.543  -9.087
  510   2HB   LEU  65          2HB       LEU  65 -13.964 -13.915 -10.733
  511    HG   LEU  65           HG       LEU  65 -16.201 -13.210  -8.889
  512   1HD1  LEU  65          3HD1      LEU  65 -13.647 -12.902  -7.933
  513   2HD1  LEU  65          1HD1      LEU  65 -13.900 -11.368  -8.766
  514   3HD1  LEU  65          2HD1      LEU  65 -15.007 -11.872  -7.489
  515   1HD2  LEU  65          3HD2      LEU  65 -15.035 -12.339 -11.397
  516   2HD2  LEU  65          1HD2      LEU  65 -16.600 -11.925 -10.698
  517   3HD2  LEU  65          2HD2      LEU  65 -15.168 -10.988 -10.271
  518    H    GLU  66           H        GLU  66 -14.172 -16.935  -8.909
  519    HA   GLU  66           HA       GLU  66 -13.076 -18.287 -11.285
  520   1HB   GLU  66          1HB       GLU  66 -11.772 -17.782  -9.131
  521   2HB   GLU  66          2HB       GLU  66 -12.687 -19.101  -8.400
  522   1HG   GLU  66          1HG       GLU  66 -11.696 -20.719  -9.755
  523   2HG   GLU  66          2HG       GLU  66 -11.304 -19.558 -11.025
  524    H    MET  67           H        MET  67 -13.790 -20.242 -12.056
  525    HA   MET  67           HA       MET  67 -15.105 -22.176 -12.248
  526   1HB   MET  67          1HB       MET  67 -14.105 -22.280  -9.724
  527   2HB   MET  67          2HB       MET  67 -15.832 -22.222  -9.374
  528   1HG   MET  67          1HG       MET  67 -15.214 -24.547  -9.609
  529   2HG   MET  67          2HG       MET  67 -16.144 -24.097 -11.039
  530   1HE   MET  67          1HE       MET  67 -13.439 -25.839  -9.672
  531   2HE   MET  67          3HE       MET  67 -14.192 -26.716 -11.003
  532   3HE   MET  67          2HE       MET  67 -12.473 -26.329 -11.064
  533    H    SER  68           H        SER  68 -16.642 -20.634 -13.315
  534    HA   SER  68           HA       SER  68 -19.256 -20.758 -11.958
  535   1HB   SER  68          1HB       SER  68 -19.724 -18.411 -12.087
  536   2HB   SER  68          2HB       SER  68 -18.152 -18.558 -11.298
  537    HG   SER  68           HG       SER  68 -18.195 -16.989 -12.992
  538    H    SER   1           H        SER   1 -16.974  12.061   1.742
  539    HA   SER   1           HA       SER   1 -14.305  13.218   1.640
  540   1HB   SER   1          1HB       SER   1 -14.716  10.540   3.004
  541   2HB   SER   1          2HB       SER   1 -13.150  11.161   2.480
  542    HG   SER   1           HG       SER   1 -13.157  12.579   4.051
  543    HA   PRO   2           HA       PRO   2 -14.400  11.315  -2.305
  544   1HB   PRO   2          1HB       PRO   2 -11.624  10.539  -2.318
  545   2HB   PRO   2          2HB       PRO   2 -12.359  11.943  -3.099
  546   1HG   PRO   2          1HG       PRO   2 -10.670  11.904  -0.757
  547   2HG   PRO   2          2HG       PRO   2 -11.397  13.308  -1.545
  548   1HD   PRO   2          1HD       PRO   2 -12.141  12.106   0.970
  549   2HD   PRO   2          2HD       PRO   2 -12.873  13.516   0.178
  550    H    TYR   3           H        TYR   3 -15.170   9.292  -2.750
  551    HA   TYR   3           HA       TYR   3 -14.640   7.056  -0.974
  552   1HB   TYR   3          1HB       TYR   3 -16.050   7.213  -3.654
  553   2HB   TYR   3          2HB       TYR   3 -16.003   5.770  -2.641
  554    HD1  TYR   3           HD1      TYR   3 -17.047   5.803  -0.352
  555    HD2  TYR   3           HD2      TYR   3 -17.491   9.073  -3.138
  556    HE1  TYR   3           HE1      TYR   3 -18.966   6.674   0.977
  557    HE2  TYR   3           HE2      TYR   3 -19.410   9.944  -1.808
  558    HH   TYR   3           HH       TYR   3 -20.875   8.098   0.744
  559    H    SER   4           H        SER   4 -12.316   6.834  -1.151
  560    HA   SER   4           HA       SER   4 -11.415   5.728  -3.781
  561   1HB   SER   4          1HB       SER   4 -10.295   7.850  -2.875
  562   2HB   SER   4          2HB       SER   4  -9.610   6.822  -1.616
  563    HG   SER   4           HG       SER   4  -8.126   6.569  -3.102
  564    H    SER   5           H        SER   5 -10.552   3.677  -3.794
  565    HA   SER   5           HA       SER   5  -9.498   2.372  -1.442
  566   1HB   SER   5          1HB       SER   5 -11.313   0.587  -1.378
  567   2HB   SER   5          2HB       SER   5 -11.784   2.160  -0.736
  568    HG   SER   5           HG       SER   5 -13.357   1.376  -2.157
  569    H    ASP   6           H        ASP   6  -7.826   1.460  -2.592
  570    HA   ASP   6           HA       ASP   6  -8.357  -0.736  -4.386
  571   1HB   ASP   6          2HB       ASP   6  -7.540   0.237  -6.461
  572   2HB   ASP   6          1HB       ASP   6  -8.880   1.218  -5.873
  573    H    THR   7           H        THR   7  -5.813  -0.328  -5.868
  574    HA   THR   7           HA       THR   7  -4.107  -1.498  -3.880
  575    HB   THR   7           HB       THR   7  -3.987  -2.103  -6.274
  576    HG1  THR   7           HG1      THR   7  -1.538  -0.873  -5.670
  577   1HG2  THR   7          1HG2      THR   7  -2.976   0.741  -6.563
  578   2HG2  THR   7          2HG2      THR   7  -2.863  -0.483  -7.827
  579   3HG2  THR   7          3HG2      THR   7  -4.444   0.065  -7.271
  580    H    THR   8           H        THR   8  -1.726  -0.583  -3.767
  581    HA   THR   8           HA       THR   8  -1.592   2.355  -3.717
  582    HB   THR   8           HB       THR   8  -1.206   0.729  -1.183
  583    HG1  THR   8           HG1      THR   8  -3.332   0.900  -1.335
  584   1HG2  THR   8          1HG2      THR   8  -0.914   3.646  -1.903
  585   2HG2  THR   8          2HG2      THR   8  -1.218   3.142  -0.241
  586   3HG2  THR   8          3HG2      THR   8   0.238   2.598  -1.073
  587    HA   PRO   9           HA       PRO   9   2.332   0.664  -5.174
  588   1HB   PRO   9          1HB       PRO   9   3.230   3.425  -5.353
  589   2HB   PRO   9          2HB       PRO   9   2.887   2.294  -6.668
  590   1HG   PRO   9          2HG       PRO   9   1.286   4.537  -5.824
  591   2HG   PRO   9          1HG       PRO   9   0.918   3.377  -7.102
  592   1HD   PRO   9          1HD       PRO   9  -0.347   3.628  -4.554
  593   2HD   PRO   9          2HD       PRO   9  -0.678   2.431  -5.822
  594    H    CYS  10           H        CYS  10   3.081  -0.164  -3.183
  595    HA   CYS  10           HA       CYS  10   4.616   1.778  -1.513
  596   1HB   CYS  10          2HB       CYS  10   2.347   0.807  -0.573
  597   2HB   CYS  10          1HB       CYS  10   3.317  -0.609  -0.264
  598    H    CYS  11           H        CYS  11   6.492   0.944  -0.553
  599    HA   CYS  11           HA       CYS  11   7.332  -1.640  -1.736
  600   1HB   CYS  11          2HB       CYS  11   9.289  -0.737  -2.377
  601   2HB   CYS  11          1HB       CYS  11   8.559   0.825  -2.058
  602    H    PHE  12           H        PHE  12   8.140  -3.233  -0.328
  603    HA   PHE  12           HA       PHE  12   7.784  -2.594   2.559
  604   1HB   PHE  12          1HB       PHE  12   6.904  -4.754   1.031
  605   2HB   PHE  12          2HB       PHE  12   8.263  -5.399   1.922
  606    HD1  PHE  12           HD1      PHE  12   5.439  -2.997   2.577
  607    HD2  PHE  12           HD2      PHE  12   7.736  -6.371   3.983
  608    HE1  PHE  12           HE1      PHE  12   4.120  -3.013   4.693
  609    HE2  PHE  12           HE2      PHE  12   6.405  -6.400   6.091
  610    HZ   PHE  12           HZ       PHE  12   4.601  -4.717   6.449
  611    H    ALA  13           H        ALA  13   9.984  -4.590   0.543
  612    HA   ALA  13           HA       ALA  13  12.072  -4.210   2.616
  613   1HB   ALA  13          3HB       ALA  13  11.617  -6.150   0.391
  614   2HB   ALA  13          1HB       ALA  13  13.283  -5.825   0.873
  615   3HB   ALA  13          2HB       ALA  13  12.129  -6.451   2.051
  616    H    TYR  14           H        TYR  14  13.412  -2.539   2.394
  617    HA   TYR  14           HA       TYR  14  14.106  -1.725  -0.372
  618   1HB   TYR  14          1HB       TYR  14  14.647   0.548   0.799
  619   2HB   TYR  14          2HB       TYR  14  12.975   0.165   0.402
  620    HD1  TYR  14           HD1      TYR  14  15.472   0.457   3.098
  621    HD2  TYR  14           HD2      TYR  14  11.361  -0.451   2.144
  622    HE1  TYR  14           HE1      TYR  14  14.900   0.491   5.518
  623    HE2  TYR  14           HE2      TYR  14  10.793  -0.418   4.558
  624    HH   TYR  14           HH       TYR  14  11.758  -0.532   6.694
  625    H    ILE  15           H        ILE  15  16.107  -2.683  -0.677
  626    HA   ILE  15           HA       ILE  15  18.403  -1.631   0.641
  627    HB   ILE  15           HB       ILE  15  17.582  -2.869   2.610
  628   1HG1  ILE  15          1HG1      ILE  15  19.876  -4.473   1.520
  629   2HG1  ILE  15          2HG1      ILE  15  20.083  -2.775   1.874
  630   1HG2  ILE  15          1HG2      ILE  15  16.783  -4.745   0.675
  631   2HG2  ILE  15          2HG2      ILE  15  18.054  -5.546   1.597
  632   3HG2  ILE  15          3HG2      ILE  15  16.635  -4.906   2.425
  633   1HD1  ILE  15          2HD1      ILE  15  19.276  -3.171   4.189
  634   2HD1  ILE  15          3HD1      ILE  15  19.133  -4.890   3.823
  635   3HD1  ILE  15          1HD1      ILE  15  20.719  -4.118   3.825
  636    H    ALA  16           H        ALA  16  20.079  -2.031  -0.723
  637    HA   ALA  16           HA       ALA  16  20.766  -4.516  -1.864
  638   1HB   ALA  16          1HB       ALA  16  18.531  -3.249  -3.181
  639   2HB   ALA  16          2HB       ALA  16  19.906  -3.329  -4.283
  640   3HB   ALA  16          3HB       ALA  16  19.287  -4.802  -3.537
  641    H    ARG  17           H        ARG  17  21.986  -2.033  -0.832
  642    HA   ARG  17           HA       ARG  17  23.909  -0.803  -1.277
  643   1HB   ARG  17          2HB       ARG  17  24.083  -2.187  -3.956
  644   2HB   ARG  17          1HB       ARG  17  25.395  -1.539  -2.973
  645   1HG   ARG  17          1HG       ARG  17  24.433  -3.305  -1.208
  646   2HG   ARG  17          2HG       ARG  17  23.895  -4.106  -2.684
  647   1HD   ARG  17          1HD       ARG  17  25.982  -4.923  -2.915
  648   2HD   ARG  17          2HD       ARG  17  26.537  -3.274  -3.198
  649    HE   ARG  17           HE       ARG  17  26.310  -4.236  -0.393
  650   1HH1  ARG  17          2HH2      ARG  17  27.775  -1.768  -1.942
  651   2HH1  ARG  17          1HH2      ARG  17  29.360  -2.446  -2.115
  652   1HH2  ARG  17          1HH1      ARG  17  28.623  -4.743   0.357
  653   2HH2  ARG  17          2HH1      ARG  17  29.803  -4.465  -0.880
  654    HA   PRO  18           HA       PRO  18  22.064   2.609  -3.346
  655   1HB   PRO  18          1HB       PRO  18  24.693   3.587  -4.110
  656   2HB   PRO  18          2HB       PRO  18  23.558   4.290  -2.996
  657   1HG   PRO  18          2HG       PRO  18  25.961   2.936  -2.319
  658   2HG   PRO  18          1HG       PRO  18  24.694   3.450  -1.199
  659   1HD   PRO  18          1HD       PRO  18  25.355   0.767  -1.988
  660   2HD   PRO  18          2HD       PRO  18  24.128   1.287  -0.849
  661    H    LEU  19           H        LEU  19  21.124   1.685  -5.134
  662    HA   LEU  19           HA       LEU  19  22.181   0.311  -7.268
  663   1HB   LEU  19          2HB       LEU  19  20.030   2.429  -7.374
  664   2HB   LEU  19          1HB       LEU  19  20.295   1.223  -8.609
  665    HG   LEU  19           HG       LEU  19  19.568   0.688  -5.717
  666   1HD1  LEU  19          3HD1      LEU  19  17.970   1.332  -7.951
  667   2HD1  LEU  19          1HD1      LEU  19  17.798  -0.407  -7.721
  668   3HD1  LEU  19          2HD1      LEU  19  17.423   0.698  -6.399
  669   1HD2  LEU  19          3HD2      LEU  19  20.555  -1.034  -7.932
  670   2HD2  LEU  19          1HD2      LEU  19  20.740  -1.227  -6.188
  671   3HD2  LEU  19          2HD2      LEU  19  19.221  -1.672  -6.969
  672    HA   PRO  20           HA       PRO  20  25.025   3.315  -9.025
  673   1HB   PRO  20          1HB       PRO  20  25.249   1.719 -11.415
  674   2HB   PRO  20          2HB       PRO  20  26.421   1.869 -10.101
  675   1HG   PRO  20          1HG       PRO  20  24.735  -0.392 -10.713
  676   2HG   PRO  20          2HG       PRO  20  25.902  -0.238  -9.395
  677   1HD   PRO  20          1HD       PRO  20  23.020  -0.205  -9.226
  678   2HD   PRO  20          2HD       PRO  20  24.192  -0.068  -7.902
  679    H    ARG  21           H        ARG  21  24.896   4.849 -10.808
  680    HA   ARG  21           HA       ARG  21  22.183   5.325 -11.719
  681   1HB   ARG  21          1HB       ARG  21  23.741   7.176 -11.235
  682   2HB   ARG  21          2HB       ARG  21  24.777   6.656 -12.542
  683   1HG   ARG  21          1HG       ARG  21  23.358   7.439 -14.169
  684   2HG   ARG  21          2HG       ARG  21  21.915   7.091 -13.217
  685   1HD   ARG  21          2HD       ARG  21  21.848   9.204 -12.439
  686   2HD   ARG  21          1HD       ARG  21  23.527   9.110 -11.908
  687    HE   ARG  21           HE       ARG  21  22.585  10.351 -14.365
  688   1HH1  ARG  21          1HH2      ARG  21  25.573   9.002 -12.782
  689   2HH1  ARG  21          2HH2      ARG  21  26.034  10.640 -13.108
  690   1HH2  ARG  21          2HH1      ARG  21  24.182  10.472 -16.108
  691   2HH2  ARG  21          1HH1      ARG  21  25.769   9.864 -15.773
  692    H    ALA  22           H        ALA  22  24.806   3.491 -12.989
  693    HA   ALA  22           HA       ALA  22  23.837   3.729 -15.763
  694   1HB   ALA  22          1HB       ALA  22  26.127   2.272 -14.448
  695   2HB   ALA  22          2HB       ALA  22  25.668   1.928 -16.116
  696   3HB   ALA  22          3HB       ALA  22  26.190   3.550 -15.660
  697    H    HIS  23           H        HIS  23  22.663   2.121 -13.171
  698    HA   HIS  23           HA       HIS  23  21.838  -0.199 -14.867
  699   1HB   HIS  23          2HB       HIS  23  22.054  -0.195 -11.846
  700   2HB   HIS  23          1HB       HIS  23  21.734  -1.578 -12.889
  701    HD2  HIS  23           HD2      HIS  23  24.729   1.058 -13.159
  702    HE1  HIS  23           HE1      HIS  23  26.293  -2.869 -13.112
  703    HE2  HIS  23           HE2      HIS  23  26.883  -0.402 -13.319
  704    H    ILE  24           H        ILE  24  20.783   2.583 -13.188
  705    HA   ILE  24           HA       ILE  24  18.076   1.418 -12.823
  706    HB   ILE  24           HB       ILE  24  18.962   4.169 -11.997
  707   1HG1  ILE  24          2HG1      ILE  24  18.978   1.624 -10.369
  708   2HG1  ILE  24          1HG1      ILE  24  20.393   2.500 -10.892
  709   1HG2  ILE  24          2HG2      ILE  24  16.622   2.382 -11.356
  710   2HG2  ILE  24          3HG2      ILE  24  17.046   3.759 -10.341
  711   3HG2  ILE  24          1HG2      ILE  24  16.596   4.011 -12.027
  712   1HD1  ILE  24          1HD1      ILE  24  18.775   4.432  -9.663
  713   2HD1  ILE  24          2HD1      ILE  24  18.664   3.016  -8.619
  714   3HD1  ILE  24          3HD1      ILE  24  20.240   3.713  -8.992
  715    H    LYS  25           H        LYS  25  16.212   2.774 -13.513
  716    HA   LYS  25           HA       LYS  25  16.838   4.206 -16.061
  717   1HB   LYS  25          1HB       LYS  25  15.059   2.106 -15.580
  718   2HB   LYS  25          2HB       LYS  25  14.029   3.536 -15.647
  719   1HG   LYS  25          1HG       LYS  25  14.142   3.113 -17.903
  720   2HG   LYS  25          2HG       LYS  25  15.627   4.054 -17.755
  721   1HD   LYS  25          1HD       LYS  25  16.953   2.238 -18.111
  722   2HD   LYS  25          2HD       LYS  25  15.931   1.185 -17.132
  723   1HE   LYS  25          1HE       LYS  25  14.243   1.472 -19.147
  724   2HE   LYS  25          2HE       LYS  25  15.708   1.876 -20.044
  725   1HZ   LYS  25          2HZ       LYS  25  16.677  -0.221 -19.148
  726   2HZ   LYS  25          3HZ       LYS  25  15.139  -0.622 -18.549
  727   3HZ   LYS  25          1HZ       LYS  25  15.382  -0.449 -20.221
  728    H    GLU  26           H        GLU  26  14.015   4.293 -13.853
  729    HA   GLU  26           HA       GLU  26  14.407   7.216 -13.612
  730   1HB   GLU  26          2HB       GLU  26  12.433   6.111 -15.002
  731   2HB   GLU  26          1HB       GLU  26  11.727   5.899 -13.403
  732   1HG   GLU  26          1HG       GLU  26  11.240   8.048 -13.255
  733   2HG   GLU  26          2HG       GLU  26  12.878   8.520 -13.669
  734    H    TYR  27           H        TYR  27  12.038   7.175 -11.714
  735    HA   TYR  27           HA       TYR  27  12.832   5.459  -9.527
  736   1HB   TYR  27          1HB       TYR  27  13.365   7.295  -7.958
  737   2HB   TYR  27          2HB       TYR  27  14.511   7.263  -9.297
  738    HD1  TYR  27           HD2      TYR  27  14.162   8.847 -11.265
  739    HD2  TYR  27           HD1      TYR  27  11.981   9.193  -7.556
  740    HE1  TYR  27           HE2      TYR  27  13.556  11.196 -11.840
  741    HE2  TYR  27           HE1      TYR  27  11.375  11.542  -8.130
  742    HH   TYR  27           HH       TYR  27  12.868  13.374 -10.208
  743    H    PHE  28           H        PHE  28  11.336   6.277  -7.497
  744    HA   PHE  28           HA       PHE  28   8.982   7.707  -8.418
  745   1HB   PHE  28          1HB       PHE  28   8.526   5.563  -9.461
  746   2HB   PHE  28          2HB       PHE  28   8.827   4.721  -7.962
  747    HD1  PHE  28           HD1      PHE  28   6.481   6.926  -9.782
  748    HD2  PHE  28           HD2      PHE  28   7.203   4.726  -6.137
  749    HE1  PHE  28           HE1      PHE  28   4.095   7.231  -9.123
  750    HE2  PHE  28           HE2      PHE  28   4.824   5.044  -5.472
  751    HZ   PHE  28           HZ       PHE  28   3.266   6.289  -6.969
  752    H    TYR  29           H        TYR  29   9.273   8.979  -6.520
  753    HA   TYR  29           HA       TYR  29   9.634   7.907  -3.898
  754   1HB   TYR  29          2HB       TYR  29  10.024  10.270  -4.365
  755   2HB   TYR  29          1HB       TYR  29   8.326  10.494  -4.772
  756    HD1  TYR  29           HD2      TYR  29  10.461   9.166  -1.967
  757    HD2  TYR  29           HD1      TYR  29   6.875  11.278  -3.114
  758    HE1  TYR  29           HE2      TYR  29   9.930   9.567   0.434
  759    HE2  TYR  29           HE1      TYR  29   6.342  11.677  -0.713
  760    HH   TYR  29           HH       TYR  29   7.258  11.658   1.406
  761    H    THR  30           H        THR  30   8.224   6.969  -2.552
  762    HA   THR  30           HA       THR  30   5.633   6.124  -3.419
  763    HB   THR  30           HB       THR  30   5.309   5.361  -1.103
  764    HG1  THR  30           HG1      THR  30   6.144   6.632   0.331
  765   1HG2  THR  30          3HG2      THR  30   7.817   4.902  -2.616
  766   2HG2  THR  30          1HG2      THR  30   7.836   4.370  -0.934
  767   3HG2  THR  30          2HG2      THR  30   6.618   3.741  -2.044
  768    H    SER  31           H        SER  31   3.710   6.628  -1.665
  769    HA   SER  31           HA       SER  31   3.376   9.586  -1.820
  770   1HB   SER  31          1HB       SER  31   1.029   9.210  -1.839
  771   2HB   SER  31          2HB       SER  31   1.693   7.946  -2.873
  772    HG   SER  31           HG       SER  31   0.116   7.386  -1.102
  773    H    GLY  32           H        GLY  32   1.225   9.626   0.144
  774   1HA   GLY  32          2HA       GLY  32   2.823   9.153   2.625
  775   2HA   GLY  32          1HA       GLY  32   1.801  10.554   2.418
  776    H    LYS  33           H        LYS  33   0.586   7.602   1.118
  777    HA   LYS  33           HA       LYS  33  -1.471   7.545   3.263
  778   1HB   LYS  33          1HB       LYS  33  -1.337   6.705   0.416
  779   2HB   LYS  33          2HB       LYS  33  -2.306   5.700   1.467
  780   1HG   LYS  33          2HG       LYS  33  -3.467   7.794   2.267
  781   2HG   LYS  33          1HG       LYS  33  -2.607   8.671   1.000
  782   1HD   LYS  33          1HD       LYS  33  -3.592   7.105  -0.679
  783   2HD   LYS  33          2HD       LYS  33  -4.515   6.354   0.597
  784   1HE   LYS  33          1HE       LYS  33  -4.716   9.310   0.403
  785   2HE   LYS  33          2HE       LYS  33  -5.478   8.386  -0.892
  786   1HZ   LYS  33          2HZ       LYS  33  -5.936   7.943   2.008
  787   2HZ   LYS  33          3HZ       LYS  33  -6.981   8.799   0.980
  788   3HZ   LYS  33          1HZ       LYS  33  -6.716   7.140   0.731
  789    H    CYS  34           H        CYS  34   0.564   5.271   1.422
  790    HA   CYS  34           HA       CYS  34   0.071   2.986   3.024
  791   1HB   CYS  34          1HB       CYS  34   1.167   2.932   0.808
  792   2HB   CYS  34          2HB       CYS  34   2.583   3.723   1.497
  793    H    SER  35           H        SER  35   1.487   1.979   4.623
  794    HA   SER  35           HA       SER  35   2.733   4.004   6.401
  795   1HB   SER  35          1HB       SER  35   2.673   1.193   7.291
  796   2HB   SER  35          2HB       SER  35   2.139   2.650   8.130
  797    HG   SER  35           HG       SER  35   0.228   1.929   7.661
  798    H    ASN  36           H        ASN  36   4.330   3.778   4.290
  799    HA   ASN  36           HA       ASN  36   6.765   2.627   5.360
  800   1HB   ASN  36          2HB       ASN  36   5.122   0.925   3.759
  801   2HB   ASN  36          1HB       ASN  36   6.546   1.323   2.829
  802   1HD2  ASN  36          2HD2      ASN  36   6.749  -0.798   6.306
  803   2HD2  ASN  36          1HD2      ASN  36   5.493  -0.937   5.172
  804    HA   PRO  37           HA       PRO  37   6.941   6.220   2.366
  805   1HB   PRO  37          1HB       PRO  37   8.943   7.316   4.153
  806   2HB   PRO  37          2HB       PRO  37   7.352   7.977   3.759
  807   1HG   PRO  37          2HG       PRO  37   8.171   6.725   6.219
  808   2HG   PRO  37          1HG       PRO  37   6.568   7.346   5.807
  809   1HD   PRO  37          2HD       PRO  37   7.393   4.592   6.046
  810   2HD   PRO  37          1HD       PRO  37   5.784   5.213   5.632
  811    H    ALA  38           H        ALA  38   8.660   6.502   0.866
  812    HA   ALA  38           HA       ALA  38  11.367   5.757   1.268
  813   1HB   ALA  38          3HB       ALA  38   9.722   3.504   1.222
  814   2HB   ALA  38          1HB       ALA  38  10.358   3.593  -0.420
  815   3HB   ALA  38          2HB       ALA  38  11.465   3.516   0.953
  816    H    VAL  39           H        VAL  39  11.891   4.599  -1.266
  817    HA   VAL  39           HA       VAL  39  10.663   6.418  -3.233
  818    HB   VAL  39           HB       VAL  39  13.075   7.091  -2.042
  819   1HG1  VAL  39          1HG1      VAL  39  14.030   5.098  -3.426
  820   2HG1  VAL  39          2HG1      VAL  39  13.861   6.195  -4.797
  821   3HG1  VAL  39          3HG1      VAL  39  14.892   6.636  -3.436
  822   1HG2  VAL  39          3HG2      VAL  39  11.611   7.851  -4.503
  823   2HG2  VAL  39          1HG2      VAL  39  12.071   8.833  -3.113
  824   3HG2  VAL  39          2HG2      VAL  39  13.267   8.441  -4.348
  825    H    VAL  40           H        VAL  40  10.920   5.474  -5.396
  826    HA   VAL  40           HA       VAL  40  11.902   2.674  -5.191
  827    HB   VAL  40           HB       VAL  40   9.330   3.631  -6.442
  828   1HG1  VAL  40          1HG1      VAL  40  10.882   1.519  -7.364
  829   2HG1  VAL  40          2HG1      VAL  40   9.777   0.745  -6.235
  830   3HG1  VAL  40          3HG1      VAL  40   9.146   1.688  -7.582
  831   1HG2  VAL  40          1HG2      VAL  40   9.427   3.374  -3.976
  832   2HG2  VAL  40          2HG2      VAL  40   8.345   2.198  -4.723
  833   3HG2  VAL  40          3HG2      VAL  40   9.958   1.706  -4.194
  834    H    PHE  41           H        PHE  41  13.497   2.316  -6.547
  835    HA   PHE  41           HA       PHE  41  13.748   3.945  -8.959
  836   1HB   PHE  41          1HB       PHE  41  15.504   1.884  -7.637
  837   2HB   PHE  41          2HB       PHE  41  15.861   2.491  -9.234
  838    HD1  PHE  41           HD1      PHE  41  15.521   5.242  -9.348
  839    HD2  PHE  41           HD2      PHE  41  16.680   2.907  -5.909
  840    HE1  PHE  41           HE1      PHE  41  16.640   7.242  -8.368
  841    HE2  PHE  41           HE2      PHE  41  17.792   4.906  -4.930
  842    HZ   PHE  41           HZ       PHE  41  17.786   7.071  -6.159
  843    H    VAL  42           H        VAL  42  13.344   3.310 -10.932
  844    HA   VAL  42           HA       VAL  42  12.259   0.554 -11.325
  845    HB   VAL  42           HB       VAL  42  11.780   1.861 -13.665
  846   1HG1  VAL  42          2HG2      VAL  42  10.266   0.527 -12.106
  847   2HG1  VAL  42          3HG2      VAL  42   9.949   2.052 -11.279
  848   3HG1  VAL  42          1HG2      VAL  42   9.494   1.855 -12.972
  849   1HG2  VAL  42          2HG1      VAL  42  12.623   4.007 -12.575
  850   2HG2  VAL  42          3HG1      VAL  42  11.018   4.084 -13.299
  851   3HG2  VAL  42          1HG1      VAL  42  11.193   3.925 -11.551
  852    H    THR  43           H        THR  43  14.515  -0.239 -11.324
  853    HA   THR  43           HA       THR  43  16.465   0.831 -13.177
  854    HB   THR  43           HB       THR  43  17.990  -0.678 -12.230
  855    HG1  THR  43           HG1      THR  43  17.121  -2.572 -11.097
  856   1HG2  THR  43          1HG2      THR  43  16.224   0.682 -10.525
  857   2HG2  THR  43          2HG2      THR  43  16.378  -0.931  -9.828
  858   3HG2  THR  43          3HG2      THR  43  17.817   0.051 -10.107
  859    H    ARG  44           H        ARG  44  17.757  -1.519 -14.038
  860    HA   ARG  44           HA       ARG  44  16.841  -1.795 -16.617
  861   1HB   ARG  44          1HB       ARG  44  17.946  -4.171 -16.478
  862   2HB   ARG  44          2HB       ARG  44  18.939  -2.749 -16.297
  863   1HG   ARG  44          1HG       ARG  44  19.561  -3.403 -14.238
  864   2HG   ARG  44          2HG       ARG  44  17.879  -3.459 -13.720
  865   1HD   ARG  44          1HD       ARG  44  18.065  -5.700 -13.604
  866   2HD   ARG  44          2HD       ARG  44  18.227  -5.721 -15.359
  867    HE   ARG  44           HE       ARG  44  20.742  -5.409 -14.900
  868   1HH1  ARG  44          2HH1      ARG  44  19.290  -6.027 -11.835
  869   2HH1  ARG  44          1HH1      ARG  44  20.897  -6.553 -11.462
  870   1HH2  ARG  44          1HH2      ARG  44  21.816  -7.809 -14.171
  871   2HH2  ARG  44          2HH2      ARG  44  20.415  -8.643 -13.588
  872    H    LYS  45           H        LYS  45  16.235  -4.348 -14.146
  873    HA   LYS  45           HA       LYS  45  14.223  -5.706 -15.646
  874   1HB   LYS  45          2HB       LYS  45  15.299  -5.942 -13.066
  875   2HB   LYS  45          1HB       LYS  45  13.604  -5.618 -12.801
  876   1HG   LYS  45          1HG       LYS  45  14.582  -7.711 -14.752
  877   2HG   LYS  45          2HG       LYS  45  14.204  -8.075 -13.068
  878   1HD   LYS  45          1HD       LYS  45  12.092  -8.425 -13.831
  879   2HD   LYS  45          2HD       LYS  45  11.977  -6.665 -13.852
  880   1HE   LYS  45          1HE       LYS  45  12.117  -6.554 -16.132
  881   2HE   LYS  45          2HE       LYS  45  13.258  -7.895 -16.227
  882   1HZ   LYS  45          2HZ       LYS  45  10.593  -8.587 -15.325
  883   2HZ   LYS  45          3HZ       LYS  45  10.696  -8.071 -16.940
  884   3HZ   LYS  45          1HZ       LYS  45  11.619  -9.395 -16.411
  885    H    ASN  46           H        ASN  46  14.266  -2.825 -13.748
  886    HA   ASN  46           HA       ASN  46  12.866  -1.028 -13.617
  887   1HB   ASN  46          2HB       ASN  46  12.065  -2.388 -16.070
  888   2HB   ASN  46          1HB       ASN  46  10.695  -1.625 -15.307
  889   1HD2  ASN  46          1HD2      ASN  46  12.725   0.687 -17.560
  890   2HD2  ASN  46          2HD2      ASN  46  11.438  -0.413 -17.692
  891    H    ARG  47           H        ARG  47  12.213  -3.913 -12.379
  892    HA   ARG  47           HA       ARG  47   9.415  -3.713 -11.703
  893   1HB   ARG  47          1HB       ARG  47  11.738  -4.796 -10.059
  894   2HB   ARG  47          2HB       ARG  47  10.032  -5.036  -9.678
  895   1HG   ARG  47          1HG       ARG  47   9.710  -6.516 -11.428
  896   2HG   ARG  47          2HG       ARG  47  10.979  -5.790 -12.413
  897   1HD   ARG  47          1HD       ARG  47  12.583  -7.139 -11.539
  898   2HD   ARG  47          2HD       ARG  47  11.961  -6.958  -9.899
  899    HE   ARG  47           HE       ARG  47  10.274  -8.642 -11.582
  900   1HH1  ARG  47          2HH2      ARG  47  11.300  -9.100  -8.403
  901   2HH1  ARG  47          1HH2      ARG  47  10.654 -10.614  -8.943
  902   1HH2  ARG  47          1HH1      ARG  47  13.055  -9.900 -11.621
  903   2HH2  ARG  47          2HH1      ARG  47  12.624 -11.194 -10.552
  904    H    GLN  48           H        GLN  48   8.712  -2.751  -9.465
  905    HA   GLN  48           HA       GLN  48  10.101  -0.199  -9.304
  906   1HB   GLN  48          2HB       GLN  48   7.482  -1.230  -8.421
  907   2HB   GLN  48          1HB       GLN  48   8.193   0.028  -7.403
  908   1HG   GLN  48          1HG       GLN  48   8.544   1.441  -9.376
  909   2HG   GLN  48          2HG       GLN  48   7.953   0.185 -10.423
  910   1HE2  GLN  48          1HE2      GLN  48   4.670   0.308  -8.799
  911   2HE2  GLN  48          2HE2      GLN  48   5.425  -0.304 -10.190
  912    H    VAL  49           H        VAL  49  12.021  -1.016  -8.601
  913    HA   VAL  49           HA       VAL  49  12.401  -2.485  -6.179
  914    HB   VAL  49           HB       VAL  49  14.573  -0.722  -7.137
  915   1HG1  VAL  49          2HG1      VAL  49  14.306  -3.658  -6.465
  916   2HG1  VAL  49          3HG1      VAL  49  15.829  -2.849  -6.837
  917   3HG1  VAL  49          1HG1      VAL  49  14.922  -2.397  -5.392
  918   1HG2  VAL  49          1HG2      VAL  49  13.322  -2.886  -8.855
  919   2HG2  VAL  49          2HG2      VAL  49  13.791  -1.263  -9.354
  920   3HG2  VAL  49          3HG2      VAL  49  15.025  -2.474  -9.007
  921    H    CYS  50           H        CYS  50  13.386  -1.587  -4.183
  922    HA   CYS  50           HA       CYS  50  12.524   1.237  -3.762
  923   1HB   CYS  50          2HB       CYS  50  11.748  -0.947  -2.347
  924   2HB   CYS  50          1HB       CYS  50  13.133  -0.437  -1.414
  925    H    ALA  51           H        ALA  51  13.915   1.937  -1.557
  926    HA   ALA  51           HA       ALA  51  16.583   1.110  -1.282
  927   1HB   ALA  51          3HB       ALA  51  16.097   2.870  -3.616
  928   2HB   ALA  51          1HB       ALA  51  17.448   3.336  -2.583
  929   3HB   ALA  51          2HB       ALA  51  17.414   1.734  -3.317
  930    H    ASN  52           H        ASN  52  14.362   2.344   0.218
  931    HA   ASN  52           HA       ASN  52  14.202   3.771   2.055
  932   1HB   ASN  52          1HB       ASN  52  16.541   2.915   2.427
  933   2HB   ASN  52          2HB       ASN  52  17.134   4.310   1.526
  934   1HD2  ASN  52          2HD2      ASN  52  16.212   4.434   5.377
  935   2HD2  ASN  52          1HD2      ASN  52  14.957   3.722   4.483
  936    HA   PRO  53           HA       PRO  53  13.604   7.655   0.001
  937   1HB   PRO  53          1HB       PRO  53  12.586   9.018   2.193
  938   2HB   PRO  53          2HB       PRO  53  11.644   7.945   1.178
  939   1HG   PRO  53          2HG       PRO  53  12.608   7.514   3.930
  940   2HG   PRO  53          1HG       PRO  53  11.340   6.669   3.065
  941   1HD   PRO  53          2HD       PRO  53  13.999   5.741   3.560
  942   2HD   PRO  53          1HD       PRO  53  12.763   4.947   2.594
  943    H    GLU  54           H        GLU  54  14.835   7.892   3.365
  944    HA   GLU  54           HA       GLU  54  16.467  10.243   2.546
  945   1HB   GLU  54          1HB       GLU  54  15.890   9.223   5.339
  946   2HB   GLU  54          2HB       GLU  54  16.581  10.785   4.901
  947   1HG   GLU  54          1HG       GLU  54  14.543  11.673   4.476
  948   2HG   GLU  54          2HG       GLU  54  14.042  10.265   3.540
  949    H    LYS  55           H        LYS  55  17.532   7.806   1.678
  950    HA   LYS  55           HA       LYS  55  19.643   7.107   3.643
  951   1HB   LYS  55          2HB       LYS  55  18.366   5.736   1.442
  952   2HB   LYS  55          1HB       LYS  55  20.100   5.696   1.266
  953   1HG   LYS  55          1HG       LYS  55  18.975   5.149   3.974
  954   2HG   LYS  55          2HG       LYS  55  18.805   3.891   2.751
  955   1HD   LYS  55          1HD       LYS  55  21.336   4.281   2.309
  956   2HD   LYS  55          2HD       LYS  55  21.331   5.092   3.875
  957   1HE   LYS  55          1HE       LYS  55  20.317   3.037   4.882
  958   2HE   LYS  55          2HE       LYS  55  20.476   2.234   3.319
  959   1HZ   LYS  55          3HZ       LYS  55  22.829   3.519   4.522
  960   2HZ   LYS  55          1HZ       LYS  55  22.331   2.001   5.099
  961   3HZ   LYS  55          2HZ       LYS  55  22.747   2.193   3.464
  962    H    LYS  56           H        LYS  56  19.505   9.730   2.252
  963    HA   LYS  56           HA       LYS  56  20.999  11.249   1.316
  964   1HB   LYS  56          1HB       LYS  56  22.942   9.002   1.903
  965   2HB   LYS  56          2HB       LYS  56  23.424  10.606   1.356
  966   1HG   LYS  56          1HG       LYS  56  23.413  11.229   3.525
  967   2HG   LYS  56          2HG       LYS  56  21.656  11.097   3.467
  968   1HD   LYS  56          1HD       LYS  56  21.667   9.232   4.743
  969   2HD   LYS  56          2HD       LYS  56  22.940   8.491   3.774
  970   1HE   LYS  56          1HE       LYS  56  24.644   9.385   5.082
  971   2HE   LYS  56          2HE       LYS  56  23.653  10.738   5.628
  972   1HZ   LYS  56          3HZ       LYS  56  22.259   8.845   6.706
  973   2HZ   LYS  56          1HZ       LYS  56  23.706   7.964   6.589
  974   3HZ   LYS  56          2HZ       LYS  56  23.663   9.413   7.475
  975    H    TRP  57           H        TRP  57  22.816   8.506   0.036
  976    HA   TRP  57           HA       TRP  57  23.076   9.416  -2.557
  977   1HB   TRP  57          1HB       TRP  57  23.549   7.147  -3.222
  978   2HB   TRP  57          2HB       TRP  57  24.210   7.422  -1.609
  979    HD1  TRP  57           HD1      TRP  57  23.298   5.863   0.286
  980    HE1  TRP  57           HE1      TRP  57  21.746   3.802   0.218
  981    HE3  TRP  57           HE3      TRP  57  21.356   6.466  -4.346
  982    HZ2  TRP  57           HZ2      TRP  57  19.832   2.605  -1.594
  983    HZ3  TRP  57           HZ3      TRP  57  19.776   4.843  -5.287
  984    HH2  TRP  57           HH2      TRP  57  18.977   2.925  -3.912
  985    H    VAL  58           H        VAL  58  20.301   7.492  -1.390
  986    HA   VAL  58           HA       VAL  58  18.983   7.113  -3.841
  987    HB   VAL  58           HB       VAL  58  16.829   7.606  -2.382
  988   1HG1  VAL  58          2HG1      VAL  58  18.115   5.399  -3.119
  989   2HG1  VAL  58          3HG1      VAL  58  18.398   5.292  -1.385
  990   3HG1  VAL  58          1HG1      VAL  58  16.750   5.353  -2.014
  991   1HG2  VAL  58          3HG2      VAL  58  18.733   8.481  -0.634
  992   2HG2  VAL  58          1HG2      VAL  58  17.101   7.980  -0.195
  993   3HG2  VAL  58          2HG2      VAL  58  18.439   6.838  -0.080
  994    H    ARG  59           H        ARG  59  18.742   9.998  -1.728
  995    HA   ARG  59           HA       ARG  59  17.001  11.428  -3.516
  996   1HB   ARG  59          1HB       ARG  59  18.727  12.171  -1.179
  997   2HB   ARG  59          2HB       ARG  59  18.088  13.446  -2.190
  998   1HG   ARG  59          2HG       ARG  59  15.809  12.201  -1.907
  999   2HG   ARG  59          1HG       ARG  59  16.592  11.443  -0.522
 1000   1HD   ARG  59          1HD       ARG  59  16.482  14.442  -0.944
 1001   2HD   ARG  59          2HD       ARG  59  15.309  13.553   0.029
 1002    HE   ARG  59           HE       ARG  59  18.095  13.074   0.798
 1003   1HH1  ARG  59          1HH2      ARG  59  15.124  13.773   2.390
 1004   2HH1  ARG  59          2HH2      ARG  59  16.291  13.753   3.669
 1005   1HH2  ARG  59          2HH1      ARG  59  18.554  15.417   2.440
 1006   2HH2  ARG  59          1HH1      ARG  59  17.168  16.308   1.908
 1007    H    GLU  60           H        GLU  60  20.494  11.148  -3.176
 1008    HA   GLU  60           HA       GLU  60  21.176  13.234  -5.056
 1009   1HB   GLU  60          2HB       GLU  60  22.677  10.789  -4.092
 1010   2HB   GLU  60          1HB       GLU  60  23.377  11.977  -5.163
 1011   1HG   GLU  60          1HG       GLU  60  22.171  13.386  -3.007
 1012   2HG   GLU  60          2HG       GLU  60  23.124  12.095  -2.317
 1013    H    TYR  61           H        TYR  61  19.813  10.132  -5.382
 1014    HA   TYR  61           HA       TYR  61  20.728   9.762  -8.168
 1015   1HB   TYR  61          2HB       TYR  61  19.529   8.096  -6.043
 1016   2HB   TYR  61          1HB       TYR  61  18.922   7.761  -7.642
 1017    HD1  TYR  61           HD1      TYR  61  22.005   8.023  -5.582
 1018    HD2  TYR  61           HD2      TYR  61  20.292   6.657  -9.298
 1019    HE1  TYR  61           HE1      TYR  61  24.089   6.760  -6.072
 1020    HE2  TYR  61           HE2      TYR  61  22.381   5.394  -9.792
 1021    HH   TYR  61           HH       TYR  61  24.970   5.725  -8.991
 1022    H    ILE  62           H        ILE  62  17.949  10.679  -6.247
 1023    HA   ILE  62           HA       ILE  62  15.945  10.487  -8.281
 1024    HB   ILE  62           HB       ILE  62  16.180  12.288  -5.850
 1025   1HG1  ILE  62          1HG1      ILE  62  14.509   9.801  -6.312
 1026   2HG1  ILE  62          2HG1      ILE  62  16.079   9.789  -5.508
 1027   1HG2  ILE  62          1HG2      ILE  62  14.310  12.341  -8.047
 1028   2HG2  ILE  62          2HG2      ILE  62  13.479  11.879  -6.562
 1029   3HG2  ILE  62          3HG2      ILE  62  14.384  13.390  -6.631
 1030   1HD1  ILE  62          3HD1      ILE  62  14.812  11.802  -4.158
 1031   2HD1  ILE  62          1HD1      ILE  62  13.460  10.727  -4.513
 1032   3HD1  ILE  62          2HD1      ILE  62  14.854  10.123  -3.617
 1033    H    ASN  63           H        ASN  63  18.405  12.889  -7.567
 1034    HA   ASN  63           HA       ASN  63  17.241  14.801  -9.496
 1035   1HB   ASN  63          2HB       ASN  63  19.690  14.885  -7.724
 1036   2HB   ASN  63          1HB       ASN  63  19.312  16.143  -8.876
 1037   1HD2  ASN  63          2HD2      ASN  63  17.526  15.503  -5.370
 1038   2HD2  ASN  63          1HD2      ASN  63  19.020  16.269  -5.618
 1039    H    SER  64           H        SER  64  19.907  12.509  -9.235
 1040    HA   SER  64           HA       SER  64  21.368  13.337 -11.545
 1041   1HB   SER  64          2HB       SER  64  21.707  11.403  -9.634
 1042   2HB   SER  64          1HB       SER  64  21.269  10.429 -11.038
 1043    HG   SER  64           HG       SER  64  23.554  10.923 -10.807
 1044    H    LEU  65           H        LEU  65  18.433  11.462 -11.165
 1045    HA   LEU  65           HA       LEU  65  18.467  10.512 -13.943
 1046   1HB   LEU  65          1HB       LEU  65  16.259  10.460 -11.862
 1047   2HB   LEU  65          2HB       LEU  65  16.232   9.611 -13.407
 1048    HG   LEU  65           HG       LEU  65  18.593   9.157 -11.641
 1049   1HD1  LEU  65          3HD1      LEU  65  16.110   8.997 -10.479
 1050   2HD1  LEU  65          1HD1      LEU  65  16.315   7.360 -11.107
 1051   3HD1  LEU  65          2HD1      LEU  65  17.504   8.031  -9.991
 1052   1HD2  LEU  65          3HD2      LEU  65  17.262   7.952 -13.919
 1053   2HD2  LEU  65          1HD2      LEU  65  18.874   7.633 -13.278
 1054   3HD2  LEU  65          2HD2      LEU  65  17.479   6.770 -12.629
 1055    H    GLU  66           H        GLU  66  16.548  12.852 -12.037
 1056    HA   GLU  66           HA       GLU  66  15.286  13.868 -14.496
 1057   1HB   GLU  66          1HB       GLU  66  14.134  13.672 -12.210
 1058   2HB   GLU  66          2HB       GLU  66  15.089  15.075 -11.731
 1059   1HG   GLU  66          1HG       GLU  66  14.001  16.494 -13.228
 1060   2HG   GLU  66          2HG       GLU  66  13.530  15.171 -14.294
 1061    H    MET  67           H        MET  67  15.936  15.695 -15.577
 1062    HA   MET  67           HA       MET  67  17.225  17.577 -16.124
 1063   1HB   MET  67          1HB       MET  67  16.398  18.035 -13.576
 1064   2HB   MET  67          2HB       MET  67  18.146  18.018 -13.340
 1065   1HG   MET  67          1HG       MET  67  17.502  20.290 -13.852
 1066   2HG   MET  67          2HG       MET  67  18.334  19.643 -15.265
 1067   1HE   MET  67          1HE       MET  67  15.720  21.570 -13.971
 1068   2HE   MET  67          3HE       MET  67  16.376  22.250 -15.460
 1069   3HE   MET  67          2HE       MET  67  14.658  21.867 -15.348
 1070    H    SER  68           H        SER  68  18.694  15.896 -17.071
 1071    HA   SER  68           HA       SER  68  21.392  16.195 -15.926
 1072   1HB   SER  68          1HB       SER  68  21.863  13.850 -15.759
 1073   2HB   SER  68          2HB       SER  68  20.348  14.112 -14.894
 1074    HG   SER  68           HG       SER  68  20.282  12.323 -16.354
   
  No H/Q in entry =        1074
  Start of MODEL    8
    1    H    SER   1           H        SER   1  13.288 -16.119   3.759
    2    HA   SER   1           HA       SER   1  10.549 -16.076   2.598
    3   1HB   SER   1          1HB       SER   1  11.797 -14.022   4.346
    4   2HB   SER   1          2HB       SER   1  10.962 -13.419   2.914
    5    HG   SER   1           HG       SER   1   9.649 -13.719   4.854
    6    HA   PRO   2           HA       PRO   2  12.555 -15.186  -1.189
    7   1HB   PRO   2          1HB       PRO   2  10.844 -12.999  -1.972
    8   2HB   PRO   2          2HB       PRO   2  10.775 -14.679  -2.516
    9   1HG   PRO   2          1HG       PRO   2   8.955 -13.320  -0.734
   10   2HG   PRO   2          2HG       PRO   2   8.885 -15.000  -1.278
   11   1HD   PRO   2          1HD       PRO   2   9.606 -14.014   1.335
   12   2HD   PRO   2          2HD       PRO   2   9.535 -15.701   0.789
   13    H    TYR   3           H        TYR   3  13.868 -13.521  -2.276
   14    HA   TYR   3           HA       TYR   3  14.655 -11.349  -0.390
   15   1HB   TYR   3          1HB       TYR   3  16.120 -12.709  -2.665
   16   2HB   TYR   3          2HB       TYR   3  16.733 -11.266  -1.856
   17    HD1  TYR   3           HD2      TYR   3  16.291 -11.541   0.917
   18    HD2  TYR   3           HD1      TYR   3  17.174 -14.662  -1.932
   19    HE1  TYR   3           HE2      TYR   3  17.200 -12.960   2.753
   20    HE2  TYR   3           HE1      TYR   3  18.083 -16.081  -0.095
   21    HH   TYR   3           HH       TYR   3  17.586 -16.119   2.622
   22    H    SER   4           H        SER   4  12.368 -10.706  -1.675
   23    HA   SER   4           HA       SER   4  12.761  -9.463  -4.254
   24   1HB   SER   4          1HB       SER   4  10.561 -10.131  -2.812
   25   2HB   SER   4          2HB       SER   4  10.637  -8.402  -2.473
   26    HG   SER   4           HG       SER   4   9.560  -9.361  -4.524
   27    H    SER   5           H        SER   5  12.129  -6.959  -4.344
   28    HA   SER   5           HA       SER   5  13.061  -5.281  -2.190
   29   1HB   SER   5          1HB       SER   5  15.019  -4.474  -3.889
   30   2HB   SER   5          2HB       SER   5  15.287  -5.629  -2.584
   31    HG   SER   5           HG       SER   5  15.401  -6.003  -5.249
   32    H    ASP   6           H        ASP   6  10.778  -5.317  -3.823
   33    HA   ASP   6           HA       ASP   6  11.059  -2.684  -5.181
   34   1HB   ASP   6          1HB       ASP   6   9.799  -3.463  -7.113
   35   2HB   ASP   6          2HB       ASP   6  11.191  -4.494  -6.904
   36    H    THR   7           H        THR   7   8.307  -2.776  -6.127
   37    HA   THR   7           HA       THR   7   7.062  -2.186  -3.536
   38    HB   THR   7           HB       THR   7   5.172  -1.332  -5.009
   39    HG1  THR   7           HG1      THR   7   5.380  -2.276  -6.909
   40   1HG2  THR   7          3HG2      THR   7   7.999  -0.291  -5.228
   41   2HG2  THR   7          1HG2      THR   7   6.637   0.575  -5.938
   42   3HG2  THR   7          2HG2      THR   7   6.693   0.298  -4.198
   43    H    THR   8           H        THR   8   4.440  -2.745  -3.869
   44    HA   THR   8           HA       THR   8   4.017  -5.434  -4.929
   45    HB   THR   8           HB       THR   8   3.984  -4.990  -1.925
   46    HG1  THR   8           HG1      THR   8   5.606  -6.634  -3.570
   47   1HG2  THR   8          1HG2      THR   8   2.250  -6.564  -3.142
   48   2HG2  THR   8          2HG2      THR   8   3.639  -7.639  -3.297
   49   3HG2  THR   8          3HG2      THR   8   3.091  -7.133  -1.700
   50    HA   PRO   9           HA       PRO   9   0.025  -3.610  -5.307
   51   1HB   PRO   9          1HB       PRO   9  -1.224  -6.229  -5.239
   52   2HB   PRO   9          2HB       PRO   9  -0.977  -5.170  -6.633
   53   1HG   PRO   9          2HG       PRO   9   0.443  -7.597  -6.009
   54   2HG   PRO   9          1HG       PRO   9   0.725  -6.510  -7.370
   55   1HD   PRO   9          2HD       PRO   9   2.363  -6.897  -5.056
   56   2HD   PRO   9          1HD       PRO   9   2.640  -5.808  -6.406
   57    H    CYS  10           H        CYS  10   0.030  -2.762  -3.113
   58    HA   CYS  10           HA       CYS  10  -1.350  -4.523  -1.133
   59   1HB   CYS  10          2HB       CYS  10   0.880  -3.797  -0.388
   60   2HB   CYS  10          1HB       CYS  10   0.433  -2.115  -0.658
   61    H    CYS  11           H        CYS  11  -3.189  -3.797  -0.179
   62    HA   CYS  11           HA       CYS  11  -4.287  -1.297  -1.333
   63   1HB   CYS  11          2HB       CYS  11  -6.143  -2.460  -1.762
   64   2HB   CYS  11          1HB       CYS  11  -5.356  -3.908  -1.168
   65    H    PHE  12           H        PHE  12  -4.425   0.429   0.048
   66    HA   PHE  12           HA       PHE  12  -4.037  -0.085   2.942
   67   1HB   PHE  12          2HB       PHE  12  -3.572   2.291   3.129
   68   2HB   PHE  12          1HB       PHE  12  -2.652   1.643   1.773
   69    HD1  PHE  12           HD1      PHE  12  -5.643   3.632   2.733
   70    HD2  PHE  12           HD2      PHE  12  -3.118   2.311  -0.510
   71    HE1  PHE  12           HE1      PHE  12  -6.738   5.275   1.212
   72    HE2  PHE  12           HE2      PHE  12  -4.215   3.953  -2.033
   73    HZ   PHE  12           HZ       PHE  12  -6.025   5.434  -1.172
   74    H    ALA  13           H        ALA  13  -6.383   1.398   0.725
   75    HA   ALA  13           HA       ALA  13  -8.312   1.480   3.009
   76   1HB   ALA  13          3HB       ALA  13  -8.001   3.304   0.620
   77   2HB   ALA  13          1HB       ALA  13  -9.480   3.259   1.580
   78   3HB   ALA  13          2HB       ALA  13  -7.957   3.740   2.329
   79    H    TYR  14           H        TYR  14 -10.095   0.262   2.799
   80    HA   TYR  14           HA       TYR  14 -10.606  -0.869   0.106
   81   1HB   TYR  14          2HB       TYR  14 -11.887  -2.662   1.548
   82   2HB   TYR  14          1HB       TYR  14 -10.138  -2.765   1.351
   83    HD1  TYR  14           HD1      TYR  14  -8.619  -1.868   3.138
   84    HD2  TYR  14           HD2      TYR  14 -12.886  -2.206   3.685
   85    HE1  TYR  14           HE1      TYR  14  -8.326  -1.563   5.584
   86    HE2  TYR  14           HE2      TYR  14 -12.593  -1.915   6.139
   87    HH   TYR  14           HH       TYR  14  -9.815  -0.736   7.540
   88    H    ILE  15           H        ILE  15 -12.741  -0.853  -0.681
   89    HA   ILE  15           HA       ILE  15 -14.497   1.139   0.570
   90    HB   ILE  15           HB       ILE  15 -14.247   1.078  -1.882
   91   1HG1  ILE  15          2HG1      ILE  15 -17.004   0.189  -1.849
   92   2HG1  ILE  15          1HG1      ILE  15 -16.659   1.174  -0.427
   93   1HG2  ILE  15          3HG2      ILE  15 -14.275  -1.663  -1.555
   94   2HG2  ILE  15          1HG2      ILE  15 -15.871  -1.349  -2.234
   95   3HG2  ILE  15          2HG2      ILE  15 -14.427  -0.829  -3.101
   96   1HD1  ILE  15          1HD1      ILE  15 -15.974   1.972  -3.273
   97   2HD1  ILE  15          2HD1      ILE  15 -17.401   2.529  -2.398
   98   3HD1  ILE  15          3HD1      ILE  15 -15.790   2.969  -1.829
   99    H    ALA  16           H        ALA  16 -16.144   0.639   1.935
  100    HA   ALA  16           HA       ALA  16 -16.715  -2.184   2.521
  101   1HB   ALA  16          2HB       ALA  16 -16.553  -0.390   4.300
  102   2HB   ALA  16          3HB       ALA  16 -18.054   0.284   3.666
  103   3HB   ALA  16          1HB       ALA  16 -18.040  -1.338   4.358
  104    H    ARG  17           H        ARG  17 -17.726  -2.830   0.526
  105    HA   ARG  17           HA       ARG  17 -20.526  -2.711   0.442
  106   1HB   ARG  17          1HB       ARG  17 -19.354  -0.294  -0.492
  107   2HB   ARG  17          2HB       ARG  17 -19.993  -1.142  -1.900
  108   1HG   ARG  17          1HG       ARG  17 -21.925  -1.419   0.159
  109   2HG   ARG  17          2HG       ARG  17 -21.434   0.273   0.155
  110   1HD   ARG  17          1HD       ARG  17 -21.844   0.375  -2.285
  111   2HD   ARG  17          2HD       ARG  17 -22.360  -1.311  -2.263
  112    HE   ARG  17           HE       ARG  17 -24.197  -0.506  -0.660
  113   1HH1  ARG  17          2HH1      ARG  17 -24.865   1.809  -0.061
  114   2HH1  ARG  17          1HH1      ARG  17 -25.070   2.867  -1.416
  115   1HH2  ARG  17          1HH2      ARG  17 -23.275   1.430  -3.562
  116   2HH2  ARG  17          2HH2      ARG  17 -25.002   1.332  -3.633
  117    HA   PRO  18           HA       PRO  18 -18.966  -6.050  -2.151
  118   1HB   PRO  18          1HB       PRO  18 -21.704  -6.679  -2.805
  119   2HB   PRO  18          2HB       PRO  18 -20.594  -7.595  -1.802
  120   1HG   PRO  18          1HG       PRO  18 -22.822  -5.999  -0.940
  121   2HG   PRO  18          2HG       PRO  18 -21.709  -6.895   0.065
  122   1HD   PRO  18          2HD       PRO  18 -21.908  -4.054  -0.231
  123   2HD   PRO  18          1HD       PRO  18 -20.719  -4.955   0.730
  124    H    LEU  19           H        LEU  19 -18.138  -5.281  -4.029
  125    HA   LEU  19           HA       LEU  19 -19.467  -3.418  -5.759
  126   1HB   LEU  19          1HB       LEU  19 -17.262  -5.336  -6.560
  127   2HB   LEU  19          2HB       LEU  19 -17.636  -3.773  -7.282
  128    HG   LEU  19           HG       LEU  19 -16.594  -4.246  -4.472
  129   1HD1  LEU  19          2HD1      LEU  19 -15.011  -4.437  -6.478
  130   2HD1  LEU  19          3HD1      LEU  19 -15.310  -2.719  -6.741
  131   3HD1  LEU  19          1HD1      LEU  19 -14.564  -3.264  -5.239
  132   1HD2  LEU  19          3HD2      LEU  19 -17.975  -1.983  -5.722
  133   2HD2  LEU  19          1HD2      LEU  19 -17.632  -2.286  -4.019
  134   3HD2  LEU  19          2HD2      LEU  19 -16.405  -1.546  -5.048
  135    HA   PRO  20           HA       PRO  20 -22.169  -5.964  -8.098
  136   1HB   PRO  20          1HB       PRO  20 -21.456  -4.802 -10.646
  137   2HB   PRO  20          2HB       PRO  20 -22.889  -4.474  -9.666
  138   1HG   PRO  20          1HG       PRO  20 -20.612  -2.757 -10.084
  139   2HG   PRO  20          2HG       PRO  20 -22.035  -2.438  -9.085
  140   1HD   PRO  20          1HD       PRO  20 -19.354  -3.050  -8.207
  141   2HD   PRO  20          2HD       PRO  20 -20.779  -2.720  -7.205
  142    H    ARG  21           H        ARG  21 -21.487  -8.065  -8.344
  143    HA   ARG  21           HA       ARG  21 -18.987  -8.996  -9.159
  144   1HB   ARG  21          2HB       ARG  21 -21.173 -10.247  -8.324
  145   2HB   ARG  21          1HB       ARG  21 -21.402 -10.525 -10.033
  146   1HG   ARG  21          1HG       ARG  21 -18.686 -11.037  -8.915
  147   2HG   ARG  21          2HG       ARG  21 -19.958 -12.196  -8.528
  148   1HD   ARG  21          1HD       ARG  21 -19.378 -11.274 -11.353
  149   2HD   ARG  21          2HD       ARG  21 -18.633 -12.704 -10.641
  150    HE   ARG  21           HE       ARG  21 -21.217 -13.292 -10.219
  151   1HH1  ARG  21          1HH1      ARG  21 -22.636 -11.659 -12.097
  152   2HH1  ARG  21          2HH1      ARG  21 -22.819 -12.954 -13.231
  153   1HH2  ARG  21          2HH2      ARG  21 -19.392 -13.296 -13.131
  154   2HH2  ARG  21          1HH2      ARG  21 -20.738 -14.246 -13.665
  155    H    ALA  22           H        ALA  22 -21.678  -7.955 -11.189
  156    HA   ALA  22           HA       ALA  22 -20.596  -8.982 -13.656
  157   1HB   ALA  22          2HB       ALA  22 -22.712  -6.995 -12.911
  158   2HB   ALA  22          3HB       ALA  22 -22.134  -7.032 -14.577
  159   3HB   ALA  22          1HB       ALA  22 -22.853  -8.474 -13.861
  160    H    HIS  23           H        HIS  23 -20.371  -5.816 -12.035
  161    HA   HIS  23           HA       HIS  23 -18.869  -4.575 -14.156
  162   1HB   HIS  23          2HB       HIS  23 -18.925  -3.901 -11.199
  163   2HB   HIS  23          1HB       HIS  23 -18.313  -2.857 -12.479
  164    HD2  HIS  23           HD2      HIS  23 -21.595  -4.700 -13.408
  165    HE1  HIS  23           HE1      HIS  23 -22.628  -0.730 -12.384
  166    HE2  HIS  23           HE2      HIS  23 -23.485  -2.902 -13.395
  167    H    ILE  24           H        ILE  24 -17.984  -6.680 -11.495
  168    HA   ILE  24           HA       ILE  24 -15.152  -6.001 -11.669
  169    HB   ILE  24           HB       ILE  24 -16.319  -8.463 -10.399
  170   1HG1  ILE  24          2HG1      ILE  24 -15.917  -5.725  -9.164
  171   2HG1  ILE  24          1HG1      ILE  24 -17.481  -6.444  -9.546
  172   1HG2  ILE  24          1HG2      ILE  24 -13.704  -7.060 -10.406
  173   2HG2  ILE  24          2HG2      ILE  24 -14.238  -7.714  -8.860
  174   3HG2  ILE  24          3HG2      ILE  24 -14.057  -8.781 -10.251
  175   1HD1  ILE  24          1HD1      ILE  24 -15.889  -8.312  -8.018
  176   2HD1  ILE  24          2HD1      ILE  24 -15.983  -6.770  -7.168
  177   3HD1  ILE  24          3HD1      ILE  24 -17.462  -7.618  -7.620
  178    H    LYS  25           H        LYS  25 -13.523  -7.698 -12.216
  179    HA   LYS  25           HA       LYS  25 -14.501  -9.538 -14.360
  180   1HB   LYS  25          1HB       LYS  25 -12.491  -7.406 -14.448
  181   2HB   LYS  25          2HB       LYS  25 -11.885  -8.936 -15.026
  182   1HG   LYS  25          1HG       LYS  25 -14.515  -8.595 -16.080
  183   2HG   LYS  25          2HG       LYS  25 -13.605  -7.114 -16.385
  184   1HD   LYS  25          1HD       LYS  25 -12.746  -8.236 -18.164
  185   2HD   LYS  25          2HD       LYS  25 -11.751  -9.069 -16.969
  186   1HE   LYS  25          1HE       LYS  25 -14.350 -10.293 -17.035
  187   2HE   LYS  25          2HE       LYS  25 -13.720 -10.199 -18.680
  188   1HZ   LYS  25          1HZ       LYS  25 -11.625 -11.165 -17.822
  189   2HZ   LYS  25          2HZ       LYS  25 -12.378 -11.392 -16.317
  190   3HZ   LYS  25          3HZ       LYS  25 -12.955 -12.211 -17.687
  191    H    GLU  26           H        GLU  26 -12.436  -9.023 -11.601
  192    HA   GLU  26           HA       GLU  26 -11.990 -11.854 -11.264
  193   1HB   GLU  26          1HB       GLU  26  -9.330 -11.084 -11.211
  194   2HB   GLU  26          2HB       GLU  26 -10.081 -11.991 -12.504
  195   1HG   GLU  26          1HG       GLU  26 -10.420  -9.060 -12.707
  196   2HG   GLU  26          2HG       GLU  26  -8.759  -9.616 -12.809
  197    H    TYR  27           H        TYR  27  -9.716 -11.568  -9.521
  198    HA   TYR  27           HA       TYR  27 -10.032  -9.357  -7.719
  199   1HB   TYR  27          1HB       TYR  27 -11.011 -10.670  -5.832
  200   2HB   TYR  27          2HB       TYR  27 -12.139 -10.532  -7.160
  201    HD1  TYR  27           HD1      TYR  27 -12.239 -12.459  -8.886
  202    HD2  TYR  27           HD2      TYR  27 -10.305 -12.799  -5.040
  203    HE1  TYR  27           HE1      TYR  27 -12.274 -14.944  -9.087
  204    HE2  TYR  27           HE2      TYR  27 -10.346 -15.284  -5.241
  205    HH   TYR  27           HH       TYR  27 -10.444 -16.950  -7.482
  206    H    PHE  28           H        PHE  28  -8.431  -9.520  -6.033
  207    HA   PHE  28           HA       PHE  28  -6.809 -11.963  -6.060
  208   1HB   PHE  28          1HB       PHE  28  -5.654 -10.842  -7.784
  209   2HB   PHE  28          2HB       PHE  28  -5.886  -9.278  -7.051
  210    HD1  PHE  28           HD1      PHE  28  -4.618  -8.676  -4.944
  211    HD2  PHE  28           HD2      PHE  28  -3.722 -12.189  -7.288
  212    HE1  PHE  28           HE1      PHE  28  -2.398  -8.839  -3.839
  213    HE2  PHE  28           HE2      PHE  28  -1.493 -12.358  -6.181
  214    HZ   PHE  28           HZ       PHE  28  -0.829 -10.684  -4.454
  215    H    TYR  29           H        TYR  29  -6.304 -12.417  -3.957
  216    HA   TYR  29           HA       TYR  29  -6.832 -10.413  -1.916
  217   1HB   TYR  29          1HB       TYR  29  -7.259 -12.863  -1.593
  218   2HB   TYR  29          2HB       TYR  29  -5.542 -13.156  -1.658
  219    HD1  TYR  29           HD2      TYR  29  -4.066 -11.746   0.033
  220    HD2  TYR  29           HD1      TYR  29  -8.291 -12.499   0.473
  221    HE1  TYR  29           HE2      TYR  29  -3.893 -11.292   2.481
  222    HE2  TYR  29           HE1      TYR  29  -8.119 -12.055   2.918
  223    HH   TYR  29           HH       TYR  29  -5.104 -11.810   4.541
  224    H    THR  30           H        THR  30  -5.387  -9.226  -0.796
  225    HA   THR  30           HA       THR  30  -2.772  -8.783  -1.936
  226    HB   THR  30           HB       THR  30  -3.892  -7.853   0.726
  227    HG1  THR  30           HG1      THR  30  -3.888  -6.675  -1.853
  228   1HG2  THR  30          3HG2      THR  30  -1.425  -7.253  -0.851
  229   2HG2  THR  30          1HG2      THR  30  -2.207  -5.916  -0.008
  230   3HG2  THR  30          2HG2      THR  30  -1.648  -7.323   0.897
  231    H    SER  31           H        SER  31  -0.980  -9.982  -1.564
  232    HA   SER  31           HA       SER  31  -0.814 -12.184   0.178
  233   1HB   SER  31          1HB       SER  31   0.836 -11.113  -1.706
  234   2HB   SER  31          2HB       SER  31   1.714 -10.697  -0.234
  235    HG   SER  31           HG       SER  31   2.357 -12.727  -0.837
  236    H    GLY  32           H        GLY  32   1.107 -12.158   1.962
  237   1HA   GLY  32          1HA       GLY  32   0.201 -10.162   3.962
  238   2HA   GLY  32          2HA       GLY  32   1.082 -11.646   4.321
  239    H    LYS  33           H        LYS  33   1.725  -8.889   2.122
  240    HA   LYS  33           HA       LYS  33   4.523  -8.864   3.110
  241   1HB   LYS  33          2HB       LYS  33   3.141  -7.515   0.779
  242   2HB   LYS  33          1HB       LYS  33   4.811  -7.175   1.228
  243   1HG   LYS  33          2HG       LYS  33   5.285  -9.642   1.039
  244   2HG   LYS  33          1HG       LYS  33   3.655  -9.851   0.399
  245   1HD   LYS  33          2HD       LYS  33   4.162  -8.831  -1.602
  246   2HD   LYS  33          1HD       LYS  33   5.352  -7.754  -0.870
  247   1HE   LYS  33          1HE       LYS  33   6.308  -9.569  -2.379
  248   2HE   LYS  33          2HE       LYS  33   6.990  -9.504  -0.755
  249   1HZ   LYS  33          2HZ       LYS  33   4.776 -11.300  -1.582
  250   2HZ   LYS  33          3HZ       LYS  33   6.404 -11.768  -1.465
  251   3HZ   LYS  33          1HZ       LYS  33   5.558 -11.284  -0.075
  252    H    CYS  34           H        CYS  34   2.025  -6.405   2.374
  253    HA   CYS  34           HA       CYS  34   3.289  -4.544   4.273
  254   1HB   CYS  34          2HB       CYS  34   1.451  -3.004   3.562
  255   2HB   CYS  34          1HB       CYS  34   2.389  -3.620   2.203
  256    H    SER  35           H        SER  35   1.760  -3.424   5.889
  257    HA   SER  35           HA       SER  35   0.391  -5.543   7.423
  258   1HB   SER  35          1HB       SER  35   0.452  -2.693   8.331
  259   2HB   SER  35          2HB       SER  35   0.633  -4.172   9.273
  260    HG   SER  35           HG       SER  35   2.515  -2.863   7.637
  261    H    ASN  36           H        ASN  36  -1.096  -5.261   5.239
  262    HA   ASN  36           HA       ASN  36  -3.544  -3.965   6.253
  263   1HB   ASN  36          1HB       ASN  36  -1.998  -2.468   4.597
  264   2HB   ASN  36          2HB       ASN  36  -2.963  -3.326   3.420
  265   1HD2  ASN  36          2HD2      ASN  36  -4.683  -0.485   5.771
  266   2HD2  ASN  36          1HD2      ASN  36  -3.181  -1.132   6.224
  267    HA   PRO  37           HA       PRO  37  -3.886  -8.070   3.979
  268   1HB   PRO  37          1HB       PRO  37  -5.654  -8.893   6.115
  269   2HB   PRO  37          2HB       PRO  37  -4.079  -9.571   5.682
  270   1HG   PRO  37          2HG       PRO  37  -4.723  -7.937   7.968
  271   2HG   PRO  37          1HG       PRO  37  -3.145  -8.594   7.520
  272   1HD   PRO  37          1HD       PRO  37  -4.027  -5.851   7.367
  273   2HD   PRO  37          2HD       PRO  37  -2.444  -6.512   6.917
  274    H    ALA  38           H        ALA  38  -5.703  -8.549   2.691
  275    HA   ALA  38           HA       ALA  38  -8.388  -7.768   3.298
  276   1HB   ALA  38          3HB       ALA  38  -7.315  -5.492   2.987
  277   2HB   ALA  38          1HB       ALA  38  -6.996  -5.944   1.312
  278   3HB   ALA  38          2HB       ALA  38  -8.657  -5.819   1.893
  279    H    VAL  39           H        VAL  39  -9.076  -7.121   0.516
  280    HA   VAL  39           HA       VAL  39  -8.092  -9.415  -1.016
  281    HB   VAL  39           HB       VAL  39 -10.337  -9.818   0.469
  282   1HG1  VAL  39          1HG1      VAL  39 -11.332  -8.799  -2.205
  283   2HG1  VAL  39          2HG1      VAL  39 -12.315  -9.631  -1.000
  284   3HG1  VAL  39          3HG1      VAL  39 -11.631  -8.047  -0.638
  285   1HG2  VAL  39          3HG2      VAL  39  -9.193 -10.941  -1.974
  286   2HG2  VAL  39          1HG2      VAL  39  -9.766 -11.751  -0.516
  287   3HG2  VAL  39          2HG2      VAL  39 -10.911 -11.292  -1.776
  288    H    VAL  40           H        VAL  40  -8.598  -9.027  -3.343
  289    HA   VAL  40           HA       VAL  40  -9.555  -6.243  -3.651
  290    HB   VAL  40           HB       VAL  40  -7.769  -5.441  -4.539
  291   1HG1  VAL  40          1HG2      VAL  40  -6.811  -7.578  -2.921
  292   2HG1  VAL  40          2HG2      VAL  40  -5.661  -7.142  -4.177
  293   3HG1  VAL  40          3HG2      VAL  40  -6.256  -5.916  -3.059
  294   1HG2  VAL  40          2HG1      VAL  40  -7.695  -7.789  -6.245
  295   2HG2  VAL  40          3HG1      VAL  40  -7.697  -6.080  -6.652
  296   3HG2  VAL  40          1HG1      VAL  40  -6.216  -6.846  -6.087
  297    H    PHE  41           H        PHE  41  -9.896  -5.661  -5.979
  298    HA   PHE  41           HA       PHE  41 -11.109  -7.897  -7.468
  299   1HB   PHE  41          2HB       PHE  41 -12.447  -5.379  -6.508
  300   2HB   PHE  41          1HB       PHE  41 -13.068  -6.266  -7.878
  301    HD1  PHE  41           HD2      PHE  41 -13.435  -8.861  -7.521
  302    HD2  PHE  41           HD1      PHE  41 -13.071  -5.988  -4.318
  303    HE1  PHE  41           HE2      PHE  41 -14.517 -10.467  -5.955
  304    HE2  PHE  41           HE1      PHE  41 -14.136  -7.607  -2.751
  305    HZ   PHE  41           HZ       PHE  41 -14.874  -9.840  -3.570
  306    H    VAL  42           H        VAL  42 -10.607  -7.833  -9.511
  307    HA   VAL  42           HA       VAL  42  -9.398  -5.305 -10.520
  308    HB   VAL  42           HB       VAL  42  -8.936  -7.326 -12.401
  309   1HG1  VAL  42          2HG2      VAL  42  -7.385  -5.945 -10.243
  310   2HG1  VAL  42          3HG2      VAL  42  -6.593  -7.187 -11.212
  311   3HG1  VAL  42          1HG2      VAL  42  -7.252  -5.750 -11.993
  312   1HG2  VAL  42          3HG1      VAL  42  -9.588  -9.012 -10.696
  313   2HG2  VAL  42          1HG1      VAL  42  -7.890  -9.136 -11.139
  314   3HG2  VAL  42          2HG1      VAL  42  -8.355  -8.370  -9.620
  315    H    THR  43           H        THR  43 -11.659  -4.530 -10.777
  316    HA   THR  43           HA       THR  43 -13.558  -5.834 -12.514
  317    HB   THR  43           HB       THR  43 -14.942  -3.939 -12.168
  318    HG1  THR  43           HG1      THR  43 -12.605  -2.515 -11.432
  319   1HG2  THR  43          3HG2      THR  43 -13.669  -5.164 -10.029
  320   2HG2  THR  43          1HG2      THR  43 -13.483  -3.447  -9.678
  321   3HG2  THR  43          2HG2      THR  43 -15.091  -4.129  -9.921
  322    H    ARG  44           H        ARG  44 -14.526  -3.769 -14.104
  323    HA   ARG  44           HA       ARG  44 -13.231  -4.187 -16.514
  324   1HB   ARG  44          2HB       ARG  44 -14.229  -1.874 -17.184
  325   2HB   ARG  44          1HB       ARG  44 -15.330  -3.171 -16.730
  326   1HG   ARG  44          1HG       ARG  44 -14.618  -1.843 -14.322
  327   2HG   ARG  44          2HG       ARG  44 -14.988  -0.589 -15.502
  328   1HD   ARG  44          1HD       ARG  44 -16.773  -2.985 -15.004
  329   2HD   ARG  44          2HD       ARG  44 -16.986  -1.432 -14.196
  330    HE   ARG  44           HE       ARG  44 -17.171  -1.769 -17.165
  331   1HH1  ARG  44          1HH1      ARG  44 -16.912   1.028 -16.216
  332   2HH1  ARG  44          2HH1      ARG  44 -18.565   1.514 -16.035
  333   1HH2  ARG  44          1HH2      ARG  44 -19.785  -1.730 -15.942
  334   2HH2  ARG  44          2HH2      ARG  44 -20.198  -0.048 -15.942
  335    H    LYS  45           H        LYS  45 -12.844  -1.153 -14.608
  336    HA   LYS  45           HA       LYS  45 -10.555  -0.236 -16.067
  337   1HB   LYS  45          1HB       LYS  45 -11.369   0.203 -13.180
  338   2HB   LYS  45          2HB       LYS  45 -10.027   1.027 -13.935
  339   1HG   LYS  45          1HG       LYS  45 -11.628   1.847 -15.706
  340   2HG   LYS  45          2HG       LYS  45 -12.940   1.172 -14.740
  341   1HD   LYS  45          1HD       LYS  45 -12.126   2.571 -12.805
  342   2HD   LYS  45          2HD       LYS  45 -10.996   3.347 -13.916
  343   1HE   LYS  45          1HE       LYS  45 -12.640   4.552 -14.944
  344   2HE   LYS  45          2HE       LYS  45 -13.802   3.228 -14.852
  345   1HZ   LYS  45          1HZ       LYS  45 -14.030   3.698 -12.464
  346   2HZ   LYS  45          2HZ       LYS  45 -13.006   5.042 -12.641
  347   3HZ   LYS  45          3HZ       LYS  45 -14.508   5.009 -13.433
  348    H    ASN  46           H        ASN  46 -11.075  -2.531 -13.520
  349    HA   ASN  46           HA       ASN  46  -9.794  -4.235 -12.676
  350   1HB   ASN  46          2HB       ASN  46  -8.810  -3.793 -15.305
  351   2HB   ASN  46          1HB       ASN  46  -7.405  -3.970 -14.285
  352   1HD2  ASN  46          1HD2      ASN  46  -7.769  -7.456 -14.202
  353   2HD2  ASN  46          2HD2      ASN  46  -6.789  -6.110 -13.869
  354    H    ARG  47           H        ARG  47  -9.129  -1.128 -12.215
  355    HA   ARG  47           HA       ARG  47  -6.445  -1.169 -11.160
  356   1HB   ARG  47          1HB       ARG  47  -8.881   0.333 -10.123
  357   2HB   ARG  47          2HB       ARG  47  -7.211   0.664  -9.665
  358   1HG   ARG  47          1HG       ARG  47  -6.668   1.531 -11.767
  359   2HG   ARG  47          2HG       ARG  47  -7.982   0.669 -12.570
  360   1HD   ARG  47          1HD       ARG  47  -9.442   2.355 -12.197
  361   2HD   ARG  47          2HD       ARG  47  -8.950   2.505 -10.511
  362    HE   ARG  47           HE       ARG  47  -7.083   3.623 -12.505
  363   1HH1  ARG  47          1HH1      ARG  47  -6.575   5.884 -10.641
  364   2HH1  ARG  47          2HH1      ARG  47  -7.537   5.124  -9.418
  365   1HH2  ARG  47          2HH2      ARG  47  -9.635   5.245 -12.549
  366   2HH2  ARG  47          1HH2      ARG  47  -9.616   6.126 -11.057
  367    H    GLN  48           H        GLN  48  -5.797  -1.996  -9.037
  368    HA   GLN  48           HA       GLN  48  -7.497  -4.161  -8.243
  369   1HB   GLN  48          1HB       GLN  48  -4.829  -3.190  -7.438
  370   2HB   GLN  48          2HB       GLN  48  -5.695  -4.148  -6.256
  371   1HG   GLN  48          1HG       GLN  48  -6.063  -5.916  -7.900
  372   2HG   GLN  48          2HG       GLN  48  -5.335  -4.934  -9.164
  373   1HE2  GLN  48          1HE2      GLN  48  -2.310  -5.045  -8.673
  374   2HE2  GLN  48          2HE2      GLN  48  -2.663  -4.275  -7.202
  375    H    VAL  49           H        VAL  49  -9.352  -3.311  -7.668
  376    HA   VAL  49           HA       VAL  49  -9.666  -1.258  -5.639
  377    HB   VAL  49           HB       VAL  49 -12.011  -2.841  -6.375
  378   1HG1  VAL  49          2HG1      VAL  49 -11.273   0.085  -6.501
  379   2HG1  VAL  49          3HG1      VAL  49 -12.894  -0.552  -6.794
  380   3HG1  VAL  49          1HG1      VAL  49 -12.156  -0.717  -5.201
  381   1HG2  VAL  49          2HG2      VAL  49 -10.327  -1.502  -8.492
  382   2HG2  VAL  49          3HG2      VAL  49 -11.118  -3.069  -8.576
  383   3HG2  VAL  49          1HG2      VAL  49 -12.074  -1.593  -8.672
  384    H    CYS  50           H        CYS  50  -9.148  -1.976  -3.593
  385    HA   CYS  50           HA       CYS  50  -9.328  -4.604  -2.665
  386   1HB   CYS  50          2HB       CYS  50  -8.521  -2.184  -1.597
  387   2HB   CYS  50          1HB       CYS  50  -9.912  -2.583  -0.618
  388    H    ALA  51           H        ALA  51 -10.832  -4.692  -0.422
  389    HA   ALA  51           HA       ALA  51 -13.445  -3.661  -0.586
  390   1HB   ALA  51          3HB       ALA  51 -12.910  -5.993  -2.294
  391   2HB   ALA  51          1HB       ALA  51 -14.296  -6.198  -1.225
  392   3HB   ALA  51          2HB       ALA  51 -14.245  -4.843  -2.351
  393    H    ASN  52           H        ASN  52 -11.344  -4.535   1.345
  394    HA   ASN  52           HA       ASN  52 -11.361  -5.349   3.532
  395   1HB   ASN  52          1HB       ASN  52 -13.682  -4.323   3.464
  396   2HB   ASN  52          2HB       ASN  52 -14.289  -5.928   3.055
  397   1HD2  ASN  52          2HD2      ASN  52 -12.515  -5.273   6.704
  398   2HD2  ASN  52          1HD2      ASN  52 -13.097  -3.969   5.787
  399    HA   PRO  53           HA       PRO  53 -10.902  -9.685   2.668
  400   1HB   PRO  53          1HB       PRO  53  -9.957 -10.377   5.205
  401   2HB   PRO  53          2HB       PRO  53  -8.960  -9.762   3.877
  402   1HG   PRO  53          2HG       PRO  53  -9.786  -8.401   6.359
  403   2HG   PRO  53          1HG       PRO  53  -8.527  -7.948   5.227
  404   1HD   PRO  53          1HD       PRO  53 -11.128  -6.776   5.488
  405   2HD   PRO  53          2HD       PRO  53  -9.896  -6.374   4.300
  406    H    GLU  54           H        GLU  54 -12.097  -8.932   5.977
  407    HA   GLU  54           HA       GLU  54 -13.846 -11.329   5.838
  408   1HB   GLU  54          1HB       GLU  54 -12.505  -9.817   7.970
  409   2HB   GLU  54          2HB       GLU  54 -14.167 -10.259   8.361
  410   1HG   GLU  54          1HG       GLU  54 -13.737 -12.548   8.202
  411   2HG   GLU  54          2HG       GLU  54 -12.338 -12.313   7.154
  412    H    LYS  55           H        LYS  55 -14.758  -9.225   4.223
  413    HA   LYS  55           HA       LYS  55 -16.873  -7.856   5.782
  414   1HB   LYS  55          1HB       LYS  55 -15.517  -7.377   3.257
  415   2HB   LYS  55          2HB       LYS  55 -17.250  -7.276   3.079
  416   1HG   LYS  55          1HG       LYS  55 -15.934  -5.919   5.409
  417   2HG   LYS  55          2HG       LYS  55 -15.908  -5.144   3.825
  418   1HD   LYS  55          1HD       LYS  55 -18.118  -4.636   3.912
  419   2HD   LYS  55          2HD       LYS  55 -18.544  -6.214   4.572
  420   1HE   LYS  55          1HE       LYS  55 -18.175  -5.539   6.780
  421   2HE   LYS  55          2HE       LYS  55 -17.105  -4.221   6.302
  422   1HZ   LYS  55          3HZ       LYS  55 -19.818  -4.055   5.294
  423   2HZ   LYS  55          1HZ       LYS  55 -19.662  -3.888   6.978
  424   3HZ   LYS  55          2HZ       LYS  55 -18.820  -2.841   5.939
  425    H    LYS  56           H        LYS  56 -16.706 -10.864   5.010
  426    HA   LYS  56           HA       LYS  56 -18.280 -12.527   4.559
  427   1HB   LYS  56          1HB       LYS  56 -19.905 -10.150   5.188
  428   2HB   LYS  56          2HB       LYS  56 -20.728 -11.355   4.196
  429   1HG   LYS  56          1HG       LYS  56 -19.715 -13.053   5.934
  430   2HG   LYS  56          2HG       LYS  56 -19.599 -11.628   6.966
  431   1HD   LYS  56          1HD       LYS  56 -22.111 -11.277   6.123
  432   2HD   LYS  56          2HD       LYS  56 -22.024 -13.027   5.927
  433   1HE   LYS  56          1HE       LYS  56 -20.925 -11.978   8.470
  434   2HE   LYS  56          2HE       LYS  56 -22.669 -11.809   8.273
  435   1HZ   LYS  56          1HZ       LYS  56 -22.609 -14.232   7.566
  436   2HZ   LYS  56          2HZ       LYS  56 -21.046 -14.279   8.227
  437   3HZ   LYS  56          3HZ       LYS  56 -22.375 -13.904   9.216
  438    H    TRP  57           H        TRP  57 -20.047 -10.069   2.729
  439    HA   TRP  57           HA       TRP  57 -20.442 -11.528   0.416
  440   1HB   TRP  57          1HB       TRP  57 -20.836  -9.447  -0.735
  441   2HB   TRP  57          2HB       TRP  57 -21.422  -9.281   0.922
  442    HD1  TRP  57           HD1      TRP  57 -20.424  -7.299   2.255
  443    HE1  TRP  57           HE1      TRP  57 -18.613  -5.534   1.731
  444    HE3  TRP  57           HE3      TRP  57 -18.550  -9.308  -1.990
  445    HZ2  TRP  57           HZ2      TRP  57 -16.661  -5.006  -0.344
  446    HZ3  TRP  57           HZ3      TRP  57 -16.816  -8.159  -3.292
  447    HH2  TRP  57           HH2      TRP  57 -15.877  -6.000  -2.492
  448    H    VAL  58           H        VAL  58 -17.483  -9.760   1.234
  449    HA   VAL  58           HA       VAL  58 -16.242  -9.890  -1.316
  450    HB   VAL  58           HB       VAL  58 -14.069 -10.219   0.192
  451   1HG1  VAL  58          3HG1      VAL  58 -15.095  -8.201  -1.117
  452   2HG1  VAL  58          1HG1      VAL  58 -15.511  -7.623   0.497
  453   3HG1  VAL  58          2HG1      VAL  58 -13.826  -7.929   0.074
  454   1HG2  VAL  58          2HG2      VAL  58 -15.609 -10.697   2.186
  455   2HG2  VAL  58          3HG2      VAL  58 -14.282  -9.564   2.418
  456   3HG2  VAL  58          1HG2      VAL  58 -15.923  -8.964   2.182
  457    H    ARG  59           H        ARG  59 -16.143 -12.286   1.327
  458    HA   ARG  59           HA       ARG  59 -14.526 -14.175  -0.084
  459   1HB   ARG  59          1HB       ARG  59 -16.585 -14.623   2.093
  460   2HB   ARG  59          2HB       ARG  59 -15.430 -15.819   1.557
  461   1HG   ARG  59          2HG       ARG  59 -13.635 -14.713   2.511
  462   2HG   ARG  59          1HG       ARG  59 -14.386 -13.144   2.357
  463   1HD   ARG  59          1HD       ARG  59 -15.041 -13.281   4.505
  464   2HD   ARG  59          2HD       ARG  59 -16.053 -14.661   4.072
  465    HE   ARG  59           HE       ARG  59 -13.438 -15.660   4.374
  466   1HH1  ARG  59          1HH2      ARG  59 -15.801 -16.632   6.081
  467   2HH1  ARG  59          2HH2      ARG  59 -15.772 -15.581   7.458
  468   1HH2  ARG  59          1HH1      ARG  59 -12.719 -14.188   6.619
  469   2HH2  ARG  59          2HH1      ARG  59 -13.383 -15.158   7.890
  470    H    GLU  60           H        GLU  60 -17.955 -13.450  -0.140
  471    HA   GLU  60           HA       GLU  60 -18.817 -15.864  -1.451
  472   1HB   GLU  60          1HB       GLU  60 -19.939 -13.131  -1.039
  473   2HB   GLU  60          2HB       GLU  60 -20.634 -14.095  -2.320
  474   1HG   GLU  60          1HG       GLU  60 -20.291 -15.058   0.531
  475   2HG   GLU  60          2HG       GLU  60 -21.793 -14.401  -0.119
  476    H    TYR  61           H        TYR  61 -17.276 -12.930  -2.532
  477    HA   TYR  61           HA       TYR  61 -17.775 -13.513  -5.378
  478   1HB   TYR  61          1HB       TYR  61 -16.335 -11.331  -3.874
  479   2HB   TYR  61          2HB       TYR  61 -16.139 -11.510  -5.617
  480    HD1  TYR  61           HD2      TYR  61 -19.049 -11.818  -3.233
  481    HD2  TYR  61           HD1      TYR  61 -17.464 -10.005  -6.818
  482    HE1  TYR  61           HE2      TYR  61 -21.217 -10.647  -3.598
  483    HE2  TYR  61           HE1      TYR  61 -19.632  -8.828  -7.178
  484    HH   TYR  61           HH       TYR  61 -21.856  -8.830  -6.553
  485    H    ILE  62           H        ILE  62 -15.173 -13.811  -3.000
  486    HA   ILE  62           HA       ILE  62 -13.002 -14.283  -4.716
  487    HB   ILE  62           HB       ILE  62 -13.060 -14.109  -2.144
  488   1HG1  ILE  62          1HG1      ILE  62 -11.356 -16.298  -3.349
  489   2HG1  ILE  62          2HG1      ILE  62 -11.072 -14.575  -3.592
  490   1HG2  ILE  62          3HG2      ILE  62 -14.490 -16.507  -2.388
  491   2HG2  ILE  62          1HG2      ILE  62 -12.892 -16.994  -1.828
  492   3HG2  ILE  62          2HG2      ILE  62 -13.832 -15.823  -0.904
  493   1HD1  ILE  62          2HD1      ILE  62 -11.448 -15.075  -0.786
  494   2HD1  ILE  62          3HD1      ILE  62 -10.219 -16.178  -1.407
  495   3HD1  ILE  62          1HD1      ILE  62 -10.023 -14.437  -1.606
  496    H    ASN  63           H        ASN  63 -15.770 -16.271  -4.062
  497    HA   ASN  63           HA       ASN  63 -14.513 -18.493  -5.620
  498   1HB   ASN  63          1HB       ASN  63 -16.635 -18.489  -3.477
  499   2HB   ASN  63          2HB       ASN  63 -16.447 -19.842  -4.566
  500   1HD2  ASN  63          1HD2      ASN  63 -13.865 -21.232  -3.740
  501   2HD2  ASN  63          2HD2      ASN  63 -15.099 -21.376  -2.583
  502    H    SER  64           H        SER  64 -17.109 -16.187  -5.474
  503    HA   SER  64           HA       SER  64 -18.657 -17.551  -7.580
  504   1HB   SER  64          1HB       SER  64 -19.043 -14.874  -6.218
  505   2HB   SER  64          2HB       SER  64 -20.153 -15.568  -7.374
  506    HG   SER  64           HG       SER  64 -20.784 -17.016  -5.956
  507    H    LEU  65           H        LEU  65 -15.820 -16.132  -7.815
  508    HA   LEU  65           HA       LEU  65 -16.537 -14.462 -10.186
  509   1HB   LEU  65          1HB       LEU  65 -14.514 -14.214  -8.074
  510   2HB   LEU  65          2HB       LEU  65 -13.863 -14.006  -9.682
  511    HG   LEU  65           HG       LEU  65 -16.426 -12.622  -9.046
  512   1HD1  LEU  65          3HD1      LEU  65 -14.676 -12.320  -7.129
  513   2HD1  LEU  65          1HD1      LEU  65 -13.804 -11.342  -8.309
  514   3HD1  LEU  65          2HD1      LEU  65 -15.434 -10.884  -7.817
  515   1HD2  LEU  65          2HD2      LEU  65 -15.034 -12.673 -11.271
  516   2HD2  LEU  65          3HD2      LEU  65 -15.726 -11.147 -10.719
  517   3HD2  LEU  65          1HD2      LEU  65 -14.019 -11.491 -10.445
  518    H    GLU  66           H        GLU  66 -14.375 -17.022  -9.009
  519    HA   GLU  66           HA       GLU  66 -13.364 -17.487 -11.746
  520   1HB   GLU  66          1HB       GLU  66 -11.870 -17.639  -9.718
  521   2HB   GLU  66          2HB       GLU  66 -12.789 -19.060  -9.219
  522   1HG   GLU  66          1HG       GLU  66 -12.260 -19.834 -11.712
  523   2HG   GLU  66          2HG       GLU  66 -10.900 -18.728 -11.516
  524    H    MET  67           H        MET  67 -15.140 -18.326 -12.887
  525    HA   MET  67           HA       MET  67 -16.567 -20.030 -13.642
  526   1HB   MET  67          1HB       MET  67 -14.405 -21.354 -12.629
  527   2HB   MET  67          2HB       MET  67 -15.694 -22.001 -11.615
  528   1HG   MET  67          1HG       MET  67 -16.966 -22.665 -13.586
  529   2HG   MET  67          2HG       MET  67 -15.781 -21.904 -14.646
  530   1HE   MET  67          3HE       MET  67 -16.070 -23.998 -15.821
  531   2HE   MET  67          2HE       MET  67 -15.086 -25.440 -15.573
  532   3HE   MET  67          1HE       MET  67 -16.638 -25.279 -14.749
  533    H    SER  68           H        SER  68 -18.693 -20.451 -13.134
  534    HA   SER  68           HA       SER  68 -19.531 -20.902 -10.366
  535   1HB   SER  68          1HB       SER  68 -20.018 -18.290 -11.779
  536   2HB   SER  68          2HB       SER  68 -21.198 -18.898 -10.618
  537    HG   SER  68           HG       SER  68 -19.433 -19.084  -9.122
  538    H    SER   1           H        SER   1  -9.988  13.938   2.429
  539    HA   SER   1           HA       SER   1  -7.332  13.720   1.104
  540   1HB   SER   1          1HB       SER   1  -8.451  11.937   3.200
  541   2HB   SER   1          2HB       SER   1  -7.711  11.136   1.814
  542    HG   SER   1           HG       SER   1  -6.272  11.696   3.600
  543    HA   PRO   2           HA       PRO   2  -9.585  12.321  -2.379
  544   1HB   PRO   2          1HB       PRO   2  -7.921  10.038  -2.963
  545   2HB   PRO   2          2HB       PRO   2  -7.895  11.625  -3.739
  546   1HG   PRO   2          1HG       PRO   2  -5.953  10.519  -1.911
  547   2HG   PRO   2          2HG       PRO   2  -5.927  12.106  -2.688
  548   1HD   PRO   2          1HD       PRO   2  -6.467  11.499   0.080
  549   2HD   PRO   2          2HD       PRO   2  -6.441  13.091  -0.700
  550    H    TYR   3           H        TYR   3 -10.959  10.527  -3.133
  551    HA   TYR   3           HA       TYR   3 -11.609   8.643  -0.914
  552   1HB   TYR   3          1HB       TYR   3 -13.229   9.680  -3.252
  553   2HB   TYR   3          2HB       TYR   3 -13.780   8.367  -2.211
  554    HD1  TYR   3           HD2      TYR   3 -13.154   9.022   0.461
  555    HD2  TYR   3           HD1      TYR   3 -14.241  11.722  -2.729
  556    HE1  TYR   3           HE2      TYR   3 -13.944  10.688   2.140
  557    HE2  TYR   3           HE1      TYR   3 -15.030  13.388  -1.050
  558    HH   TYR   3           HH       TYR   3 -14.352  13.801   1.596
  559    H    SER   4           H        SER   4  -9.410   7.818  -2.248
  560    HA   SER   4           HA       SER   4  -9.970   6.229  -4.595
  561   1HB   SER   4          1HB       SER   4  -7.681   7.080  -3.412
  562   2HB   SER   4          2HB       SER   4  -7.727   5.416  -2.831
  563    HG   SER   4           HG       SER   4  -6.795   6.074  -5.064
  564    H    SER   5           H        SER   5  -9.336   3.733  -4.378
  565    HA   SER   5           HA       SER   5 -10.114   2.379  -1.952
  566   1HB   SER   5          1HB       SER   5 -12.177   1.350  -3.388
  567   2HB   SER   5          2HB       SER   5 -12.364   2.678  -2.242
  568    HG   SER   5           HG       SER   5 -12.655   2.676  -4.919
  569    H    ASP   6           H        ASP   6  -7.944   2.174  -3.721
  570    HA   ASP   6           HA       ASP   6  -8.306  -0.622  -4.670
  571   1HB   ASP   6          2HB       ASP   6  -7.185  -0.134  -6.776
  572   2HB   ASP   6          1HB       ASP   6  -8.563   0.925  -6.621
  573    H    THR   7           H        THR   7  -5.627  -0.682  -5.808
  574    HA   THR   7           HA       THR   7  -4.203  -0.908  -3.252
  575    HB   THR   7           HB       THR   7  -2.414  -1.967  -4.720
  576    HG1  THR   7           HG1      THR   7  -2.756  -1.296  -6.713
  577   1HG2  THR   7          3HG2      THR   7  -5.243  -3.016  -4.599
  578   2HG2  THR   7          1HG2      THR   7  -3.928  -3.979  -5.273
  579   3HG2  THR   7          2HG2      THR   7  -3.869  -3.462  -3.588
  580    H    THR   8           H        THR   8  -1.613  -0.411  -3.836
  581    HA   THR   8           HA       THR   8  -1.276   2.101  -5.288
  582    HB   THR   8           HB       THR   8  -1.038   2.081  -2.260
  583    HG1  THR   8           HG1      THR   8  -2.774   3.490  -4.003
  584   1HG2  THR   8          1HG2      THR   8   0.603   3.460  -3.799
  585   2HG2  THR   8          2HG2      THR   8  -0.797   4.510  -4.010
  586   3HG2  THR   8          3HG2      THR   8  -0.140   4.229  -2.397
  587    HA   PRO   9           HA       PRO   9   2.690   0.225  -5.674
  588   1HB   PRO   9          1HB       PRO   9   3.929   2.821  -6.060
  589   2HB   PRO   9          2HB       PRO   9   3.590   1.579  -7.271
  590   1HG   PRO   9          2HG       PRO   9   2.207   4.077  -6.894
  591   2HG   PRO   9          1HG       PRO   9   1.839   2.814  -8.070
  592   1HD   PRO   9          1HD       PRO   9   0.359   3.526  -5.728
  593   2HD   PRO   9          2HD       PRO   9  -0.003   2.260  -6.892
  594    H    CYS  10           H        CYS  10   2.841  -0.309  -3.389
  595    HA   CYS  10           HA       CYS  10   4.342   1.705  -1.772
  596   1HB   CYS  10          2HB       CYS  10   2.171   1.100  -0.785
  597   2HB   CYS  10          1HB       CYS  10   2.607  -0.606  -0.848
  598    H    CYS  11           H        CYS  11   6.245   1.109  -0.850
  599    HA   CYS  11           HA       CYS  11   7.272  -1.534  -1.717
  600   1HB   CYS  11          2HB       CYS  11   9.092  -0.459  -2.429
  601   2HB   CYS  11          1HB       CYS  11   8.343   1.065  -1.998
  602    H    PHE  12           H        PHE  12   7.509  -3.050  -0.123
  603    HA   PHE  12           HA       PHE  12   7.318  -2.137   2.691
  604   1HB   PHE  12          2HB       PHE  12   6.875  -4.462   3.238
  605   2HB   PHE  12          1HB       PHE  12   5.865  -4.005   1.869
  606    HD1  PHE  12           HD1      PHE  12   8.922  -5.855   2.897
  607    HD2  PHE  12           HD2      PHE  12   6.181  -4.988  -0.325
  608    HE1  PHE  12           HE1      PHE  12   9.921  -7.700   1.551
  609    HE2  PHE  12           HE2      PHE  12   7.183  -6.833  -1.671
  610    HZ   PHE  12           HZ       PHE  12   9.052  -8.188  -0.733
  611    H    ALA  13           H        ALA  13   9.515  -3.927   0.549
  612    HA   ALA  13           HA       ALA  13  11.595  -3.699   2.687
  613   1HB   ALA  13          3HB       ALA  13  11.131  -5.838   0.602
  614   2HB   ALA  13          1HB       ALA  13  12.671  -5.666   1.444
  615   3HB   ALA  13          2HB       ALA  13  11.204  -6.031   2.353
  616    H    TYR  14           H        TYR  14  13.353  -2.531   2.190
  617    HA   TYR  14           HA       TYR  14  13.678  -1.790  -0.662
  618   1HB   TYR  14          2HB       TYR  14  15.044   0.181   0.426
  619   2HB   TYR  14          1HB       TYR  14  13.285   0.263   0.335
  620    HD1  TYR  14           HD1      TYR  14  11.894  -0.369   2.327
  621    HD2  TYR  14           HD2      TYR  14  16.186   0.023   2.534
  622    HE1  TYR  14           HE1      TYR  14  11.767  -0.327   4.805
  623    HE2  TYR  14           HE2      TYR  14  16.060   0.080   5.018
  624    HH   TYR  14           HH       TYR  14  13.389  -0.881   6.753
  625    H    ILE  15           H        ILE  15  15.753  -1.932  -1.583
  626    HA   ILE  15           HA       ILE  15  17.598  -3.738  -0.189
  627    HB   ILE  15           HB       ILE  15  17.186  -4.011  -2.605
  628   1HG1  ILE  15          2HG1      ILE  15  19.934  -3.140  -2.879
  629   2HG1  ILE  15          1HG1      ILE  15  19.690  -3.915  -1.313
  630   1HG2  ILE  15          3HG2      ILE  15  17.222  -1.252  -2.657
  631   2HG2  ILE  15          1HG2      ILE  15  18.771  -1.664  -3.393
  632   3HG2  ILE  15          2HG2      ILE  15  17.274  -2.290  -4.082
  633   1HD1  ILE  15          1HD1      ILE  15  18.820  -5.100  -3.967
  634   2HD1  ILE  15          2HD1      ILE  15  20.305  -5.536  -3.121
  635   3HD1  ILE  15          3HD1      ILE  15  18.738  -5.883  -2.389
  636    H    ALA  16           H        ALA  16  19.332  -3.066   0.983
  637    HA   ALA  16           HA       ALA  16  19.916  -0.193   1.148
  638   1HB   ALA  16          2HB       ALA  16  19.890  -1.723   3.157
  639   2HB   ALA  16          3HB       ALA  16  21.346  -2.486   2.520
  640   3HB   ALA  16          1HB       ALA  16  21.372  -0.784   2.984
  641    H    ARG  17           H        ARG  17  20.753   0.132  -1.012
  642    HA   ARG  17           HA       ARG  17  23.564   0.041  -1.241
  643   1HB   ARG  17          1HB       ARG  17  22.362  -2.480  -1.770
  644   2HB   ARG  17          2HB       ARG  17  22.902  -1.829  -3.316
  645   1HG   ARG  17          1HG       ARG  17  24.965  -1.271  -1.455
  646   2HG   ARG  17          2HG       ARG  17  24.485  -2.945  -1.178
  647   1HD   ARG  17          1HD       ARG  17  24.727  -3.403  -3.601
  648   2HD   ARG  17          2HD       ARG  17  25.240  -1.734  -3.856
  649    HE   ARG  17           HE       ARG  17  27.180  -2.318  -2.279
  650   1HH1  ARG  17          2HH1      ARG  17  27.902  -4.530  -1.412
  651   2HH1  ARG  17          1HH1      ARG  17  28.019  -5.767  -2.619
  652   1HH2  ARG  17          1HH2      ARG  17  26.075  -4.632  -4.816
  653   2HH2  ARG  17          2HH2      ARG  17  27.794  -4.552  -5.016
  654    HA   PRO  18           HA       PRO  18  21.845   2.989  -4.176
  655   1HB   PRO  18          1HB       PRO  18  24.526   3.511  -5.104
  656   2HB   PRO  18          2HB       PRO  18  23.486   4.561  -4.155
  657   1HG   PRO  18          2HG       PRO  18  25.792   3.107  -3.251
  658   2HG   PRO  18          1HG       PRO  18  24.727   4.113  -2.292
  659   1HD   PRO  18          2HD       PRO  18  24.942   1.248  -2.246
  660   2HD   PRO  18          1HD       PRO  18  23.836   2.266  -1.303
  661    H    LEU  19           H        LEU  19  20.893   1.967  -5.868
  662    HA   LEU  19           HA       LEU  19  22.110  -0.125  -7.406
  663   1HB   LEU  19          1HB       LEU  19  19.847   1.675  -8.316
  664   2HB   LEU  19          2HB       LEU  19  20.179   0.025  -8.838
  665    HG   LEU  19           HG       LEU  19  19.326   0.889  -6.057
  666   1HD1  LEU  19          2HD1      LEU  19  17.612   0.806  -7.960
  667   2HD1  LEU  19          3HD1      LEU  19  17.900  -0.934  -8.000
  668   3HD1  LEU  19          1HD1      LEU  19  17.254  -0.181  -6.542
  669   1HD2  LEU  19          3HD2      LEU  19  20.632  -1.533  -7.071
  670   2HD2  LEU  19          1HD2      LEU  19  20.404  -0.994  -5.407
  671   3HD2  LEU  19          2HD2      LEU  19  19.113  -1.865  -6.237
  672    HA   PRO  20           HA       PRO  20  24.635   2.058 -10.255
  673   1HB   PRO  20          1HB       PRO  20  23.755   0.555 -12.563
  674   2HB   PRO  20          2HB       PRO  20  25.254   0.362 -11.647
  675   1HG   PRO  20          1HG       PRO  20  22.963  -1.388 -11.663
  676   2HG   PRO  20          2HG       PRO  20  24.453  -1.569 -10.730
  677   1HD   PRO  20          1HD       PRO  20  21.833  -0.830  -9.766
  678   2HD   PRO  20          2HD       PRO  20  23.326  -1.022  -8.827
  679    H    ARG  21           H        ARG  21  23.935   4.107 -10.752
  680    HA   ARG  21           HA       ARG  21  21.378   4.927 -11.512
  681   1HB   ARG  21          1HB       ARG  21  23.609   6.274 -11.008
  682   2HB   ARG  21          2HB       ARG  21  23.722   6.309 -12.751
  683   1HG   ARG  21          1HG       ARG  21  21.084   6.985 -11.535
  684   2HG   ARG  21          2HG       ARG  21  22.374   8.180 -11.400
  685   1HD   ARG  21          1HD       ARG  21  21.610   6.876 -14.023
  686   2HD   ARG  21          2HD       ARG  21  20.906   8.394 -13.469
  687    HE   ARG  21           HE       ARG  21  23.512   9.024 -13.308
  688   1HH1  ARG  21          1HH1      ARG  21  24.807   7.137 -15.031
  689   2HH1  ARG  21          2HH1      ARG  21  24.909   8.261 -16.345
  690   1HH2  ARG  21          2HH2      ARG  21  21.495   8.630 -16.062
  691   2HH2  ARG  21          1HH2      ARG  21  22.797   9.490 -16.813
  692    H    ALA  22           H        ALA  22  23.929   3.600 -13.553
  693    HA   ALA  22           HA       ALA  22  22.677   4.279 -16.060
  694   1HB   ALA  22          2HB       ALA  22  24.848   2.404 -15.192
  695   2HB   ALA  22          3HB       ALA  22  24.159   2.212 -16.804
  696   3HB   ALA  22          1HB       ALA  22  24.919   3.736 -16.345
  697    H    HIS  23           H        HIS  23  22.570   1.376 -13.996
  698    HA   HIS  23           HA       HIS  23  20.936  -0.143 -15.819
  699   1HB   HIS  23          2HB       HIS  23  21.197  -0.398 -12.808
  700   2HB   HIS  23          1HB       HIS  23  20.501  -1.606 -13.884
  701    HD2  HIS  23           HD2      HIS  23  23.706   0.070 -15.284
  702    HE1  HIS  23           HE1      HIS  23  24.822  -3.724 -13.790
  703    HE2  HIS  23           HE2      HIS  23  25.600  -1.718 -15.149
  704    H    ILE  24           H        ILE  24  20.227   2.319 -13.425
  705    HA   ILE  24           HA       ILE  24  17.373   1.666 -13.340
  706    HB   ILE  24           HB       ILE  24  18.633   4.253 -12.468
  707   1HG1  ILE  24          2HG1      ILE  24  18.282   1.728 -10.837
  708   2HG1  ILE  24          1HG1      ILE  24  19.832   2.328 -11.431
  709   1HG2  ILE  24          1HG2      ILE  24  16.028   2.873 -12.111
  710   2HG2  ILE  24          2HG2      ILE  24  16.662   3.746 -10.718
  711   3HG2  ILE  24          3HG2      ILE  24  16.379   4.597 -12.236
  712   1HD1  ILE  24          1HD1      ILE  24  18.376   4.440 -10.082
  713   2HD1  ILE  24          2HD1      ILE  24  18.536   3.038  -9.025
  714   3HD1  ILE  24          3HD1      ILE  24  19.975   3.790  -9.715
  715    H    LYS  25           H        LYS  25  15.748   3.248 -13.982
  716    HA   LYS  25           HA       LYS  25  16.554   4.751 -16.429
  717   1HB   LYS  25          2HB       LYS  25  14.680   2.565 -16.042
  718   2HB   LYS  25          1HB       LYS  25  13.901   3.944 -16.732
  719   1HG   LYS  25          1HG       LYS  25  16.457   3.589 -17.997
  720   2HG   LYS  25          2HG       LYS  25  15.554   2.077 -18.059
  721   1HD   LYS  25          1HD       LYS  25  14.486   2.969 -19.844
  722   2HD   LYS  25          2HD       LYS  25  13.631   3.977 -18.677
  723   1HE   LYS  25          1HE       LYS  25  16.204   5.140 -19.148
  724   2HE   LYS  25          2HE       LYS  25  15.459   4.803 -20.710
  725   1HZ   LYS  25          1HZ       LYS  25  13.433   5.915 -19.875
  726   2HZ   LYS  25          2HZ       LYS  25  14.280   6.352 -18.469
  727   3HZ   LYS  25          3HZ       LYS  25  14.773   6.954 -19.978
  728    H    GLU  26           H        GLU  26  14.705   4.662 -13.475
  729    HA   GLU  26           HA       GLU  26  14.231   7.503 -13.541
  730   1HB   GLU  26          1HB       GLU  26  11.593   6.734 -13.193
  731   2HB   GLU  26          2HB       GLU  26  12.240   7.457 -14.649
  732   1HG   GLU  26          1HG       GLU  26  12.605   4.525 -14.456
  733   2HG   GLU  26          2HG       GLU  26  10.934   5.058 -14.529
  734    H    TYR  27           H        TYR  27  12.086   7.490 -11.614
  735    HA   TYR  27           HA       TYR  27  12.555   5.557  -9.561
  736   1HB   TYR  27          2HB       TYR  27  13.674   7.088  -7.945
  737   2HB   TYR  27          1HB       TYR  27  14.683   6.775  -9.333
  738    HD1  TYR  27           HD1      TYR  27  14.661   8.451 -11.282
  739    HD2  TYR  27           HD2      TYR  27  12.983   9.311  -7.397
  740    HE1  TYR  27           HE1      TYR  27  14.662  10.884 -11.820
  741    HE2  TYR  27           HE2      TYR  27  12.991  11.746  -7.935
  742    HH   TYR  27           HH       TYR  27  12.927  13.090 -10.392
  743    H    PHE  28           H        PHE  28  11.049   5.941  -7.770
  744    HA   PHE  28           HA       PHE  28   9.415   8.370  -8.038
  745   1HB   PHE  28          2HB       PHE  28   8.164   7.005  -9.488
  746   2HB   PHE  28          1HB       PHE  28   8.449   5.569  -8.541
  747    HD1  PHE  28           HD1      PHE  28   7.307   5.290  -6.303
  748    HD2  PHE  28           HD2      PHE  28   6.264   8.426  -9.078
  749    HE1  PHE  28           HE1      PHE  28   5.160   5.639  -5.096
  750    HE2  PHE  28           HE2      PHE  28   4.107   8.772  -7.875
  751    HZ   PHE  28           HZ       PHE  28   3.553   7.376  -5.884
  752    H    TYR  29           H        TYR  29   9.162   9.174  -5.984
  753    HA   TYR  29           HA       TYR  29   9.756   7.553  -3.666
  754   1HB   TYR  29          2HB       TYR  29  10.100  10.020  -3.775
  755   2HB   TYR  29          1HB       TYR  29   8.368  10.233  -3.747
  756    HD1  TYR  29           HD2      TYR  29   7.068   9.087  -1.786
  757    HD2  TYR  29           HD1      TYR  29  11.317   9.844  -1.765
  758    HE1  TYR  29           HE2      TYR  29   7.089   8.909   0.702
  759    HE2  TYR  29           HE1      TYR  29  11.339   9.665   0.719
  760    HH   TYR  29           HH       TYR  29   8.470   9.666   2.590
  761    H    THR  30           H        THR  30   8.395   6.461  -2.346
  762    HA   THR  30           HA       THR  30   5.724   5.838  -3.268
  763    HB   THR  30           HB       THR  30   7.016   5.264  -0.585
  764    HG1  THR  30           HG1      THR  30   6.815   3.720  -2.955
  765   1HG2  THR  30          3HG2      THR  30   4.448   4.469  -1.896
  766   2HG2  THR  30          1HG2      THR  30   5.293   3.257  -0.932
  767   3HG2  THR  30          2HG2      THR  30   4.790   4.776  -0.193
  768    H    SER  31           H        SER  31   3.935   7.063  -2.944
  769    HA   SER  31           HA       SER  31   3.852   9.479  -1.509
  770   1HB   SER  31          1HB       SER  31   2.094   8.150  -3.113
  771   2HB   SER  31          2HB       SER  31   1.318   7.950  -1.541
  772    HG   SER  31           HG       SER  31   0.620   9.874  -2.376
  773    H    GLY  32           H        GLY  32   2.065   9.703   0.386
  774   1HA   GLY  32          1HA       GLY  32   3.114   7.998   2.576
  775   2HA   GLY  32          2HA       GLY  32   2.254   9.523   2.785
  776    H    LYS  33           H        LYS  33   1.472   6.492   1.040
  777    HA   LYS  33           HA       LYS  33  -1.252   6.620   2.209
  778   1HB   LYS  33          2HB       LYS  33  -0.025   4.953   0.001
  779   2HB   LYS  33          1HB       LYS  33  -1.661   4.687   0.605
  780   1HG   LYS  33          2HG       LYS  33  -2.156   7.106   0.106
  781   2HG   LYS  33          1HG       LYS  33  -0.574   7.216  -0.665
  782   1HD   LYS  33          2HD       LYS  33  -1.209   5.930  -2.466
  783   2HD   LYS  33          1HD       LYS  33  -2.343   4.971  -1.514
  784   1HE   LYS  33          1HE       LYS  33  -3.407   6.563  -3.193
  785   2HE   LYS  33          2HE       LYS  33  -3.977   6.727  -1.532
  786   1HZ   LYS  33          2HZ       LYS  33  -1.833   8.380  -2.749
  787   2HZ   LYS  33          3HZ       LYS  33  -3.451   8.868  -2.589
  788   3HZ   LYS  33          1HZ       LYS  33  -2.510   8.578  -1.205
  789    H    CYS  34           H        CYS  34   1.202   4.070   1.657
  790    HA   CYS  34           HA       CYS  34   0.077   2.498   3.877
  791   1HB   CYS  34          2HB       CYS  34   1.870   0.866   3.266
  792   2HB   CYS  34          1HB       CYS  34   0.840   1.292   1.899
  793    H    SER  35           H        SER  35   1.717   1.607   5.528
  794    HA   SER  35           HA       SER  35   3.176   3.913   6.655
  795   1HB   SER  35          1HB       SER  35   3.190   1.218   7.953
  796   2HB   SER  35          2HB       SER  35   3.066   2.816   8.689
  797    HG   SER  35           HG       SER  35   1.084   1.299   7.381
  798    H    ASN  36           H        ASN  36   4.515   3.324   4.436
  799    HA   ASN  36           HA       ASN  36   7.030   2.169   5.454
  800   1HB   ASN  36          2HB       ASN  36   5.383   0.463   4.131
  801   2HB   ASN  36          1HB       ASN  36   6.262   1.144   2.784
  802   1HD2  ASN  36          2HD2      ASN  36   8.150  -1.352   5.387
  803   2HD2  ASN  36          1HD2      ASN  36   6.678  -0.639   5.844
  804    HA   PRO  37           HA       PRO  37   7.208   5.911   2.608
  805   1HB   PRO  37          1HB       PRO  37   9.109   7.017   4.488
  806   2HB   PRO  37          2HB       PRO  37   7.508   7.636   4.067
  807   1HG   PRO  37          2HG       PRO  37   8.307   6.335   6.512
  808   2HG   PRO  37          1HG       PRO  37   6.700   6.932   6.083
  809   1HD   PRO  37          1HD       PRO  37   7.581   4.191   6.258
  810   2HD   PRO  37          2HD       PRO  37   5.969   4.790   5.825
  811    H    ALA  38           H        ALA  38   8.938   6.193   1.149
  812    HA   ALA  38           HA       ALA  38  11.660   5.487   1.682
  813   1HB   ALA  38          3HB       ALA  38  10.573   3.198   1.767
  814   2HB   ALA  38          1HB       ALA  38  10.146   3.412   0.069
  815   3HB   ALA  38          2HB       ALA  38  11.841   3.357   0.551
  816    H    VAL  39           H        VAL  39  12.175   4.446  -1.021
  817    HA   VAL  39           HA       VAL  39  11.081   6.549  -2.761
  818    HB   VAL  39           HB       VAL  39  13.441   7.081  -1.543
  819   1HG1  VAL  39          1HG1      VAL  39  14.199   5.700  -4.130
  820   2HG1  VAL  39          2HG1      VAL  39  15.285   6.669  -3.134
  821   3HG1  VAL  39          3HG1      VAL  39  14.626   5.158  -2.508
  822   1HG2  VAL  39          3HG2      VAL  39  12.117   7.878  -4.034
  823   2HG2  VAL  39          1HG2      VAL  39  12.760   8.871  -2.724
  824   3HG2  VAL  39          2HG2      VAL  39  13.838   8.259  -3.981
  825    H    VAL  40           H        VAL  40  11.422   5.907  -5.050
  826    HA   VAL  40           HA       VAL  40  11.948   2.966  -5.158
  827    HB   VAL  40           HB       VAL  40   9.951   4.590  -6.714
  828   1HG1  VAL  40          3HG1      VAL  40  10.657   1.716  -6.765
  829   2HG1  VAL  40          1HG1      VAL  40   9.040   2.274  -7.183
  830   3HG1  VAL  40          2HG1      VAL  40  10.430   2.845  -8.098
  831   1HG2  VAL  40          1HG2      VAL  40   9.525   4.279  -4.233
  832   2HG2  VAL  40          2HG2      VAL  40   8.260   3.688  -5.309
  833   3HG2  VAL  40          3HG2      VAL  40   9.391   2.554  -4.572
  834    H    PHE  41           H        PHE  41  12.451   2.162  -7.327
  835    HA   PHE  41           HA       PHE  41  13.671   4.115  -9.152
  836   1HB   PHE  41          1HB       PHE  41  15.051   1.750  -7.906
  837   2HB   PHE  41          2HB       PHE  41  15.592   2.426  -9.424
  838    HD1  PHE  41           HD2      PHE  41  15.951   5.041  -9.477
  839    HD2  PHE  41           HD1      PHE  41  15.817   2.664  -5.877
  840    HE1  PHE  41           HE2      PHE  41  17.122   6.854  -8.236
  841    HE2  PHE  41           HE1      PHE  41  16.958   4.491  -4.632
  842    HZ   PHE  41           HZ       PHE  41  17.638   6.578  -5.813
  843    H    VAL  42           H        VAL  42  12.998   3.777 -11.116
  844    HA   VAL  42           HA       VAL  42  11.751   1.133 -11.688
  845    HB   VAL  42           HB       VAL  42  11.148   2.864 -13.796
  846   1HG1  VAL  42          2HG2      VAL  42   9.758   1.812 -11.364
  847   2HG1  VAL  42          3HG2      VAL  42   8.895   2.913 -12.439
  848   3HG1  VAL  42          1HG2      VAL  42   9.504   1.376 -13.057
  849   1HG2  VAL  42          3HG1      VAL  42  11.908   4.776 -12.405
  850   2HG2  VAL  42          1HG1      VAL  42  10.184   4.843 -12.746
  851   3HG2  VAL  42          2HG1      VAL  42  10.752   4.305 -11.165
  852    H    THR  43           H        THR  43  13.984   0.315 -11.987
  853    HA   THR  43           HA       THR  43  15.752   1.360 -14.012
  854    HB   THR  43           HB       THR  43  17.165  -0.477 -13.508
  855    HG1  THR  43           HG1      THR  43  14.888  -1.771 -12.425
  856   1HG2  THR  43          3HG2      THR  43  16.040   1.040 -11.476
  857   2HG2  THR  43          1HG2      THR  43  15.885  -0.611 -10.877
  858   3HG2  THR  43          2HG2      THR  43  17.470   0.021 -11.323
  859    H    ARG  44           H        ARG  44  16.617  -0.904 -15.366
  860    HA   ARG  44           HA       ARG  44  15.152  -0.798 -17.711
  861   1HB   ARG  44          2HB       ARG  44  16.120  -3.187 -18.142
  862   2HB   ARG  44          1HB       ARG  44  17.243  -1.846 -17.936
  863   1HG   ARG  44          1HG       ARG  44  16.703  -2.843 -15.332
  864   2HG   ARG  44          2HG       ARG  44  16.991  -4.244 -16.358
  865   1HD   ARG  44          1HD       ARG  44  18.807  -1.821 -16.314
  866   2HD   ARG  44          2HD       ARG  44  19.072  -3.246 -15.309
  867    HE   ARG  44           HE       ARG  44  19.057  -3.339 -18.301
  868   1HH1  ARG  44          1HH1      ARG  44  18.876  -5.970 -16.948
  869   2HH1  ARG  44          2HH1      ARG  44  20.539  -6.433 -16.812
  870   1HH2  ARG  44          1HH2      ARG  44  21.747  -3.214 -17.254
  871   2HH2  ARG  44          2HH2      ARG  44  22.167  -4.882 -17.047
  872    H    LYS  45           H        LYS  45  14.921  -3.559 -15.395
  873    HA   LYS  45           HA       LYS  45  12.544  -4.661 -16.553
  874   1HB   LYS  45          2HB       LYS  45  13.557  -4.699 -13.695
  875   2HB   LYS  45          1HB       LYS  45  12.168  -5.611 -14.233
  876   1HG   LYS  45          1HG       LYS  45  13.643  -6.683 -15.977
  877   2HG   LYS  45          2HG       LYS  45  15.017  -5.889 -15.209
  878   1HD   LYS  45          1HD       LYS  45  14.340  -6.997 -13.044
  879   2HD   LYS  45          2HD       LYS  45  13.141  -7.914 -13.958
  880   1HE   LYS  45          1HE       LYS  45  14.716  -9.260 -14.914
  881   2HE   LYS  45          2HE       LYS  45  15.878  -7.944 -15.087
  882   1HZ   LYS  45          1HZ       LYS  45  16.266  -8.077 -12.676
  883   2HZ   LYS  45          2HZ       LYS  45  15.238  -9.426 -12.596
  884   3HZ   LYS  45          3HZ       LYS  45  16.683  -9.512 -13.484
  885    H    ASN  46           H        ASN  46  13.223  -2.038 -14.391
  886    HA   ASN  46           HA       ASN  46  11.993  -0.229 -13.700
  887   1HB   ASN  46          1HB       ASN  46  10.841  -1.021 -16.176
  888   2HB   ASN  46          2HB       ASN  46   9.504  -0.703 -15.100
  889   1HD2  ASN  46          1HD2      ASN  46   9.850   2.760 -15.512
  890   2HD2  ASN  46          2HD2      ASN  46   8.905   1.473 -14.934
  891    H    ARG  47           H        ARG  47  11.378  -3.243 -12.779
  892    HA   ARG  47           HA       ARG  47   8.768  -3.052 -11.568
  893   1HB   ARG  47          1HB       ARG  47  11.278  -4.402 -10.497
  894   2HB   ARG  47          2HB       ARG  47   9.644  -4.657  -9.883
  895   1HG   ARG  47          1HG       ARG  47   8.962  -5.807 -11.799
  896   2HG   ARG  47          2HG       ARG  47  10.214  -5.075 -12.804
  897   1HD   ARG  47          1HD       ARG  47  11.703  -6.699 -12.296
  898   2HD   ARG  47          2HD       ARG  47  11.327  -6.607 -10.575
  899    HE   ARG  47           HE       ARG  47   9.333  -7.984 -12.261
  900   1HH1  ARG  47          1HH1      ARG  47   8.962  -9.956 -10.067
  901   2HH1  ARG  47          2HH1      ARG  47  10.001  -9.037  -9.030
  902   1HH2  ARG  47          2HH2      ARG  47  11.886  -9.608 -12.246
  903   2HH2  ARG  47          1HH2      ARG  47  11.970 -10.270 -10.648
  904    H    GLN  48           H        GLN  48   8.258  -1.950  -9.538
  905    HA   GLN  48           HA       GLN  48   9.983   0.306  -9.167
  906   1HB   GLN  48          2HB       GLN  48   7.378  -0.555  -8.078
  907   2HB   GLN  48          1HB       GLN  48   8.298   0.555  -7.087
  908   1HG   GLN  48          1HG       GLN  48   8.568   2.076  -9.005
  909   2HG   GLN  48          2HG       GLN  48   7.738   0.932 -10.049
  910   1HE2  GLN  48          1HE2      GLN  48   4.770   1.163  -9.360
  911   2HE2  GLN  48          2HE2      GLN  48   5.223   0.602  -7.824
  912    H    VAL  49           H        VAL  49  11.884  -0.475  -8.612
  913    HA   VAL  49           HA       VAL  49  12.340  -2.218  -6.334
  914    HB   VAL  49           HB       VAL  49  14.630  -0.763  -7.421
  915   1HG1  VAL  49          2HG1      VAL  49  13.882  -3.675  -7.094
  916   2HG1  VAL  49          3HG1      VAL  49  15.482  -3.109  -7.581
  917   3HG1  VAL  49          1HG1      VAL  49  14.855  -2.711  -5.980
  918   1HG2  VAL  49          2HG2      VAL  49  12.820  -2.358  -9.236
  919   2HG2  VAL  49          3HG2      VAL  49  13.618  -0.830  -9.579
  920   3HG2  VAL  49          1HG2      VAL  49  14.554  -2.319  -9.527
  921    H    CYS  50           H        CYS  50  12.077  -1.294  -4.341
  922    HA   CYS  50           HA       CYS  50  12.212   1.484  -3.844
  923   1HB   CYS  50          1HB       CYS  50  11.492  -0.741  -2.375
  924   2HB   CYS  50          2HB       CYS  50  12.942  -0.210  -1.558
  925    H    ALA  51           H        ALA  51  13.855   1.900  -1.728
  926    HA   ALA  51           HA       ALA  51  16.468   0.871  -1.928
  927   1HB   ALA  51          3HB       ALA  51  15.771   2.928  -3.910
  928   2HB   ALA  51          1HB       ALA  51  17.228   3.296  -2.985
  929   3HB   ALA  51          2HB       ALA  51  17.121   1.791  -3.897
  930    H    ASN  52           H        ASN  52  14.486   2.007   0.001
  931    HA   ASN  52           HA       ASN  52  14.642   3.120   2.045
  932   1HB   ASN  52          1HB       ASN  52  16.959   2.087   1.967
  933   2HB   ASN  52          2HB       ASN  52  17.528   3.617   1.298
  934   1HD2  ASN  52          2HD2      ASN  52  16.005   3.483   5.112
  935   2HD2  ASN  52          1HD2      ASN  52  16.530   2.061   4.348
  936    HA   PRO  53           HA       PRO  53  14.103   7.297   0.622
  937   1HB   PRO  53          1HB       PRO  53  13.330   8.339   3.097
  938   2HB   PRO  53          2HB       PRO  53  12.247   7.549   1.939
  939   1HG   PRO  53          1HG       PRO  53  13.246   6.544   4.524
  940   2HG   PRO  53          2HG       PRO  53  11.917   5.943   3.555
  941   1HD   PRO  53          2HD       PRO  53  14.536   4.807   3.796
  942   2HD   PRO  53          1HD       PRO  53  13.228   4.249   2.763
  943    H    GLU  54           H        GLU  54  15.523   7.007   3.914
  944    HA   GLU  54           HA       GLU  54  17.249   9.353   3.326
  945   1HB   GLU  54          1HB       GLU  54  16.062   8.159   5.733
  946   2HB   GLU  54          2HB       GLU  54  17.744   8.644   5.946
  947   1HG   GLU  54          1HG       GLU  54  17.292  10.890   5.498
  948   2HG   GLU  54          2HG       GLU  54  15.827  10.517   4.589
  949    H    LYS  55           H        LYS  55  18.059   7.040   1.961
  950    HA   LYS  55           HA       LYS  55  20.281   5.892   3.550
  951   1HB   LYS  55          2HB       LYS  55  18.760   5.072   1.212
  952   2HB   LYS  55          1HB       LYS  55  20.478   4.938   0.935
  953   1HG   LYS  55          1HG       LYS  55  19.326   3.925   3.514
  954   2HG   LYS  55          2HG       LYS  55  19.198   2.938   2.058
  955   1HD   LYS  55          1HD       LYS  55  21.410   2.435   2.069
  956   2HD   LYS  55          2HD       LYS  55  21.872   4.089   2.470
  957   1HE   LYS  55          1HE       LYS  55  21.656   3.729   4.771
  958   2HE   LYS  55          2HE       LYS  55  20.562   2.362   4.554
  959   1HZ   LYS  55          3HZ       LYS  55  23.202   2.045   3.400
  960   2HZ   LYS  55          1HZ       LYS  55  23.160   2.114   5.097
  961   3HZ   LYS  55          2HZ       LYS  55  22.255   0.937   4.272
  962    H    LYS  56           H        LYS  56  20.048   8.763   2.379
  963    HA   LYS  56           HA       LYS  56  21.580  10.339   1.596
  964   1HB   LYS  56          1HB       LYS  56  23.254   8.066   2.437
  965   2HB   LYS  56          2HB       LYS  56  24.003   9.116   1.235
  966   1HG   LYS  56          1HG       LYS  56  23.102  11.044   2.785
  967   2HG   LYS  56          2HG       LYS  56  23.062   9.777   4.011
  968   1HD   LYS  56          1HD       LYS  56  25.512   9.300   3.057
  969   2HD   LYS  56          2HD       LYS  56  25.405  11.007   2.625
  970   1HE   LYS  56          1HE       LYS  56  24.483  10.326   5.358
  971   2HE   LYS  56          2HE       LYS  56  26.212  10.124   5.071
  972   1HZ   LYS  56          1HZ       LYS  56  26.092  12.425   4.038
  973   2HZ   LYS  56          2HZ       LYS  56  24.577  12.571   4.790
  974   3HZ   LYS  56          3HZ       LYS  56  25.971  12.332   5.729
  975    H    TRP  57           H        TRP  57  23.229   7.641   0.009
  976    HA   TRP  57           HA       TRP  57  23.459   8.767  -2.505
  977   1HB   TRP  57          1HB       TRP  57  23.783   6.544  -3.383
  978   2HB   TRP  57          2HB       TRP  57  24.485   6.609  -1.764
  979    HD1  TRP  57           HD1      TRP  57  23.592   4.835  -0.100
  980    HE1  TRP  57           HE1      TRP  57  21.759   3.022  -0.245
  981    HE3  TRP  57           HE3      TRP  57  21.419   6.238  -4.444
  982    HZ2  TRP  57           HZ2      TRP  57  19.672   2.216  -2.087
  983    HZ3  TRP  57           HZ3      TRP  57  19.606   4.926  -5.450
  984    HH2  TRP  57           HH2      TRP  57  18.737   2.904  -4.294
  985    H    VAL  58           H        VAL  58  20.572   7.142  -1.251
  986    HA   VAL  58           HA       VAL  58  19.161   6.922  -3.704
  987    HB   VAL  58           HB       VAL  58  17.093   7.466  -2.113
  988   1HG1  VAL  58          3HG1      VAL  58  18.041   5.283  -3.195
  989   2HG1  VAL  58          1HG1      VAL  58  18.564   4.932  -1.548
  990   3HG1  VAL  58          2HG1      VAL  58  16.853   5.185  -1.900
  991   1HG2  VAL  58          2HG2      VAL  58  18.765   8.210  -0.314
  992   2HG2  VAL  58          3HG2      VAL  58  17.459   7.128   0.162
  993   3HG2  VAL  58          1HG2      VAL  58  19.082   6.491  -0.099
  994    H    ARG  59           H        ARG  59  19.232   9.662  -1.421
  995    HA   ARG  59           HA       ARG  59  17.515  11.346  -2.968
  996   1HB   ARG  59          2HB       ARG  59  19.714  12.081  -1.017
  997   2HB   ARG  59          1HB       ARG  59  18.520  13.195  -1.636
  998   1HG   ARG  59          1HG       ARG  59  16.798  12.243  -0.419
  999   2HG   ARG  59          2HG       ARG  59  17.544  10.663  -0.404
 1000   1HD   ARG  59          1HD       ARG  59  18.341  11.094   1.656
 1001   2HD   ARG  59          2HD       ARG  59  19.315  12.395   0.969
 1002    HE   ARG  59           HE       ARG  59  16.721  13.440   1.302
 1003   1HH1  ARG  59          1HH2      ARG  59  19.190  14.628   2.695
 1004   2HH1  ARG  59          2HH2      ARG  59  19.258  13.780   4.203
 1005   1HH2  ARG  59          1HH1      ARG  59  16.162  12.298   3.774
 1006   2HH2  ARG  59          2HH1      ARG  59  16.906  13.433   4.851
 1007    H    GLU  60           H        GLU  60  20.933  10.599  -3.151
 1008    HA   GLU  60           HA       GLU  60  21.701  12.801  -4.840
 1009   1HB   GLU  60          2HB       GLU  60  22.851  10.148  -4.116
 1010   2HB   GLU  60          1HB       GLU  60  23.458  10.907  -5.567
 1011   1HG   GLU  60          1HG       GLU  60  23.310  12.272  -2.868
 1012   2HG   GLU  60          2HG       GLU  60  24.766  11.524  -3.524
 1013    H    TYR  61           H        TYR  61  20.096   9.757  -5.397
 1014    HA   TYR  61           HA       TYR  61  20.403   9.936  -8.324
 1015   1HB   TYR  61          1HB       TYR  61  19.079   7.991  -6.438
 1016   2HB   TYR  61          2HB       TYR  61  18.764   7.927  -8.172
 1017    HD1  TYR  61           HD2      TYR  61  21.827   8.549  -6.055
 1018    HD2  TYR  61           HD1      TYR  61  20.012   6.262  -9.236
 1019    HE1  TYR  61           HE2      TYR  61  23.970   7.327  -6.399
 1020    HE2  TYR  61           HE1      TYR  61  22.155   5.035  -9.574
 1021    HH   TYR  61           HH       TYR  61  24.417   5.112  -9.107
 1022    H    ILE  62           H        ILE  62  17.968  10.578  -5.840
 1023    HA   ILE  62           HA       ILE  62  15.682  10.811  -7.456
 1024    HB   ILE  62           HB       ILE  62  15.913  10.998  -4.895
 1025   1HG1  ILE  62          1HG1      ILE  62  14.122  13.007  -6.275
 1026   2HG1  ILE  62          2HG1      ILE  62  13.831  11.267  -6.257
 1027   1HG2  ILE  62          3HG2      ILE  62  17.313  13.331  -5.566
 1028   2HG2  ILE  62          1HG2      ILE  62  15.753  13.900  -4.973
 1029   3HG2  ILE  62          2HG2      ILE  62  16.759  12.865  -3.960
 1030   1HD1  ILE  62          2HD1      ILE  62  14.391  12.151  -3.580
 1031   2HD1  ILE  62          3HD1      ILE  62  13.118  13.162  -4.265
 1032   3HD1  ILE  62          1HD1      ILE  62  12.917  11.411  -4.206
 1033    H    ASN  63           H        ASN  63  18.479  12.859  -7.274
 1034    HA   ASN  63           HA       ASN  63  17.109  14.848  -9.039
 1035   1HB   ASN  63          2HB       ASN  63  19.370  15.133  -7.064
 1036   2HB   ASN  63          1HB       ASN  63  19.103  16.320  -8.316
 1037   1HD2  ASN  63          1HD2      ASN  63  16.575  17.826  -7.518
 1038   2HD2  ASN  63          2HD2      ASN  63  17.885  18.124  -6.480
 1039    H    SER  64           H        SER  64  19.718  12.572  -8.748
 1040    HA   SER  64           HA       SER  64  21.115  13.620 -11.123
 1041   1HB   SER  64          2HB       SER  64  21.605  11.158  -9.429
 1042   2HB   SER  64          1HB       SER  64  22.631  11.679 -10.744
 1043    HG   SER  64           HG       SER  64  23.349  13.307  -9.586
 1044    H    LEU  65           H        LEU  65  18.275  12.197 -10.963
 1045    HA   LEU  65           HA       LEU  65  18.837  10.208 -13.121
 1046   1HB   LEU  65          2HB       LEU  65  16.964  10.267 -10.862
 1047   2HB   LEU  65          1HB       LEU  65  16.204   9.843 -12.376
 1048    HG   LEU  65           HG       LEU  65  18.810   8.545 -11.730
 1049   1HD1  LEU  65          3HD1      LEU  65  17.197   8.523  -9.676
 1050   2HD1  LEU  65          1HD1      LEU  65  16.250   7.393 -10.644
 1051   3HD1  LEU  65          2HD1      LEU  65  17.914   7.002 -10.206
 1052   1HD2  LEU  65          2HD2      LEU  65  17.271   8.293 -13.841
 1053   2HD2  LEU  65          3HD2      LEU  65  18.006   6.855 -13.130
 1054   3HD2  LEU  65          1HD2      LEU  65  16.319   7.243 -12.792
 1055    H    GLU  66           H        GLU  66  16.750  12.920 -12.171
 1056    HA   GLU  66           HA       GLU  66  15.554  13.002 -14.872
 1057   1HB   GLU  66          1HB       GLU  66  14.199  13.443 -12.789
 1058   2HB   GLU  66          2HB       GLU  66  15.143  14.915 -12.557
 1059   1HG   GLU  66          1HG       GLU  66  14.444  15.337 -15.092
 1060   2HG   GLU  66          2HG       GLU  66  13.107  14.276 -14.652
 1061    H    MET  67           H        MET  67  17.245  13.665 -16.237
 1062    HA   MET  67           HA       MET  67  18.611  15.241 -17.315
 1063   1HB   MET  67          1HB       MET  67  16.516  16.703 -16.353
 1064   2HB   MET  67          2HB       MET  67  17.868  17.480 -15.530
 1065   1HG   MET  67          1HG       MET  67  19.002  17.857 -17.653
 1066   2HG   MET  67          2HG       MET  67  17.751  16.960 -18.515
 1067   1HE   MET  67          3HE       MET  67  17.951  18.869 -19.987
 1068   2HE   MET  67          2HE       MET  67  16.979  20.336 -19.877
 1069   3HE   MET  67          1HE       MET  67  18.583  20.284 -19.146
 1070    H    SER  68           H        SER  68  20.764  15.719 -17.016
 1071    HA   SER  68           HA       SER  68  21.785  16.547 -14.400
 1072   1HB   SER  68          1HB       SER  68  22.187  13.762 -15.465
 1073   2HB   SER  68          2HB       SER  68  23.441  14.519 -14.483
 1074    HG   SER  68           HG       SER  68  21.778  14.920 -12.911
   
  No H/Q in entry =        1074
  Start of MODEL    9
    1    H    SER   1           H        SER   1  10.848 -17.678   1.210
    2    HA   SER   1           HA       SER   1  12.366 -17.915  -1.260
    3   1HB   SER   1          1HB       SER   1   9.741 -16.714  -0.455
    4   2HB   SER   1          2HB       SER   1  10.458 -16.227  -1.992
    5    HG   SER   1           HG       SER   1   9.066 -18.091  -2.111
    6    HA   PRO   2           HA       PRO   2  14.766 -14.252  -1.087
    7   1HB   PRO   2          1HB       PRO   2  14.228 -13.452  -3.805
    8   2HB   PRO   2          2HB       PRO   2  15.668 -14.263  -3.178
    9   1HG   PRO   2          1HG       PRO   2  13.578 -15.390  -4.820
   10   2HG   PRO   2          2HG       PRO   2  15.017 -16.202  -4.192
   11   1HD   PRO   2          1HD       PRO   2  12.280 -16.531  -3.337
   12   2HD   PRO   2          2HD       PRO   2  13.724 -17.348  -2.707
   13    H    TYR   3           H        TYR   3  13.965 -12.496  -0.010
   14    HA   TYR   3           HA       TYR   3  11.328 -11.439  -0.407
   15   1HB   TYR   3          1HB       TYR   3  13.789 -10.448   1.028
   16   2HB   TYR   3          2HB       TYR   3  12.348  -9.438   0.906
   17    HD1  TYR   3           HD2      TYR   3  13.438 -12.902   1.880
   18    HD2  TYR   3           HD1      TYR   3  10.586  -9.710   2.446
   19    HE1  TYR   3           HE2      TYR   3  12.395 -14.168   3.758
   20    HE2  TYR   3           HE1      TYR   3   9.543 -10.975   4.324
   21    HH   TYR   3           HH       TYR   3  10.890 -13.263   5.976
   22    H    SER   4           H        SER   4  14.502 -10.536  -1.687
   23    HA   SER   4           HA       SER   4  15.084  -9.043  -3.400
   24   1HB   SER   4          1HB       SER   4  12.915 -10.487  -4.292
   25   2HB   SER   4          2HB       SER   4  12.360  -8.825  -4.495
   26    HG   SER   4           HG       SER   4  13.479  -9.440  -6.326
   27    H    SER   5           H        SER   5  14.067  -6.871  -4.506
   28    HA   SER   5           HA       SER   5  12.659  -5.312  -2.400
   29   1HB   SER   5          1HB       SER   5  15.177  -4.348  -3.788
   30   2HB   SER   5          2HB       SER   5  14.273  -3.502  -2.532
   31    HG   SER   5           HG       SER   5  14.874  -5.025  -1.065
   32    H    ASP   6           H        ASP   6  10.820  -4.954  -3.629
   33    HA   ASP   6           HA       ASP   6  11.112  -3.141  -5.927
   34   1HB   ASP   6          2HB       ASP   6   9.843  -4.562  -7.470
   35   2HB   ASP   6          1HB       ASP   6  11.285  -5.420  -6.932
   36    H    THR   7           H        THR   7   8.449  -3.390  -6.858
   37    HA   THR   7           HA       THR   7   7.096  -2.177  -4.541
   38    HB   THR   7           HB       THR   7   5.327  -1.754  -6.478
   39    HG1  THR   7           HG1      THR   7   6.259  -1.760  -8.468
   40   1HG2  THR   7          2HG2      THR   7   8.008  -0.370  -6.185
   41   2HG2  THR   7          3HG2      THR   7   6.655   0.297  -7.099
   42   3HG2  THR   7          1HG2      THR   7   6.504   0.041  -5.361
   43    H    THR   8           H        THR   8   4.475  -2.637  -4.924
   44    HA   THR   8           HA       THR   8   3.877  -5.414  -5.550
   45    HB   THR   8           HB       THR   8   3.644  -4.608  -2.639
   46    HG1  THR   8           HG1      THR   8   5.764  -4.805  -2.825
   47   1HG2  THR   8          2HG2      THR   8   2.218  -6.464  -3.796
   48   2HG2  THR   8          3HG2      THR   8   3.719  -7.390  -3.787
   49   3HG2  THR   8          1HG2      THR   8   3.014  -6.838  -2.268
   50    HA   PRO   9           HA       PRO   9   0.101  -3.116  -6.177
   51   1HB   PRO   9          1HB       PRO   9  -1.316  -5.604  -6.567
   52   2HB   PRO   9          2HB       PRO   9  -0.807  -4.442  -7.799
   53   1HG   PRO   9          1HG       PRO   9   0.323  -7.039  -7.261
   54   2HG   PRO   9          2HG       PRO   9   0.834  -5.887  -8.473
   55   1HD   PRO   9          1HD       PRO   9   2.172  -6.593  -6.048
   56   2HD   PRO   9          2HD       PRO   9   2.687  -5.438  -7.267
   57    H    CYS  10           H        CYS  10  -0.809  -2.383  -4.275
   58    HA   CYS  10           HA       CYS  10  -2.254  -4.340  -2.590
   59   1HB   CYS  10          1HB       CYS  10   0.139  -2.763  -1.765
   60   2HB   CYS  10          2HB       CYS  10  -1.144  -2.964  -0.599
   61    H    CYS  11           H        CYS  11  -3.831  -3.399  -1.251
   62    HA   CYS  11           HA       CYS  11  -4.578  -0.661  -2.109
   63   1HB   CYS  11          1HB       CYS  11  -6.475  -1.866  -2.593
   64   2HB   CYS  11          2HB       CYS  11  -6.097  -3.116  -1.419
   65    H    PHE  12           H        PHE  12  -5.140   0.892  -0.444
   66    HA   PHE  12           HA       PHE  12  -3.989   0.189   2.223
   67   1HB   PHE  12          1HB       PHE  12  -3.711   2.649   2.516
   68   2HB   PHE  12          2HB       PHE  12  -2.826   2.034   1.120
   69    HD1  PHE  12           HD1      PHE  12  -3.590   2.489  -1.178
   70    HD2  PHE  12           HD2      PHE  12  -5.695   4.052   2.252
   71    HE1  PHE  12           HE1      PHE  12  -4.846   4.051  -2.661
   72    HE2  PHE  12           HE2      PHE  12  -6.959   5.607   0.769
   73    HZ   PHE  12           HZ       PHE  12  -6.531   5.609  -1.688
   74    H    ALA  13           H        ALA  13  -6.760   1.672   0.598
   75    HA   ALA  13           HA       ALA  13  -8.300   1.326   3.130
   76   1HB   ALA  13          2HB       ALA  13  -7.721   3.738   2.803
   77   2HB   ALA  13          3HB       ALA  13  -8.555   3.690   1.249
   78   3HB   ALA  13          1HB       ALA  13  -9.458   3.439   2.743
   79    H    TYR  14           H        TYR  14 -10.404   0.583   2.844
   80    HA   TYR  14           HA       TYR  14 -11.061  -0.073   0.030
   81   1HB   TYR  14          2HB       TYR  14 -12.619  -1.826   1.295
   82   2HB   TYR  14          1HB       TYR  14 -10.964  -2.190   0.908
   83    HD1  TYR  14           HD1      TYR  14  -9.141  -1.644   2.694
   84    HD2  TYR  14           HD2      TYR  14 -13.378  -1.863   3.512
   85    HE1  TYR  14           HE1      TYR  14  -8.662  -1.861   5.118
   86    HE2  TYR  14           HE2      TYR  14 -12.892  -2.086   5.945
   87    HH   TYR  14           HH       TYR  14  -9.606  -1.750   7.211
   88    H    ILE  15           H        ILE  15 -13.247   0.190  -0.678
   89    HA   ILE  15           HA       ILE  15 -14.646   2.395   0.556
   90    HB   ILE  15           HB       ILE  15 -14.752   1.946  -1.876
   91   1HG1  ILE  15          1HG1      ILE  15 -17.529   1.520  -0.794
   92   2HG1  ILE  15          2HG1      ILE  15 -16.668   3.025  -0.472
   93   1HG2  ILE  15          2HG2      ILE  15 -15.261  -0.694  -0.990
   94   2HG2  ILE  15          3HG2      ILE  15 -16.723  -0.158  -1.819
   95   3HG2  ILE  15          1HG2      ILE  15 -15.172  -0.124  -2.657
   96   1HD1  ILE  15          1HD1      ILE  15 -16.474   2.223  -3.274
   97   2HD1  ILE  15          2HD1      ILE  15 -18.146   2.444  -2.762
   98   3HD1  ILE  15          3HD1      ILE  15 -16.988   3.763  -2.585
   99    H    ALA  16           H        ALA  16 -16.973   2.199   1.271
  100    HA   ALA  16           HA       ALA  16 -17.262  -0.236   2.959
  101   1HB   ALA  16          1HB       ALA  16 -18.418   2.549   3.116
  102   2HB   ALA  16          2HB       ALA  16 -19.040   1.221   4.097
  103   3HB   ALA  16          3HB       ALA  16 -17.364   1.739   4.275
  104    H    ARG  17           H        ARG  17 -18.001  -1.446   1.017
  105    HA   ARG  17           HA       ARG  17 -20.766  -1.861   0.929
  106   1HB   ARG  17          2HB       ARG  17 -20.034   0.508  -0.494
  107   2HB   ARG  17          1HB       ARG  17 -20.541  -0.703  -1.672
  108   1HG   ARG  17          1HG       ARG  17 -22.702  -0.569  -1.020
  109   2HG   ARG  17          2HG       ARG  17 -22.269  -0.651   0.688
  110   1HD   ARG  17          1HD       ARG  17 -22.516   1.576   0.918
  111   2HD   ARG  17          2HD       ARG  17 -21.439   1.882  -0.445
  112    HE   ARG  17           HE       ARG  17 -24.364   1.337  -0.771
  113   1HH1  ARG  17          2HH1      ARG  17 -21.498   3.368  -2.028
  114   2HH1  ARG  17          1HH1      ARG  17 -22.763   4.453  -1.557
  115   1HH2  ARG  17          2HH2      ARG  17 -24.872   1.882  -3.011
  116   2HH2  ARG  17          1HH2      ARG  17 -23.777   2.926  -3.854
  117    HA   PRO  18           HA       PRO  18 -18.710  -5.246  -1.088
  118   1HB   PRO  18          2HB       PRO  18 -21.192  -6.455  -1.847
  119   2HB   PRO  18          1HB       PRO  18 -20.141  -6.912  -0.527
  120   1HG   PRO  18          2HG       PRO  18 -22.690  -5.558  -0.371
  121   2HG   PRO  18          1HG       PRO  18 -21.663  -6.101   0.960
  122   1HD   PRO  18          1HD       PRO  18 -22.099  -3.403   0.095
  123   2HD   PRO  18          2HD       PRO  18 -21.003  -3.959   1.369
  124    H    LEU  19           H        LEU  19 -19.247  -6.528  -3.300
  125    HA   LEU  19           HA       LEU  19 -19.874  -4.440  -5.343
  126   1HB   LEU  19          1HB       LEU  19 -17.857  -6.675  -5.572
  127   2HB   LEU  19          2HB       LEU  19 -18.133  -5.412  -6.746
  128    HG   LEU  19           HG       LEU  19 -17.098  -5.049  -3.925
  129   1HD1  LEU  19          1HD1      LEU  19 -15.739  -5.818  -6.200
  130   2HD1  LEU  19          2HD1      LEU  19 -15.528  -4.067  -6.204
  131   3HD1  LEU  19          3HD1      LEU  19 -15.011  -5.015  -4.809
  132   1HD2  LEU  19          1HD2      LEU  19 -18.343  -3.204  -5.821
  133   2HD2  LEU  19          2HD2      LEU  19 -17.952  -2.961  -4.119
  134   3HD2  LEU  19          3HD2      LEU  19 -16.722  -2.689  -5.354
  135    HA   PRO  20           HA       PRO  20 -22.951  -7.521  -6.452
  136   1HB   PRO  20          1HB       PRO  20 -23.351  -6.200  -8.990
  137   2HB   PRO  20          2HB       PRO  20 -24.411  -6.181  -7.576
  138   1HG   PRO  20          1HG       PRO  20 -22.769  -4.033  -8.567
  139   2HG   PRO  20          2HG       PRO  20 -23.793  -4.030  -7.126
  140   1HD   PRO  20          1HD       PRO  20 -20.905  -4.119  -7.261
  141   2HD   PRO  20          2HD       PRO  20 -21.931  -4.070  -5.815
  142    H    ARG  21           H        ARG  21 -22.971  -9.307  -7.935
  143    HA   ARG  21           HA       ARG  21 -20.413 -10.002  -9.058
  144   1HB   ARG  21          1HB       ARG  21 -22.232 -11.593  -8.216
  145   2HB   ARG  21          2HB       ARG  21 -23.044 -11.317  -9.738
  146   1HG   ARG  21          2HG       ARG  21 -21.767 -13.013 -10.534
  147   2HG   ARG  21          1HG       ARG  21 -20.452 -11.837 -10.537
  148   1HD   ARG  21          1HD       ARG  21 -19.516 -12.678  -8.597
  149   2HD   ARG  21          2HD       ARG  21 -21.065 -13.237  -7.967
  150    HE   ARG  21           HE       ARG  21 -19.244 -14.869  -9.388
  151   1HH1  ARG  21          2HH1      ARG  21 -22.319 -15.531  -8.205
  152   2HH1  ARG  21          1HH1      ARG  21 -23.125 -15.056  -9.662
  153   1HH2  ARG  21          2HH2      ARG  21 -20.231 -15.825 -11.502
  154   2HH2  ARG  21          1HH2      ARG  21 -21.588 -16.794 -11.036
  155    H    ALA  22           H        ALA  22 -22.994  -8.113 -10.295
  156    HA   ALA  22           HA       ALA  22 -22.205  -8.678 -13.102
  157   1HB   ALA  22          3HB       ALA  22 -24.667  -8.354 -12.123
  158   2HB   ALA  22          1HB       ALA  22 -24.294  -6.655 -12.416
  159   3HB   ALA  22          2HB       ALA  22 -24.247  -7.811 -13.748
  160    H    HIS  23           H        HIS  23 -20.790  -6.933 -10.859
  161    HA   HIS  23           HA       HIS  23 -20.276  -4.653 -12.722
  162   1HB   HIS  23          1HB       HIS  23 -20.417  -4.533  -9.695
  163   2HB   HIS  23          2HB       HIS  23 -19.976  -3.194 -10.753
  164    HD2  HIS  23           HD2      HIS  23 -23.157  -5.625 -10.833
  165    HE1  HIS  23           HE1      HIS  23 -24.410  -1.616 -11.307
  166    HE2  HIS  23           HE2      HIS  23 -25.196  -4.032 -11.157
  167    H    ILE  24           H        ILE  24 -18.924  -7.312 -11.150
  168    HA   ILE  24           HA       ILE  24 -16.270  -5.957 -11.100
  169    HB   ILE  24           HB       ILE  24 -16.635  -8.649  -9.894
  170   1HG1  ILE  24          2HG1      ILE  24 -17.276  -6.134  -8.358
  171   2HG1  ILE  24          1HG1      ILE  24 -18.527  -7.167  -9.051
  172   1HG2  ILE  24          3HG2      ILE  24 -14.677  -6.550  -9.966
  173   2HG2  ILE  24          1HG2      ILE  24 -15.141  -6.866  -8.296
  174   3HG2  ILE  24          2HG2      ILE  24 -14.527  -8.177  -9.301
  175   1HD1  ILE  24          2HD1      ILE  24 -17.038  -9.040  -7.796
  176   2HD1  ILE  24          3HD1      ILE  24 -16.694  -7.659  -6.754
  177   3HD1  ILE  24          1HD1      ILE  24 -18.359  -8.190  -6.994
  178    H    LYS  25           H        LYS  25 -14.430  -7.611 -11.550
  179    HA   LYS  25           HA       LYS  25 -15.224  -9.403 -13.799
  180   1HB   LYS  25          1HB       LYS  25 -13.859  -7.060 -14.163
  181   2HB   LYS  25          2HB       LYS  25 -12.533  -8.199 -13.954
  182   1HG   LYS  25          1HG       LYS  25 -12.837  -8.658 -16.158
  183   2HG   LYS  25          2HG       LYS  25 -14.228  -9.595 -15.614
  184   1HD   LYS  25          1HD       LYS  25 -15.747  -7.961 -16.239
  185   2HD   LYS  25          2HD       LYS  25 -14.582  -6.653 -16.038
  186   1HE   LYS  25          1HE       LYS  25 -13.603  -7.027 -18.120
  187   2HE   LYS  25          2HE       LYS  25 -14.106  -8.717 -18.165
  188   1HZ   LYS  25          3HZ       LYS  25 -16.092  -6.533 -18.211
  189   2HZ   LYS  25          1HZ       LYS  25 -15.336  -7.057 -19.640
  190   3HZ   LYS  25          2HZ       LYS  25 -16.268  -8.143 -18.725
  191    H    GLU  26           H        GLU  26 -12.795  -8.665 -11.260
  192    HA   GLU  26           HA       GLU  26 -12.440 -11.523 -10.826
  193   1HB   GLU  26          1HB       GLU  26 -10.708 -11.665 -12.242
  194   2HB   GLU  26          2HB       GLU  26 -10.687  -9.961 -12.528
  195   1HG   GLU  26          2HG       GLU  26  -8.617 -10.135 -11.651
  196   2HG   GLU  26          1HG       GLU  26  -9.438 -10.033 -10.116
  197    H    TYR  27           H        TYR  27 -10.558 -11.638  -9.009
  198    HA   TYR  27           HA       TYR  27 -10.781  -9.255  -7.312
  199   1HB   TYR  27          2HB       TYR  27 -11.608 -10.391  -5.442
  200   2HB   TYR  27          1HB       TYR  27 -12.459 -11.208  -6.746
  201    HD1  TYR  27           HD2      TYR  27 -11.783 -13.472  -7.506
  202    HD2  TYR  27           HD1      TYR  27  -9.831 -11.519  -4.187
  203    HE1  TYR  27           HE2      TYR  27 -10.746 -15.639  -6.842
  204    HE2  TYR  27           HE1      TYR  27  -8.781 -13.683  -3.532
  205    HH   TYR  27           HH       TYR  27  -8.242 -15.815  -4.425
  206    H    PHE  28           H        PHE  28  -9.069  -9.628  -5.350
  207    HA   PHE  28           HA       PHE  28  -6.910 -11.395  -6.168
  208   1HB   PHE  28          1HB       PHE  28  -6.420  -9.607  -7.696
  209   2HB   PHE  28          2HB       PHE  28  -6.630  -8.395  -6.437
  210    HD1  PHE  28           HD2      PHE  28  -4.503 -11.318  -7.436
  211    HD2  PHE  28           HD1      PHE  28  -4.813  -7.718  -5.074
  212    HE1  PHE  28           HE2      PHE  28  -2.097 -11.519  -6.812
  213    HE2  PHE  28           HE1      PHE  28  -2.415  -7.926  -4.438
  214    HZ   PHE  28           HZ       PHE  28  -1.052  -9.822  -5.314
  215    H    TYR  29           H        TYR  29  -7.378 -12.134  -3.948
  216    HA   TYR  29           HA       TYR  29  -7.257 -10.536  -1.632
  217   1HB   TYR  29          1HB       TYR  29  -7.906 -12.880  -1.527
  218   2HB   TYR  29          2HB       TYR  29  -6.312 -13.379  -2.026
  219    HD1  TYR  29           HD1      TYR  29  -7.727 -11.009   0.538
  220    HD2  TYR  29           HD2      TYR  29  -4.984 -14.233  -0.306
  221    HE1  TYR  29           HE1      TYR  29  -6.961 -10.976   2.906
  222    HE2  TYR  29           HE2      TYR  29  -4.215 -14.199   2.063
  223    HH   TYR  29           HH       TYR  29  -5.460 -13.342   4.396
  224    H    THR  30           H        THR  30  -5.619  -9.603  -0.518
  225    HA   THR  30           HA       THR  30  -3.086  -9.134  -1.756
  226    HB   THR  30           HB       THR  30  -3.707  -8.893   1.200
  227    HG1  THR  30           HG1      THR  30  -5.269  -7.748   0.213
  228   1HG2  THR  30          3HG2      THR  30  -1.808  -7.397  -0.635
  229   2HG2  THR  30          1HG2      THR  30  -2.040  -7.074   1.084
  230   3HG2  THR  30          2HG2      THR  30  -1.339  -8.605   0.562
  231    H    SER  31           H        SER  31  -0.950  -9.825  -0.897
  232    HA   SER  31           HA       SER  31  -0.956 -12.705  -0.346
  233   1HB   SER  31          1HB       SER  31   0.760 -12.104  -1.829
  234   2HB   SER  31          2HB       SER  31   1.161 -10.645  -0.922
  235    HG   SER  31           HG       SER  31   2.682 -11.919  -0.192
  236    H    GLY  32           H        GLY  32   1.263 -10.411   1.188
  237   1HA   GLY  32          1HA       GLY  32   0.201 -10.310   3.781
  238   2HA   GLY  32          2HA       GLY  32   1.135 -11.805   3.707
  239    H    LYS  33           H        LYS  33   1.457  -8.347   2.847
  240    HA   LYS  33           HA       LYS  33   3.812  -7.919   4.388
  241   1HB   LYS  33          1HB       LYS  33   5.490  -7.836   2.535
  242   2HB   LYS  33          2HB       LYS  33   4.894  -9.469   2.832
  243   1HG   LYS  33          1HG       LYS  33   3.319  -9.253   0.966
  244   2HG   LYS  33          2HG       LYS  33   3.826  -7.603   0.697
  245   1HD   LYS  33          1HD       LYS  33   4.945  -9.133  -0.879
  246   2HD   LYS  33          2HD       LYS  33   6.106  -8.376   0.184
  247   1HE   LYS  33          1HE       LYS  33   6.554 -10.330   1.322
  248   2HE   LYS  33          2HE       LYS  33   4.925 -10.960   1.082
  249   1HZ   LYS  33          1HZ       LYS  33   5.849 -10.833  -1.434
  250   2HZ   LYS  33          2HZ       LYS  33   7.268 -11.221  -0.585
  251   3HZ   LYS  33          3HZ       LYS  33   5.904 -12.224  -0.462
  252    H    CYS  34           H        CYS  34   1.416  -6.524   3.792
  253    HA   CYS  34           HA       CYS  34   2.548  -4.091   2.481
  254   1HB   CYS  34          2HB       CYS  34   0.045  -5.595   1.865
  255   2HB   CYS  34          1HB       CYS  34  -0.030  -3.835   1.799
  256    H    SER  35           H        SER  35   1.303  -5.333   5.301
  257    HA   SER  35           HA       SER  35   0.346  -4.334   7.200
  258   1HB   SER  35          1HB       SER  35   2.102  -2.421   5.993
  259   2HB   SER  35          2HB       SER  35   0.682  -1.565   6.593
  260    HG   SER  35           HG       SER  35   2.607  -3.035   7.972
  261    H    ASN  36           H        ASN  36  -1.176  -4.598   4.564
  262    HA   ASN  36           HA       ASN  36  -3.558  -3.090   5.432
  263   1HB   ASN  36          2HB       ASN  36  -2.370  -2.726   2.668
  264   2HB   ASN  36          1HB       ASN  36  -3.890  -2.064   3.220
  265   1HD2  ASN  36          1HD2      ASN  36  -0.622   0.078   3.862
  266   2HD2  ASN  36          2HD2      ASN  36  -0.766  -1.145   2.693
  267    HA   PRO  37           HA       PRO  37  -3.921  -7.431   3.585
  268   1HB   PRO  37          1HB       PRO  37  -5.618  -8.021   5.863
  269   2HB   PRO  37          2HB       PRO  37  -4.085  -8.778   5.413
  270   1HG   PRO  37          1HG       PRO  37  -4.554  -6.946   7.573
  271   2HG   PRO  37          2HG       PRO  37  -3.026  -7.651   7.091
  272   1HD   PRO  37          1HD       PRO  37  -3.888  -4.923   6.762
  273   2HD   PRO  37          2HD       PRO  37  -2.341  -5.639   6.270
  274    H    ALA  38           H        ALA  38  -5.611  -7.722   2.184
  275    HA   ALA  38           HA       ALA  38  -8.348  -7.043   2.841
  276   1HB   ALA  38          3HB       ALA  38  -6.909  -4.841   2.183
  277   2HB   ALA  38          1HB       ALA  38  -7.410  -5.368   0.576
  278   3HB   ALA  38          2HB       ALA  38  -8.622  -5.016   1.807
  279    H    VAL  39           H        VAL  39  -9.085  -6.514   0.066
  280    HA   VAL  39           HA       VAL  39  -8.078  -8.815  -1.446
  281    HB   VAL  39           HB       VAL  39 -10.252  -9.191   0.180
  282   1HG1  VAL  39          2HG1      VAL  39 -11.649  -7.676  -1.165
  283   2HG1  VAL  39          3HG1      VAL  39 -11.378  -8.712  -2.568
  284   3HG1  VAL  39          1HG1      VAL  39 -12.247  -9.334  -1.165
  285   1HG2  VAL  39          2HG2      VAL  39  -9.238 -10.543  -2.258
  286   2HG2  VAL  39          3HG2      VAL  39  -9.284 -11.110  -0.585
  287   3HG2  VAL  39          1HG2      VAL  39 -10.758 -11.105  -1.555
  288    H    VAL  40           H        VAL  40  -8.050  -8.209  -3.552
  289    HA   VAL  40           HA       VAL  40  -9.239  -5.548  -4.051
  290    HB   VAL  40           HB       VAL  40  -6.845  -6.965  -5.168
  291   1HG1  VAL  40          2HG1      VAL  40  -8.582  -5.026  -6.539
  292   2HG1  VAL  40          3HG1      VAL  40  -6.892  -4.538  -6.453
  293   3HG1  VAL  40          1HG1      VAL  40  -7.331  -6.073  -7.202
  294   1HG2  VAL  40          2HG2      VAL  40  -7.440  -4.293  -3.880
  295   2HG2  VAL  40          3HG2      VAL  40  -6.539  -5.637  -3.175
  296   3HG2  VAL  40          1HG2      VAL  40  -5.858  -4.733  -4.529
  297    H    PHE  41           H        PHE  41 -11.095  -5.542  -5.058
  298    HA   PHE  41           HA       PHE  41 -11.699  -7.683  -6.991
  299   1HB   PHE  41          2HB       PHE  41 -13.288  -5.731  -5.400
  300   2HB   PHE  41          1HB       PHE  41 -13.957  -6.229  -6.930
  301    HD1  PHE  41           HD2      PHE  41 -12.748  -7.429  -3.625
  302    HD2  PHE  41           HD1      PHE  41 -14.832  -8.469  -7.254
  303    HE1  PHE  41           HE2      PHE  41 -13.533  -9.549  -2.575
  304    HE2  PHE  41           HE1      PHE  41 -15.629 -10.571  -6.204
  305    HZ   PHE  41           HZ       PHE  41 -15.003 -11.102  -3.849
  306    H    VAL  42           H        VAL  42 -10.766  -7.256  -8.874
  307    HA   VAL  42           HA       VAL  42 -10.476  -4.587  -9.962
  308    HB   VAL  42           HB       VAL  42 -10.225  -6.043 -12.153
  309   1HG1  VAL  42          2HG2      VAL  42  -8.508  -4.787 -10.654
  310   2HG1  VAL  42          3HG2      VAL  42  -8.119  -6.398 -10.048
  311   3HG1  VAL  42          1HG2      VAL  42  -7.912  -6.025 -11.761
  312   1HG2  VAL  42          3HG1      VAL  42 -11.063  -8.098 -10.842
  313   2HG2  VAL  42          1HG1      VAL  42  -9.639  -8.294 -11.860
  314   3HG2  VAL  42          2HG1      VAL  42  -9.459  -8.102 -10.116
  315    H    THR  43           H        THR  43 -12.641  -3.664  -9.951
  316    HA   THR  43           HA       THR  43 -14.680  -5.213 -11.468
  317    HB   THR  43           HB       THR  43 -16.345  -4.269 -10.153
  318    HG1  THR  43           HG1      THR  43 -16.286  -2.183 -10.185
  319   1HG2  THR  43          1HG2      THR  43 -14.095  -5.158  -8.756
  320   2HG2  THR  43          2HG2      THR  43 -14.539  -3.655  -7.955
  321   3HG2  THR  43          3HG2      THR  43 -15.717  -4.958  -8.104
  322    H    ARG  44           H        ARG  44 -16.046  -4.294 -12.904
  323    HA   ARG  44           HA       ARG  44 -16.605  -3.078 -14.753
  324   1HB   ARG  44          2HB       ARG  44 -15.645  -0.884 -12.928
  325   2HB   ARG  44          1HB       ARG  44 -16.358  -0.560 -14.490
  326   1HG   ARG  44          1HG       ARG  44 -17.679  -2.212 -12.327
  327   2HG   ARG  44          2HG       ARG  44 -18.053  -0.520 -12.653
  328   1HD   ARG  44          1HD       ARG  44 -18.141  -1.946 -15.134
  329   2HD   ARG  44          2HD       ARG  44 -19.100  -2.841 -13.955
  330    HE   ARG  44           HE       ARG  44 -19.630   0.046 -14.026
  331   1HH1  ARG  44          1HH2      ARG  44 -20.860  -1.622 -16.818
  332   2HH1  ARG  44          2HH2      ARG  44 -21.049  -2.993 -15.777
  333   1HH2  ARG  44          1HH1      ARG  44 -22.013  -0.217 -13.516
  334   2HH2  ARG  44          2HH1      ARG  44 -22.903  -0.999 -14.779
  335    H    LYS  45           H        LYS  45 -13.946  -0.871 -14.201
  336    HA   LYS  45           HA       LYS  45 -12.785  -1.707 -16.774
  337   1HB   LYS  45          1HB       LYS  45 -12.949   0.708 -15.509
  338   2HB   LYS  45          2HB       LYS  45 -11.309   0.219 -15.093
  339   1HG   LYS  45          1HG       LYS  45 -10.810   1.134 -17.124
  340   2HG   LYS  45          2HG       LYS  45 -11.351  -0.430 -17.731
  341   1HD   LYS  45          1HD       LYS  45 -13.625   0.466 -18.040
  342   2HD   LYS  45          2HD       LYS  45 -13.104   2.026 -17.401
  343   1HE   LYS  45          1HE       LYS  45 -11.461   2.216 -19.249
  344   2HE   LYS  45          2HE       LYS  45 -12.028   0.678 -19.898
  345   1HZ   LYS  45          3HZ       LYS  45 -14.286   1.709 -19.987
  346   2HZ   LYS  45          1HZ       LYS  45 -13.558   3.201 -19.629
  347   3HZ   LYS  45          2HZ       LYS  45 -13.153   2.380 -21.059
  348    H    ASN  46           H        ASN  46 -12.705  -3.146 -13.925
  349    HA   ASN  46           HA       ASN  46 -11.290  -4.587 -12.842
  350   1HB   ASN  46          2HB       ASN  46 -10.181  -4.404 -15.608
  351   2HB   ASN  46          1HB       ASN  46  -9.107  -5.043 -14.370
  352   1HD2  ASN  46          1HD2      ASN  46 -10.793  -7.624 -13.293
  353   2HD2  ASN  46          2HD2      ASN  46  -9.542  -7.685 -14.439
  354    H    ARG  47           H        ARG  47 -10.857  -1.540 -12.864
  355    HA   ARG  47           HA       ARG  47  -8.069  -1.072 -12.377
  356   1HB   ARG  47          2HB       ARG  47 -10.506   0.153 -11.034
  357   2HB   ARG  47          1HB       ARG  47  -8.866   0.769 -10.874
  358   1HG   ARG  47          1HG       ARG  47  -8.830   0.953 -13.422
  359   2HG   ARG  47          2HG       ARG  47 -10.567   0.651 -13.373
  360   1HD   ARG  47          1HD       ARG  47  -9.876   2.670 -11.430
  361   2HD   ARG  47          2HD       ARG  47  -9.248   3.128 -13.013
  362    HE   ARG  47           HE       ARG  47 -12.096   2.285 -12.781
  363   1HH1  ARG  47          2HH1      ARG  47  -9.843   4.920 -14.081
  364   2HH1  ARG  47          1HH1      ARG  47 -10.903   4.434 -15.362
  365   1HH2  ARG  47          1HH2      ARG  47 -13.497   4.292 -13.097
  366   2HH2  ARG  47          2HH2      ARG  47 -12.547   5.740 -13.100
  367    H    GLN  48           H        GLN  48  -6.861  -1.612 -10.466
  368    HA   GLN  48           HA       GLN  48  -8.017  -3.782  -9.023
  369   1HB   GLN  48          1HB       GLN  48  -5.393  -2.447  -9.056
  370   2HB   GLN  48          2HB       GLN  48  -5.839  -3.217  -7.526
  371   1HG   GLN  48          1HG       GLN  48  -6.370  -5.294  -8.691
  372   2HG   GLN  48          2HG       GLN  48  -6.064  -4.538 -10.248
  373   1HE2  GLN  48          2HE2      GLN  48  -3.023  -6.444  -8.953
  374   2HE2  GLN  48          1HE2      GLN  48  -4.525  -6.807  -9.655
  375    H    VAL  49           H        VAL  49  -9.748  -3.222  -8.021
  376    HA   VAL  49           HA       VAL  49  -9.845  -0.844  -6.307
  377    HB   VAL  49           HB       VAL  49 -12.138  -2.688  -6.403
  378   1HG1  VAL  49          3HG1      VAL  49 -11.646   0.269  -6.660
  379   2HG1  VAL  49          1HG1      VAL  49 -13.244  -0.437  -6.907
  380   3HG1  VAL  49          2HG1      VAL  49 -12.449  -0.587  -5.340
  381   1HG2  VAL  49          2HG2      VAL  49 -11.243  -1.157  -8.880
  382   2HG2  VAL  49          3HG2      VAL  49 -11.396  -2.904  -8.768
  383   3HG2  VAL  49          1HG2      VAL  49 -12.830  -1.891  -8.684
  384    H    CYS  50           H        CYS  50 -11.179  -1.370  -4.148
  385    HA   CYS  50           HA       CYS  50  -9.802  -3.677  -2.850
  386   1HB   CYS  50          2HB       CYS  50  -9.653  -1.007  -2.182
  387   2HB   CYS  50          1HB       CYS  50 -10.957  -1.561  -1.156
  388    H    ALA  51           H        ALA  51 -11.248  -4.094  -0.631
  389    HA   ALA  51           HA       ALA  51 -14.029  -3.742  -0.651
  390   1HB   ALA  51          3HB       ALA  51 -13.179  -5.541  -2.725
  391   2HB   ALA  51          1HB       ALA  51 -14.101  -6.448  -1.527
  392   3HB   ALA  51          2HB       ALA  51 -14.820  -5.042  -2.312
  393    H    ASN  52           H        ASN  52 -11.761  -4.253   1.190
  394    HA   ASN  52           HA       ASN  52 -11.528  -5.291   3.279
  395   1HB   ASN  52          1HB       ASN  52 -14.025  -4.752   3.301
  396   2HB   ASN  52          2HB       ASN  52 -14.293  -6.412   2.763
  397   1HD2  ASN  52          2HD2      ASN  52 -14.174  -5.679   6.540
  398   2HD2  ASN  52          1HD2      ASN  52 -13.359  -4.479   5.662
  399    HA   PRO  53           HA       PRO  53 -10.359  -9.365   1.980
  400   1HB   PRO  53          2HB       PRO  53  -9.030 -10.109   4.219
  401   2HB   PRO  53          1HB       PRO  53  -8.366  -8.977   3.069
  402   1HG   PRO  53          2HG       PRO  53  -9.459  -8.427   5.783
  403   2HG   PRO  53          1HG       PRO  53  -8.295  -7.488   4.838
  404   1HD   PRO  53          1HD       PRO  53 -11.091  -6.946   5.150
  405   2HD   PRO  53          2HD       PRO  53  -9.960  -6.116   4.062
  406    H    GLU  54           H        GLU  54 -11.162  -9.358   5.475
  407    HA   GLU  54           HA       GLU  54 -12.349 -12.026   5.235
  408   1HB   GLU  54          1HB       GLU  54 -11.712 -10.157   7.491
  409   2HB   GLU  54          2HB       GLU  54 -12.826 -11.497   7.766
  410   1HG   GLU  54          1HG       GLU  54 -11.113 -13.066   6.878
  411   2HG   GLU  54          2HG       GLU  54  -9.997 -11.714   6.697
  412    H    LYS  55           H        LYS  55 -13.746  -9.356   4.196
  413    HA   LYS  55           HA       LYS  55 -16.145  -9.179   5.792
  414   1HB   LYS  55          2HB       LYS  55 -15.182  -8.038   3.301
  415   2HB   LYS  55          1HB       LYS  55 -16.884  -8.482   3.189
  416   1HG   LYS  55          1HG       LYS  55 -16.081  -7.143   5.708
  417   2HG   LYS  55          2HG       LYS  55 -16.004  -6.138   4.262
  418   1HD   LYS  55          1HD       LYS  55 -18.315  -6.533   3.759
  419   2HD   LYS  55          2HD       LYS  55 -18.425  -7.812   4.968
  420   1HE   LYS  55          1HE       LYS  55 -17.775  -4.930   5.642
  421   2HE   LYS  55          2HE       LYS  55 -19.408  -5.594   5.693
  422   1HZ   LYS  55          2HZ       LYS  55 -18.569  -7.299   7.243
  423   2HZ   LYS  55          3HZ       LYS  55 -17.065  -6.510   7.269
  424   3HZ   LYS  55          1HZ       LYS  55 -18.448  -5.723   7.863
  425    H    LYS  56           H        LYS  56 -17.815 -10.587   5.879
  426    HA   LYS  56           HA       LYS  56 -17.798 -13.165   4.898
  427   1HB   LYS  56          1HB       LYS  56 -20.234 -11.420   5.346
  428   2HB   LYS  56          2HB       LYS  56 -20.257 -13.180   5.232
  429   1HG   LYS  56          1HG       LYS  56 -19.250 -13.464   7.287
  430   2HG   LYS  56          2HG       LYS  56 -18.348 -11.953   7.172
  431   1HD   LYS  56          1HD       LYS  56 -20.225 -10.651   7.788
  432   2HD   LYS  56          2HD       LYS  56 -21.353 -11.963   7.446
  433   1HE   LYS  56          1HE       LYS  56 -20.086 -13.248   9.315
  434   2HE   LYS  56          2HE       LYS  56 -19.467 -11.663   9.780
  435   1HZ   LYS  56          3HZ       LYS  56 -22.059 -11.131   9.497
  436   2HZ   LYS  56          1HZ       LYS  56 -22.147 -12.748  10.006
  437   3HZ   LYS  56          2HZ       LYS  56 -21.355 -11.596  10.970
  438    H    TRP  57           H        TRP  57 -18.605 -10.312   3.021
  439    HA   TRP  57           HA       TRP  57 -19.868 -11.954   0.928
  440   1HB   TRP  57          1HB       TRP  57 -20.417  -9.910  -0.160
  441   2HB   TRP  57          2HB       TRP  57 -20.705  -9.660   1.563
  442    HD1  TRP  57           HD1      TRP  57 -19.429  -7.673   2.639
  443    HE1  TRP  57           HE1      TRP  57 -17.825  -5.898   1.662
  444    HE3  TRP  57           HE3      TRP  57 -18.350  -9.894  -1.786
  445    HZ2  TRP  57           HZ2      TRP  57 -16.222  -5.521  -0.721
  446    HZ3  TRP  57           HZ3      TRP  57 -16.882  -8.814  -3.433
  447    HH2  TRP  57           HH2      TRP  57 -15.799  -6.636  -2.906
  448    H    VAL  58           H        VAL  58 -16.872 -10.021   1.224
  449    HA   VAL  58           HA       VAL  58 -15.949 -10.373  -1.411
  450    HB   VAL  58           HB       VAL  58 -13.589 -10.519  -0.227
  451   1HG1  VAL  58          3HG1      VAL  58 -14.779  -8.612  -1.451
  452   2HG1  VAL  58          1HG1      VAL  58 -15.214  -8.023   0.152
  453   3HG1  VAL  58          2HG1      VAL  58 -13.520  -8.167  -0.308
  454   1HG2  VAL  58          2HG2      VAL  58 -14.571 -11.041   1.992
  455   2HG2  VAL  58          3HG2      VAL  58 -13.555  -9.603   1.991
  456   3HG2  VAL  58          1HG2      VAL  58 -15.304  -9.444   1.988
  457    H    ARG  59           H        ARG  59 -15.443 -12.577   1.354
  458    HA   ARG  59           HA       ARG  59 -13.976 -14.508  -0.177
  459   1HB   ARG  59          1HB       ARG  59 -15.571 -14.723   2.384
  460   2HB   ARG  59          2HB       ARG  59 -14.708 -16.080   1.702
  461   1HG   ARG  59          1HG       ARG  59 -12.689 -14.401   1.633
  462   2HG   ARG  59          2HG       ARG  59 -13.610 -13.537   2.840
  463   1HD   ARG  59          1HD       ARG  59 -13.413 -15.232   4.412
  464   2HD   ARG  59          2HD       ARG  59 -13.247 -16.486   3.182
  465    HE   ARG  59           HE       ARG  59 -11.062 -14.619   3.999
  466   1HH1  ARG  59          1HH1      ARG  59 -11.683 -16.478   1.365
  467   2HH1  ARG  59          2HH1      ARG  59 -10.411 -17.631   1.601
  468   1HH2  ARG  59          1HH2      ARG  59  -9.775 -16.728   4.845
  469   2HH2  ARG  59          2HH2      ARG  59  -8.991 -17.314   3.415
  470    H    GLU  60           H        GLU  60 -17.382 -13.860   0.287
  471    HA   GLU  60           HA       GLU  60 -18.329 -16.379  -0.809
  472   1HB   GLU  60          1HB       GLU  60 -19.485 -14.016   0.331
  473   2HB   GLU  60          2HB       GLU  60 -20.258 -14.324  -1.205
  474   1HG   GLU  60          2HG       GLU  60 -19.839 -16.753   0.389
  475   2HG   GLU  60          1HG       GLU  60 -20.901 -15.577   1.165
  476    H    TYR  61           H        TYR  61 -17.087 -13.453  -2.144
  477    HA   TYR  61           HA       TYR  61 -18.268 -13.960  -4.813
  478   1HB   TYR  61          1HB       TYR  61 -16.788 -11.727  -3.493
  479   2HB   TYR  61          2HB       TYR  61 -16.584 -11.909  -5.233
  480    HD1  TYR  61           HD2      TYR  61 -19.135 -11.519  -2.531
  481    HD2  TYR  61           HD1      TYR  61 -18.297 -11.237  -6.756
  482    HE1  TYR  61           HE2      TYR  61 -21.310 -10.370  -2.881
  483    HE2  TYR  61           HE1      TYR  61 -20.482 -10.092  -7.109
  484    HH   TYR  61           HH       TYR  61 -22.951 -10.103  -4.897
  485    H    ILE  62           H        ILE  62 -15.349 -14.387  -2.968
  486    HA   ILE  62           HA       ILE  62 -13.544 -14.776  -5.181
  487    HB   ILE  62           HB       ILE  62 -13.461 -15.703  -2.292
  488   1HG1  ILE  62          1HG1      ILE  62 -11.798 -13.541  -3.563
  489   2HG1  ILE  62          2HG1      ILE  62 -13.429 -13.188  -2.998
  490   1HG2  ILE  62          3HG2      ILE  62 -11.685 -16.216  -4.587
  491   2HG2  ILE  62          1HG2      ILE  62 -10.867 -15.589  -3.156
  492   3HG2  ILE  62          2HG2      ILE  62 -11.817 -17.071  -3.050
  493   1HD1  ILE  62          1HD1      ILE  62 -11.964 -14.720  -1.018
  494   2HD1  ILE  62          2HD1      ILE  62 -11.084 -13.252  -1.446
  495   3HD1  ILE  62          3HD1      ILE  62 -12.741 -13.146  -0.851
  496    H    ASN  63           H        ASN  63 -15.877 -16.809  -3.548
  497    HA   ASN  63           HA       ASN  63 -14.816 -19.215  -4.940
  498   1HB   ASN  63          1HB       ASN  63 -16.725 -18.774  -2.666
  499   2HB   ASN  63          2HB       ASN  63 -16.783 -20.274  -3.560
  500   1HD2  ASN  63          2HD2      ASN  63 -14.233 -21.787  -2.201
  501   2HD2  ASN  63          1HD2      ASN  63 -14.100 -21.207  -3.790
  502    H    SER  64           H        SER  64 -17.510 -16.976  -4.942
  503    HA   SER  64           HA       SER  64 -19.155 -18.635  -6.704
  504   1HB   SER  64          2HB       SER  64 -20.015 -16.884  -5.041
  505   2HB   SER  64          1HB       SER  64 -19.477 -15.671  -6.202
  506    HG   SER  64           HG       SER  64 -21.677 -16.296  -6.486
  507    H    LEU  65           H        LEU  65 -16.568 -16.380  -7.101
  508    HA   LEU  65           HA       LEU  65 -17.157 -15.289  -9.647
  509   1HB   LEU  65          1HB       LEU  65 -14.687 -15.809  -8.074
  510   2HB   LEU  65          2HB       LEU  65 -14.475 -15.557  -9.807
  511    HG   LEU  65           HG       LEU  65 -16.253 -13.678  -8.298
  512   1HD1  LEU  65          2HD1      LEU  65 -13.772 -14.148  -7.284
  513   2HD1  LEU  65          3HD1      LEU  65 -13.400 -12.914  -8.488
  514   3HD1  LEU  65          1HD1      LEU  65 -14.573 -12.579  -7.214
  515   1HD2  LEU  65          3HD2      LEU  65 -15.055 -13.896 -10.897
  516   2HD2  LEU  65          1HD2      LEU  65 -16.195 -12.684 -10.312
  517   3HD2  LEU  65          2HD2      LEU  65 -14.461 -12.430 -10.115
  518    H    GLU  66           H        GLU  66 -16.980 -16.101 -11.726
  519    HA   GLU  66           HA       GLU  66 -16.427 -19.023 -11.932
  520   1HB   GLU  66          1HB       GLU  66 -18.631 -18.221 -12.749
  521   2HB   GLU  66          2HB       GLU  66 -17.805 -17.167 -13.897
  522   1HG   GLU  66          1HG       GLU  66 -16.661 -19.240 -14.810
  523   2HG   GLU  66          2HG       GLU  66 -17.757 -20.193 -13.811
  524    H    MET  67           H        MET  67 -15.984 -16.147 -14.031
  525    HA   MET  67           HA       MET  67 -13.136 -16.605 -14.291
  526   1HB   MET  67          1HB       MET  67 -14.028 -18.472 -15.690
  527   2HB   MET  67          2HB       MET  67 -14.862 -17.284 -16.692
  528   1HG   MET  67          1HG       MET  67 -12.850 -16.393 -17.526
  529   2HG   MET  67          2HG       MET  67 -11.900 -17.053 -16.196
  530   1HE   MET  67          1HE       MET  67 -10.253 -17.738 -17.312
  531   2HE   MET  67          3HE       MET  67 -10.302 -19.450 -16.890
  532   3HE   MET  67          2HE       MET  67 -10.099 -18.961 -18.572
  533    H    SER  68           H        SER  68 -15.856 -15.384 -16.288
  534    HA   SER  68           HA       SER  68 -15.045 -12.626 -15.877
  535   1HB   SER  68          1HB       SER  68 -14.725 -12.416 -18.506
  536   2HB   SER  68          2HB       SER  68 -13.365 -12.831 -17.462
  537    HG   SER  68           HG       SER  68 -13.245 -14.613 -18.528
  538    H    SER   1           H        SER   1  -7.743  15.095  -0.432
  539    HA   SER   1           HA       SER   1  -9.429  14.990  -2.802
  540   1HB   SER   1          1HB       SER   1  -6.746  13.906  -2.019
  541   2HB   SER   1          2HB       SER   1  -7.562  13.213  -3.420
  542    HG   SER   1           HG       SER   1  -6.195  15.038  -3.892
  543    HA   PRO   2           HA       PRO   2 -11.786  11.393  -1.957
  544   1HB   PRO   2          1HB       PRO   2 -11.428  10.221  -4.568
  545   2HB   PRO   2          2HB       PRO   2 -12.827  11.116  -3.963
  546   1HG   PRO   2          1HG       PRO   2 -10.863  11.998  -5.885
  547   2HG   PRO   2          2HG       PRO   2 -12.261  12.893  -5.278
  548   1HD   PRO   2          1HD       PRO   2  -9.474  13.332  -4.667
  549   2HD   PRO   2          2HD       PRO   2 -10.878  14.231  -4.059
  550    H    TYR   3           H        TYR   3 -10.901   9.800  -0.704
  551    HA   TYR   3           HA       TYR   3  -8.290   8.692  -1.131
  552   1HB   TYR   3          1HB       TYR   3 -10.640   7.916   0.591
  553   2HB   TYR   3          2HB       TYR   3  -9.204   6.896   0.513
  554    HD1  TYR   3           HD2      TYR   3 -10.249  10.464   1.071
  555    HD2  TYR   3           HD1      TYR   3  -7.343   7.374   1.876
  556    HE1  TYR   3           HE2      TYR   3  -9.088  11.975   2.678
  557    HE2  TYR   3           HE1      TYR   3  -6.183   8.884   3.485
  558    HH   TYR   3           HH       TYR   3  -7.430  11.383   4.892
  559    H    SER   4           H        SER   4 -11.538   7.626  -2.051
  560    HA   SER   4           HA       SER   4 -12.224   5.911  -3.497
  561   1HB   SER   4          1HB       SER   4 -10.130   7.210  -4.728
  562   2HB   SER   4          2HB       SER   4  -9.580   5.535  -4.736
  563    HG   SER   4           HG       SER   4 -10.825   5.896  -6.553
  564    H    SER   5           H        SER   5 -11.273   3.602  -4.355
  565    HA   SER   5           HA       SER   5  -9.713   2.347  -2.152
  566   1HB   SER   5          1HB       SER   5 -12.313   1.208  -3.222
  567   2HB   SER   5          2HB       SER   5 -11.321   0.540  -1.926
  568    HG   SER   5           HG       SER   5 -11.828   2.259  -0.648
  569    H    ASP   6           H        ASP   6  -7.958   1.813  -3.439
  570    HA   ASP   6           HA       ASP   6  -8.393  -0.293  -5.446
  571   1HB   ASP   6          2HB       ASP   6  -7.240   0.906  -7.250
  572   2HB   ASP   6          1HB       ASP   6  -8.649   1.829  -6.735
  573    H    THR   7           H        THR   7  -5.800  -0.175  -6.582
  574    HA   THR   7           HA       THR   7  -4.284  -1.068  -4.220
  575    HB   THR   7           HB       THR   7  -2.647  -1.755  -6.194
  576    HG1  THR   7           HG1      THR   7  -3.712  -2.021  -8.099
  577   1HG2  THR   7          2HG2      THR   7  -5.295  -3.077  -5.538
  578   2HG2  THR   7          3HG2      THR   7  -4.003  -3.868  -6.442
  579   3HG2  THR   7          1HG2      THR   7  -3.737  -3.378  -4.769
  580    H    THR   8           H        THR   8  -1.695  -0.669  -4.864
  581    HA   THR   8           HA       THR   8  -1.164   1.998  -5.889
  582    HB   THR   8           HB       THR   8  -0.724   1.593  -2.919
  583    HG1  THR   8           HG1      THR   8  -2.854   1.765  -2.981
  584   1HG2  THR   8          2HG2      THR   8   0.604   3.272  -4.412
  585   2HG2  THR   8          3HG2      THR   8  -0.900   4.192  -4.428
  586   3HG2  THR   8          1HG2      THR   8  -0.090   3.854  -2.898
  587    HA   PRO   9           HA       PRO   9   2.576  -0.377  -6.440
  588   1HB   PRO   9          1HB       PRO   9   3.948   2.022  -7.280
  589   2HB   PRO   9          2HB       PRO   9   3.358   0.701  -8.295
  590   1HG   PRO   9          2HG       PRO   9   2.259   3.353  -8.059
  591   2HG   PRO   9          1HG       PRO   9   1.661   2.040  -9.046
  592   1HD   PRO   9          2HD       PRO   9   0.519   3.103  -6.647
  593   2HD   PRO   9          1HD       PRO   9  -0.100   1.802  -7.652
  594    H    CYS  10           H        CYS  10   3.638  -0.834  -4.527
  595    HA   CYS  10           HA       CYS  10   5.162   1.352  -3.235
  596   1HB   CYS  10          2HB       CYS  10   2.847  -0.101  -2.043
  597   2HB   CYS  10          1HB       CYS  10   4.201   0.256  -1.002
  598    H    CYS  11           H        CYS  11   6.832   0.617  -1.861
  599    HA   CYS  11           HA       CYS  11   7.565  -2.208  -2.389
  600   1HB   CYS  11          1HB       CYS  11   9.292  -0.713  -3.146
  601   2HB   CYS  11          2HB       CYS  11   9.258   0.202  -1.642
  602    H    PHE  12           H        PHE  12   8.241  -3.530  -0.578
  603    HA   PHE  12           HA       PHE  12   7.249  -2.499   2.047
  604   1HB   PHE  12          1HB       PHE  12   7.002  -4.896   2.670
  605   2HB   PHE  12          2HB       PHE  12   6.031  -4.471   1.261
  606    HD1  PHE  12           HD1      PHE  12   6.639  -5.248  -0.990
  607    HD2  PHE  12           HD2      PHE  12   9.005  -6.300   2.465
  608    HE1  PHE  12           HE1      PHE  12   7.795  -7.012  -2.319
  609    HE2  PHE  12           HE2      PHE  12  10.164  -8.061   1.135
  610    HZ   PHE  12           HZ       PHE  12   9.559  -8.418  -1.258
  611    H    ALA  13           H        ALA  13   9.909  -4.202   0.448
  612    HA   ALA  13           HA       ALA  13  11.622  -3.521   2.794
  613   1HB   ALA  13          2HB       ALA  13  11.028  -5.952   2.842
  614   2HB   ALA  13          3HB       ALA  13  11.753  -6.122   1.243
  615   3HB   ALA  13          1HB       ALA  13  12.757  -5.673   2.623
  616    H    TYR  14           H        TYR  14  13.686  -2.816   2.256
  617    HA   TYR  14           HA       TYR  14  14.144  -2.584  -0.661
  618   1HB   TYR  14          1HB       TYR  14  15.728  -0.630   0.194
  619   2HB   TYR  14          2HB       TYR  14  14.027  -0.364  -0.093
  620    HD1  TYR  14           HD1      TYR  14  12.387  -0.624   1.887
  621    HD2  TYR  14           HD2      TYR  14  16.672  -0.317   2.340
  622    HE1  TYR  14           HE1      TYR  14  12.094  -0.078   4.288
  623    HE2  TYR  14           HE2      TYR  14  16.373   0.240   4.749
  624    HH   TYR  14           HH       TYR  14  13.190   0.103   6.295
  625    H    ILE  15           H        ILE  15  16.275  -2.945  -1.472
  626    HA   ILE  15           HA       ILE  15  17.785  -4.938  -0.037
  627    HB   ILE  15           HB       ILE  15  17.718  -4.834  -2.510
  628   1HG1  ILE  15          1HG1      ILE  15  20.561  -4.270  -1.690
  629   2HG1  ILE  15          2HG1      ILE  15  19.734  -5.713  -1.106
  630   1HG2  ILE  15          2HG2      ILE  15  18.271  -2.096  -2.039
  631   2HG2  ILE  15          3HG2      ILE  15  19.676  -2.749  -2.881
  632   3HG2  ILE  15          1HG2      ILE  15  18.072  -2.895  -3.598
  633   1HD1  ILE  15          1HD1      ILE  15  19.342  -5.307  -3.971
  634   2HD1  ILE  15          2HD1      ILE  15  21.048  -5.460  -3.550
  635   3HD1  ILE  15          3HD1      ILE  15  19.913  -6.738  -3.112
  636    H    ALA  16           H        ALA  16  20.149  -4.649   0.481
  637    HA   ALA  16           HA       ALA  16  20.540  -2.005   1.790
  638   1HB   ALA  16          1HB       ALA  16  21.720  -4.745   2.251
  639   2HB   ALA  16          2HB       ALA  16  22.400  -3.298   2.994
  640   3HB   ALA  16          3HB       ALA  16  20.742  -3.782   3.357
  641    H    ARG  17           H        ARG  17  21.135  -1.082  -0.349
  642    HA   ARG  17           HA       ARG  17  23.886  -0.692  -0.683
  643   1HB   ARG  17          2HB       ARG  17  23.074  -3.234  -1.709
  644   2HB   ARG  17          1HB       ARG  17  23.490  -2.201  -3.076
  645   1HG   ARG  17          1HG       ARG  17  25.693  -2.248  -2.561
  646   2HG   ARG  17          2HG       ARG  17  25.377  -1.927  -0.856
  647   1HD   ARG  17          1HD       ARG  17  25.655  -4.102  -0.337
  648   2HD   ARG  17          2HD       ARG  17  24.489  -4.591  -1.566
  649    HE   ARG  17           HE       ARG  17  27.381  -4.105  -2.165
  650   1HH1  ARG  17          2HH1      ARG  17  24.450  -6.284  -2.928
  651   2HH1  ARG  17          1HH1      ARG  17  25.752  -7.295  -2.398
  652   1HH2  ARG  17          2HH2      ARG  17  27.740  -4.958  -4.337
  653   2HH2  ARG  17          1HH2      ARG  17  26.596  -6.105  -4.950
  654    HA   PRO  18           HA       PRO  18  21.677   2.390  -2.999
  655   1HB   PRO  18          1HB       PRO  18  24.094   3.467  -4.094
  656   2HB   PRO  18          2HB       PRO  18  23.135   4.112  -2.784
  657   1HG   PRO  18          2HG       PRO  18  25.694   2.783  -2.611
  658   2HG   PRO  18          1HG       PRO  18  24.755   3.510  -1.301
  659   1HD   PRO  18          1HD       PRO  18  25.150   0.715  -1.812
  660   2HD   PRO  18          2HD       PRO  18  24.141   1.445  -0.556
  661    H    LEU  19           H        LEU  19  22.066   3.360  -5.396
  662    HA   LEU  19           HA       LEU  19  22.523   1.007  -7.183
  663   1HB   LEU  19          2HB       LEU  19  20.494   3.225  -7.509
  664   2HB   LEU  19          1HB       LEU  19  20.678   1.854  -8.567
  665    HG   LEU  19           HG       LEU  19  19.851   1.797  -5.659
  666   1HD1  LEU  19          1HD1      LEU  19  18.344   2.255  -7.930
  667   2HD1  LEU  19          2HD1      LEU  19  18.155   0.519  -7.678
  668   3HD1  LEU  19          3HD1      LEU  19  17.719   1.649  -6.397
  669   1HD2  LEU  19          1HD2      LEU  19  21.000  -0.262  -7.395
  670   2HD2  LEU  19          2HD2      LEU  19  20.736  -0.289  -5.652
  671   3HD2  LEU  19          3HD2      LEU  19  19.425  -0.725  -6.748
  672    HA   PRO  20           HA       PRO  20  25.522   3.881  -8.910
  673   1HB   PRO  20          1HB       PRO  20  25.754   2.214 -11.258
  674   2HB   PRO  20          2HB       PRO  20  26.907   2.388  -9.930
  675   1HG   PRO  20          1HG       PRO  20  25.208   0.133 -10.495
  676   2HG   PRO  20          2HG       PRO  20  26.330   0.325  -9.143
  677   1HD   PRO  20          1HD       PRO  20  23.440   0.410  -9.086
  678   2HD   PRO  20          2HD       PRO  20  24.565   0.563  -7.723
  679    H    ARG  21           H        ARG  21  25.428   5.446 -10.619
  680    HA   ARG  21           HA       ARG  21  22.796   5.985 -11.655
  681   1HB   ARG  21          2HB       ARG  21  24.658   7.672 -11.169
  682   2HB   ARG  21          1HB       ARG  21  25.366   7.185 -12.690
  683   1HG   ARG  21          2HG       ARG  21  24.026   8.757 -13.623
  684   2HG   ARG  21          1HG       ARG  21  22.723   7.596 -13.371
  685   1HD   ARG  21          1HD       ARG  21  21.914   8.699 -11.508
  686   2HD   ARG  21          2HD       ARG  21  23.499   9.337 -11.070
  687    HE   ARG  21           HE       ARG  21  21.574  10.762 -12.574
  688   1HH1  ARG  21          2HH1      ARG  21  24.719  11.572 -11.708
  689   2HH1  ARG  21          1HH1      ARG  21  25.427  10.898 -13.138
  690   1HH2  ARG  21          2HH2      ARG  21  22.407  11.411 -14.863
  691   2HH2  ARG  21          1HH2      ARG  21  23.787  12.433 -14.630
  692    H    ALA  22           H        ALA  22  25.294   3.929 -12.789
  693    HA   ALA  22           HA       ALA  22  24.312   4.103 -15.587
  694   1HB   ALA  22          3HB       ALA  22  26.838   3.910 -14.744
  695   2HB   ALA  22          1HB       ALA  22  26.457   2.189 -14.772
  696   3HB   ALA  22          2HB       ALA  22  26.310   3.148 -16.245
  697    H    HIS  23           H        HIS  23  23.065   2.692 -13.032
  698    HA   HIS  23           HA       HIS  23  22.438   0.175 -14.518
  699   1HB   HIS  23          1HB       HIS  23  22.788   0.480 -11.522
  700   2HB   HIS  23          2HB       HIS  23  22.284  -0.993 -12.347
  701    HD2  HIS  23           HD2      HIS  23  25.434   1.395 -12.985
  702    HE1  HIS  23           HE1      HIS  23  26.681  -2.645 -12.987
  703    HE2  HIS  23           HE2      HIS  23  27.458  -0.233 -13.223
  704    H    ILE  24           H        ILE  24  21.185   3.031 -13.231
  705    HA   ILE  24           HA       ILE  24  18.543   1.715 -12.819
  706    HB   ILE  24           HB       ILE  24  18.988   4.544 -12.032
  707   1HG1  ILE  24          2HG1      ILE  24  19.736   2.258 -10.214
  708   2HG1  ILE  24          1HG1      ILE  24  20.934   3.185 -11.119
  709   1HG2  ILE  24          3HG2      ILE  24  17.033   2.471 -11.674
  710   2HG2  ILE  24          1HG2      ILE  24  17.607   3.020 -10.103
  711   3HG2  ILE  24          2HG2      ILE  24  16.924   4.178 -11.243
  712   1HD1  ILE  24          2HD1      ILE  24  19.521   5.213 -10.024
  713   2HD1  ILE  24          3HD1      ILE  24  19.258   3.982  -8.788
  714   3HD1  ILE  24          1HD1      ILE  24  20.900   4.472  -9.209
  715    H    LYS  25           H        LYS  25  16.675   3.297 -13.370
  716    HA   LYS  25           HA       LYS  25  17.308   4.751 -15.892
  717   1HB   LYS  25          1HB       LYS  25  15.999   2.356 -15.858
  718   2HB   LYS  25          2HB       LYS  25  14.643   3.477 -15.701
  719   1HG   LYS  25          1HG       LYS  25  14.774   3.675 -17.956
  720   2HG   LYS  25          2HG       LYS  25  16.190   4.679 -17.648
  721   1HD   LYS  25          1HD       LYS  25  17.679   2.981 -18.166
  722   2HD   LYS  25          2HD       LYS  25  16.547   1.709 -17.704
  723   1HE   LYS  25          1HE       LYS  25  15.405   1.804 -19.735
  724   2HE   LYS  25          2HE       LYS  25  15.898   3.468 -20.048
  725   1HZ   LYS  25          3HZ       LYS  25  17.884   1.289 -19.938
  726   2HZ   LYS  25          1HZ       LYS  25  17.023   1.613 -21.366
  727   3HZ   LYS  25          2HZ       LYS  25  18.014   2.810 -20.681
  728    H    GLU  26           H        GLU  26  15.080   4.379 -13.106
  729    HA   GLU  26           HA       GLU  26  14.631   7.268 -13.109
  730   1HB   GLU  26          2HB       GLU  26  12.840   6.956 -14.507
  731   2HB   GLU  26          1HB       GLU  26  12.806   5.260 -14.239
  732   1HG   GLU  26          2HG       GLU  26  10.788   5.820 -13.374
  733   2HG   GLU  26          1HG       GLU  26  11.728   5.956 -11.917
  734    H    TYR  27           H        TYR  27  12.929   7.615 -11.159
  735    HA   TYR  27           HA       TYR  27  13.316   5.509  -9.147
  736   1HB   TYR  27          2HB       TYR  27  14.270   6.906  -7.534
  737   2HB   TYR  27          1HB       TYR  27  15.013   7.528  -9.001
  738    HD1  TYR  27           HD2      TYR  27  14.267   9.665 -10.013
  739    HD2  TYR  27           HD1      TYR  27  12.565   8.192  -6.329
  740    HE1  TYR  27           HE2      TYR  27  13.259  11.904  -9.584
  741    HE2  TYR  27           HE1      TYR  27  11.542  10.427  -5.909
  742    HH   TYR  27           HH       TYR  27  10.926  12.415  -7.047
  743    H    PHE  28           H        PHE  28  11.735   6.148  -7.157
  744    HA   PHE  28           HA       PHE  28   9.515   7.796  -8.064
  745   1HB   PHE  28          1HB       PHE  28   8.933   5.818  -9.292
  746   2HB   PHE  28          2HB       PHE  28   9.236   4.789  -7.896
  747    HD1  PHE  28           HD2      PHE  28   7.028   7.552  -9.143
  748    HD2  PHE  28           HD1      PHE  28   7.521   4.315  -6.329
  749    HE1  PHE  28           HE2      PHE  28   4.668   7.845  -8.390
  750    HE2  PHE  28           HE1      PHE  28   5.170   4.617  -5.567
  751    HZ   PHE  28           HZ       PHE  28   3.738   6.376  -6.603
  752    H    TYR  29           H        TYR  29  10.124   8.837  -6.009
  753    HA   TYR  29           HA       TYR  29  10.173   7.579  -3.490
  754   1HB   TYR  29          2HB       TYR  29  10.814   9.913  -3.760
  755   2HB   TYR  29          1HB       TYR  29   9.184  10.342  -4.208
  756    HD1  TYR  29           HD1      TYR  29  10.804   8.352  -1.450
  757    HD2  TYR  29           HD2      TYR  29   7.972  11.425  -2.535
  758    HE1  TYR  29           HE1      TYR  29  10.199   8.643   0.950
  759    HE2  TYR  29           HE2      TYR  29   7.370  11.719  -0.135
  760    HH   TYR  29           HH       TYR  29   8.773  11.197   2.197
  761    H    THR  30           H        THR  30   8.624   6.810  -2.150
  762    HA   THR  30           HA       THR  30   6.014   6.184  -3.132
  763    HB   THR  30           HB       THR  30   6.839   6.355  -0.220
  764    HG1  THR  30           HG1      THR  30   8.339   5.078  -1.144
  765   1HG2  THR  30          3HG2      THR  30   4.829   4.625  -1.696
  766   2HG2  THR  30          1HG2      THR  30   5.183   4.539   0.030
  767   3HG2  THR  30          2HG2      THR  30   4.436   5.986  -0.646
  768    H    SER  31           H        SER  31   3.937   6.993  -2.231
  769    HA   SER  31           HA       SER  31   3.961   9.921  -2.087
  770   1HB   SER  31          1HB       SER  31   2.152   9.125  -3.351
  771   2HB   SER  31          2HB       SER  31   1.824   7.808  -2.226
  772    HG   SER  31           HG       SER  31   0.347   9.176  -1.577
  773    H    GLY  32           H        GLY  32   1.865   7.868  -0.103
  774   1HA   GLY  32          1HA       GLY  32   3.099   8.121   2.402
  775   2HA   GLY  32          2HA       GLY  32   2.155   9.596   2.186
  776    H    LYS  33           H        LYS  33   1.796   6.054   1.840
  777    HA   LYS  33           HA       LYS  33  -0.457   5.849   3.571
  778   1HB   LYS  33          1HB       LYS  33  -2.245   5.512   1.857
  779   2HB   LYS  33          2HB       LYS  33  -1.642   7.171   1.886
  780   1HG   LYS  33          2HG       LYS  33  -0.181   6.688  -0.025
  781   2HG   LYS  33          1HG       LYS  33  -0.700   5.021  -0.029
  782   1HD   LYS  33          2HD       LYS  33  -1.911   6.341  -1.731
  783   2HD   LYS  33          1HD       LYS  33  -3.003   5.716  -0.520
  784   1HE   LYS  33          1HE       LYS  33  -3.404   7.797   0.397
  785   2HE   LYS  33          2HE       LYS  33  -1.803   8.402  -0.028
  786   1HZ   LYS  33          1HZ       LYS  33  -2.892   7.942  -2.441
  787   2HZ   LYS  33          2HZ       LYS  33  -4.253   8.437  -1.553
  788   3HZ   LYS  33          3HZ       LYS  33  -2.893   9.448  -1.656
  789    H    CYS  34           H        CYS  34   1.913   4.383   3.018
  790    HA   CYS  34           HA       CYS  34   0.716   1.793   2.137
  791   1HB   CYS  34          2HB       CYS  34   3.161   3.191   1.152
  792   2HB   CYS  34          1HB       CYS  34   3.242   1.439   1.323
  793    H    SER  35           H        SER  35   2.141   3.413   4.666
  794    HA   SER  35           HA       SER  35   3.230   2.684   6.617
  795   1HB   SER  35          1HB       SER  35   1.411   0.626   5.809
  796   2HB   SER  35          2HB       SER  35   2.876  -0.142   6.421
  797    HG   SER  35           HG       SER  35   1.040   1.509   7.714
  798    H    ASN  36           H        ASN  36   4.567   2.574   3.870
  799    HA   ASN  36           HA       ASN  36   7.012   1.197   4.778
  800   1HB   ASN  36          1HB       ASN  36   5.645   0.453   2.178
  801   2HB   ASN  36          2HB       ASN  36   7.204  -0.128   2.710
  802   1HD2  ASN  36          1HD2      ASN  36   4.002  -2.154   3.866
  803   2HD2  ASN  36          2HD2      ASN  36   4.058  -1.106   2.532
  804    HA   PRO  37           HA       PRO  37   7.225   5.235   2.320
  805   1HB   PRO  37          1HB       PRO  37   9.067   6.136   4.372
  806   2HB   PRO  37          2HB       PRO  37   7.502   6.824   3.927
  807   1HG   PRO  37          2HG       PRO  37   8.133   5.310   6.284
  808   2HG   PRO  37          1HG       PRO  37   6.571   5.945   5.816
  809   1HD   PRO  37          1HD       PRO  37   7.426   3.196   5.811
  810   2HD   PRO  37          2HD       PRO  37   5.844   3.841   5.332
  811    H    ALA  38           H        ALA  38   8.820   5.338   0.784
  812    HA   ALA  38           HA       ALA  38  11.597   4.754   1.340
  813   1HB   ALA  38          3HB       ALA  38  10.139   2.483   1.095
  814   2HB   ALA  38          1HB       ALA  38  10.529   2.779  -0.598
  815   3HB   ALA  38          2HB       ALA  38  11.824   2.603   0.586
  816    H    VAL  39           H        VAL  39  12.158   3.840  -1.378
  817    HA   VAL  39           HA       VAL  39  11.020   5.899  -3.129
  818    HB   VAL  39           HB       VAL  39  13.315   6.532  -1.766
  819   1HG1  VAL  39          2HG1      VAL  39  14.592   4.770  -2.987
  820   2HG1  VAL  39          3HG1      VAL  39  14.236   5.620  -4.491
  821   3HG1  VAL  39          1HG1      VAL  39  15.211   6.400  -3.245
  822   1HG2  VAL  39          2HG2      VAL  39  12.173   7.430  -4.377
  823   2HG2  VAL  39          3HG2      VAL  39  12.204   8.267  -2.825
  824   3HG2  VAL  39          1HG2      VAL  39  13.678   8.146  -3.787
  825    H    VAL  40           H        VAL  40  10.864   5.010  -5.131
  826    HA   VAL  40           HA       VAL  40  12.018   2.293  -5.322
  827    HB   VAL  40           HB       VAL  40   9.546   3.549  -6.459
  828   1HG1  VAL  40          2HG1      VAL  40  11.196   1.433  -7.664
  829   2HG1  VAL  40          3HG1      VAL  40   9.518   0.967  -7.395
  830   3HG1  VAL  40          1HG1      VAL  40   9.895   2.382  -8.377
  831   1HG2  VAL  40          2HG2      VAL  40  10.245   1.082  -4.855
  832   2HG2  VAL  40          3HG2      VAL  40   9.384   2.514  -4.286
  833   3HG2  VAL  40          1HG2      VAL  40   8.619   1.430  -5.448
  834    H    PHE  41           H        PHE  41  13.809   2.148  -6.441
  835    HA   PHE  41           HA       PHE  41  14.260   3.999  -8.686
  836   1HB   PHE  41          1HB       PHE  41  15.977   2.287  -6.963
  837   2HB   PHE  41          2HB       PHE  41  16.529   2.573  -8.592
  838    HD1  PHE  41           HD2      PHE  41  15.544   4.219  -5.406
  839    HD2  PHE  41           HD1      PHE  41  17.350   4.739  -9.287
  840    HE1  PHE  41           HE2      PHE  41  16.404   6.457  -4.721
  841    HE2  PHE  41           HE1      PHE  41  18.228   6.950  -8.595
  842    HZ   PHE  41           HZ       PHE  41  17.789   7.792  -6.296
  843    H    VAL  42           H        VAL  42  13.234   3.339 -10.422
  844    HA   VAL  42           HA       VAL  42  12.862   0.560 -11.134
  845    HB   VAL  42           HB       VAL  42  12.491   1.772 -13.483
  846   1HG1  VAL  42          2HG2      VAL  42  10.891   0.639 -11.738
  847   2HG1  VAL  42          3HG2      VAL  42  10.481   2.304 -11.325
  848   3HG1  VAL  42          1HG2      VAL  42  10.204   1.707 -12.964
  849   1HG2  VAL  42          3HG1      VAL  42  13.326   3.951 -12.556
  850   2HG2  VAL  42          1HG1      VAL  42  11.752   3.991 -13.344
  851   3HG2  VAL  42          2HG1      VAL  42  11.857   3.994 -11.585
  852    H    THR  43           H        THR  43  15.044  -0.311 -11.054
  853    HA   THR  43           HA       THR  43  16.973   0.857 -13.014
  854    HB   THR  43           HB       THR  43  18.717   0.229 -11.621
  855    HG1  THR  43           HG1      THR  43  18.679  -1.868 -11.424
  856   1HG2  THR  43          1HG2      THR  43  16.560   1.284 -10.219
  857   2HG2  THR  43          2HG2      THR  43  17.046  -0.101  -9.248
  858   3HG2  THR  43          3HG2      THR  43  18.214   1.163  -9.630
  859    H    ARG  44           H        ARG  44  18.189  -0.480 -14.350
  860    HA   ARG  44           HA       ARG  44  18.183  -2.073 -16.074
  861   1HB   ARG  44          1HB       ARG  44  18.174  -3.835 -13.621
  862   2HB   ARG  44          2HB       ARG  44  18.726  -4.316 -15.203
  863   1HG   ARG  44          1HG       ARG  44  19.899  -1.965 -13.717
  864   2HG   ARG  44          2HG       ARG  44  20.536  -3.602 -13.567
  865   1HD   ARG  44          1HD       ARG  44  20.128  -2.843 -16.355
  866   2HD   ARG  44          2HD       ARG  44  21.239  -1.752 -15.527
  867    HE   ARG  44           HE       ARG  44  21.738  -4.638 -15.156
  868   1HH1  ARG  44          1HH2      ARG  44  22.797  -3.384 -18.215
  869   2HH1  ARG  44          2HH2      ARG  44  23.046  -1.883 -17.388
  870   1HH2  ARG  44          1HH1      ARG  44  24.149  -4.324 -14.825
  871   2HH2  ARG  44          2HH1      ARG  44  24.963  -3.732 -16.234
  872    H    LYS  45           H        LYS  45  16.232  -2.110 -17.153
  873    HA   LYS  45           HA       LYS  45  14.289  -3.180 -17.961
  874   1HB   LYS  45          1HB       LYS  45  15.210  -5.160 -16.241
  875   2HB   LYS  45          2HB       LYS  45  13.605  -4.779 -15.613
  876   1HG   LYS  45          1HG       LYS  45  12.860  -6.169 -17.253
  877   2HG   LYS  45          2HG       LYS  45  13.157  -4.799 -18.323
  878   1HD   LYS  45          1HD       LYS  45  15.518  -5.651 -18.612
  879   2HD   LYS  45          2HD       LYS  45  15.035  -7.101 -17.733
  880   1HE   LYS  45          1HE       LYS  45  13.263  -7.517 -19.413
  881   2HE   LYS  45          2HE       LYS  45  13.775  -6.081 -20.299
  882   1HZ   LYS  45          3HZ       LYS  45  16.021  -7.131 -20.426
  883   2HZ   LYS  45          1HZ       LYS  45  15.331  -8.557 -19.817
  884   3HZ   LYS  45          2HZ       LYS  45  14.813  -7.933 -21.308
  885    H    ASN  46           H        ASN  46  14.786  -1.357 -15.209
  886    HA   ASN  46           HA       ASN  46  13.478   0.118 -14.022
  887   1HB   ASN  46          2HB       ASN  46  12.035  -0.340 -16.605
  888   2HB   ASN  46          1HB       ASN  46  11.158   0.484 -15.321
  889   1HD2  ASN  46          1HD2      ASN  46  12.923   3.148 -14.863
  890   2HD2  ASN  46          2HD2      ASN  46  11.601   3.051 -15.923
  891    H    ARG  47           H        ARG  47  13.087  -2.872 -13.603
  892    HA   ARG  47           HA       ARG  47  10.342  -3.295 -12.863
  893   1HB   ARG  47          2HB       ARG  47  12.888  -4.314 -11.559
  894   2HB   ARG  47          1HB       ARG  47  11.275  -4.894 -11.168
  895   1HG   ARG  47          1HG       ARG  47  11.020  -5.442 -13.653
  896   2HG   ARG  47          2HG       ARG  47  12.754  -5.153 -13.794
  897   1HD   ARG  47          1HD       ARG  47  12.214  -6.863 -11.526
  898   2HD   ARG  47          2HD       ARG  47  11.485  -7.540 -12.983
  899    HE   ARG  47           HE       ARG  47  14.337  -6.684 -13.059
  900   1HH1  ARG  47          2HH1      ARG  47  12.014  -9.465 -13.821
  901   2HH1  ARG  47          1HH1      ARG  47  12.978  -9.165 -15.229
  902   1HH2  ARG  47          1HH2      ARG  47  15.724  -8.721 -13.188
  903   2HH2  ARG  47          2HH2      ARG  47  14.783 -10.151 -12.926
  904    H    GLN  48           H        GLN  48   9.255  -2.498 -10.966
  905    HA   GLN  48           HA       GLN  48  10.483  -0.150  -9.907
  906   1HB   GLN  48          1HB       GLN  48   7.870  -1.471  -9.588
  907   2HB   GLN  48          2HB       GLN  48   8.411  -0.502  -8.209
  908   1HG   GLN  48          1HG       GLN  48   8.852   1.396  -9.679
  909   2HG   GLN  48          2HG       GLN  48   8.442   0.439 -11.093
  910   1HE2  GLN  48          2HE2      GLN  48   5.487   2.512  -9.865
  911   2HE2  GLN  48          1HE2      GLN  48   6.936   2.770 -10.711
  912    H    VAL  49           H        VAL  49  12.278  -0.569  -8.951
  913    HA   VAL  49           HA       VAL  49  12.500  -2.685  -6.928
  914    HB   VAL  49           HB       VAL  49  14.778  -0.894  -7.435
  915   1HG1  VAL  49          3HG1      VAL  49  14.271  -3.860  -7.267
  916   2HG1  VAL  49          1HG1      VAL  49  15.851  -3.203  -7.692
  917   3HG1  VAL  49          2HG1      VAL  49  15.144  -2.844  -6.117
  918   1HG2  VAL  49          2HG2      VAL  49  13.725  -2.737  -9.620
  919   2HG2  VAL  49          3HG2      VAL  49  13.873  -0.991  -9.753
  920   3HG2  VAL  49          1HG2      VAL  49  15.316  -1.988  -9.631
  921    H    CYS  50           H        CYS  50  13.972  -1.866  -4.948
  922    HA   CYS  50           HA       CYS  50  12.673   0.623  -3.924
  923   1HB   CYS  50          2HB       CYS  50  13.944  -1.511  -2.223
  924   2HB   CYS  50          1HB       CYS  50  12.788  -0.296  -1.727
  925    H    ALA  51           H        ALA  51  14.275   1.323  -1.879
  926    HA   ALA  51           HA       ALA  51  17.046   0.987  -2.053
  927   1HB   ALA  51          3HB       ALA  51  16.038   2.486  -4.288
  928   2HB   ALA  51          1HB       ALA  51  17.036   3.546  -3.292
  929   3HB   ALA  51          2HB       ALA  51  17.706   2.044  -3.928
  930    H    ASN  52           H        ASN  52  14.899   1.748  -0.150
  931    HA   ASN  52           HA       ASN  52  14.807   3.051   1.793
  932   1HB   ASN  52          1HB       ASN  52  17.297   2.520   1.720
  933   2HB   ASN  52          2HB       ASN  52  17.519   4.089   0.942
  934   1HD2  ASN  52          2HD2      ASN  52  17.667   3.887   4.780
  935   2HD2  ASN  52          1HD2      ASN  52  16.801   2.577   4.136
  936    HA   PRO  53           HA       PRO  53  13.460   6.931   0.091
  937   1HB   PRO  53          1HB       PRO  53  12.412   7.960   2.434
  938   2HB   PRO  53          2HB       PRO  53  11.585   6.783   1.433
  939   1HG   PRO  53          2HG       PRO  53  12.874   6.407   4.068
  940   2HG   PRO  53          1HG       PRO  53  11.665   5.394   3.267
  941   1HD   PRO  53          1HD       PRO  53  14.490   4.910   3.457
  942   2HD   PRO  53          2HD       PRO  53  13.292   3.954   2.562
  943    H    GLU  54           H        GLU  54  14.556   7.417   3.462
  944    HA   GLU  54           HA       GLU  54  15.725  10.001   2.746
  945   1HB   GLU  54          1HB       GLU  54  15.270   8.478   5.290
  946   2HB   GLU  54          2HB       GLU  54  16.379   9.849   5.284
  947   1HG   GLU  54          1HG       GLU  54  14.584  11.265   4.310
  948   2HG   GLU  54          2HG       GLU  54  13.479   9.894   4.393
  949    H    LYS  55           H        LYS  55  17.055   7.206   1.994
  950    HA   LYS  55           HA       LYS  55  19.561   7.241   3.428
  951   1HB   LYS  55          2HB       LYS  55  18.432   5.769   1.191
  952   2HB   LYS  55          1HB       LYS  55  20.121   6.187   0.901
  953   1HG   LYS  55          1HG       LYS  55  19.502   5.211   3.630
  954   2HG   LYS  55          2HG       LYS  55  19.332   4.016   2.344
  955   1HD   LYS  55          1HD       LYS  55  21.601   4.330   1.634
  956   2HD   LYS  55          2HD       LYS  55  21.786   5.765   2.643
  957   1HE   LYS  55          1HE       LYS  55  21.203   3.008   3.756
  958   2HE   LYS  55          2HE       LYS  55  22.830   3.668   3.602
  959   1HZ   LYS  55          2HZ       LYS  55  22.088   5.575   4.953
  960   2HZ   LYS  55          3HZ       LYS  55  20.594   4.802   5.191
  961   3HZ   LYS  55          1HZ       LYS  55  22.019   4.101   5.793
  962    H    LYS  56           H        LYS  56  21.222   8.645   3.203
  963    HA   LYS  56           HA       LYS  56  21.118  11.061   1.876
  964   1HB   LYS  56          1HB       LYS  56  23.593   9.392   2.395
  965   2HB   LYS  56          2HB       LYS  56  23.594  11.118   2.035
  966   1HG   LYS  56          1HG       LYS  56  22.728  11.686   4.096
  967   2HG   LYS  56          2HG       LYS  56  21.830  10.178   4.252
  968   1HD   LYS  56          1HD       LYS  56  23.752   8.967   4.913
  969   2HD   LYS  56          2HD       LYS  56  24.847  10.215   4.317
  970   1HE   LYS  56          1HE       LYS  56  23.701  11.751   6.073
  971   2HE   LYS  56          2HE       LYS  56  23.127  10.247   6.793
  972   1HZ   LYS  56          3HZ       LYS  56  25.697   9.673   6.409
  973   2HZ   LYS  56          1HZ       LYS  56  25.808  11.346   6.683
  974   3HZ   LYS  56          2HZ       LYS  56  25.092  10.340   7.849
  975    H    TRP  57           H        TRP  57  21.815   7.973   0.362
  976    HA   TRP  57           HA       TRP  57  22.921   9.305  -2.019
  977   1HB   TRP  57          1HB       TRP  57  23.410   7.129  -2.847
  978   2HB   TRP  57          2HB       TRP  57  23.815   7.120  -1.130
  979    HD1  TRP  57           HD1      TRP  57  22.627   5.303   0.294
  980    HE1  TRP  57           HE1      TRP  57  20.972   3.416  -0.317
  981    HE3  TRP  57           HE3      TRP  57  21.243   6.894  -4.312
  982    HZ2  TRP  57           HZ2      TRP  57  19.213   2.720  -2.511
  983    HZ3  TRP  57           HZ3      TRP  57  19.670   5.603  -5.690
  984    HH2  TRP  57           HH2      TRP  57  18.638   3.523  -4.796
  985    H    VAL  58           H        VAL  58  19.965   7.441  -1.252
  986    HA   VAL  58           HA       VAL  58  18.861   7.423  -3.840
  987    HB   VAL  58           HB       VAL  58  16.584   7.740  -2.526
  988   1HG1  VAL  58          3HG1      VAL  58  17.701   5.678  -3.553
  989   2HG1  VAL  58          1HG1      VAL  58  18.254   5.320  -1.918
  990   3HG1  VAL  58          2HG1      VAL  58  16.530   5.401  -2.271
  991   1HG2  VAL  58          2HG2      VAL  58  17.716   8.565  -0.476
  992   2HG2  VAL  58          3HG2      VAL  58  16.714   7.144  -0.206
  993   3HG2  VAL  58          1HG2      VAL  58  18.459   6.981  -0.308
  994    H    ARG  59           H        ARG  59  18.529   9.993  -1.383
  995    HA   ARG  59           HA       ARG  59  16.947  11.694  -3.065
  996   1HB   ARG  59          2HB       ARG  59  18.712  12.262  -0.675
  997   2HB   ARG  59          1HB       ARG  59  17.794  13.512  -1.478
  998   1HG   ARG  59          2HG       ARG  59  15.788  11.843  -1.171
  999   2HG   ARG  59          1HG       ARG  59  16.797  11.154   0.077
 1000   1HD   ARG  59          1HD       ARG  59  16.695  13.051   1.407
 1001   2HD   ARG  59          2HD       ARG  59  16.436  14.123   0.030
 1002    HE   ARG  59           HE       ARG  59  14.326  12.394   1.247
 1003   1HH1  ARG  59          1HH1      ARG  59  14.753  13.868  -1.655
 1004   2HH1  ARG  59          2HH1      ARG  59  13.493  15.045  -1.495
 1005   1HH2  ARG  59          1HH2      ARG  59  13.084  14.604   1.878
 1006   2HH2  ARG  59          2HH2      ARG  59  12.202  14.987   0.438
 1007    H    GLU  60           H        GLU  60  20.384  11.110  -2.749
 1008    HA   GLU  60           HA       GLU  60  21.235  13.450  -4.244
 1009   1HB   GLU  60          2HB       GLU  60  22.482  11.266  -2.870
 1010   2HB   GLU  60          1HB       GLU  60  23.146  11.355  -4.483
 1011   1HG   GLU  60          2HG       GLU  60  22.822  13.983  -3.217
 1012   2HG   GLU  60          1HG       GLU  60  23.942  12.923  -2.360
 1013    H    TYR  61           H        TYR  61  19.928  10.370  -5.073
 1014    HA   TYR  61           HA       TYR  61  20.917  10.499  -7.863
 1015   1HB   TYR  61          1HB       TYR  61  19.558   8.476  -6.140
 1016   2HB   TYR  61          2HB       TYR  61  19.225   8.410  -7.869
 1017    HD1  TYR  61           HD2      TYR  61  21.962   8.398  -5.329
 1018    HD2  TYR  61           HD1      TYR  61  20.836   7.532  -9.404
 1019    HE1  TYR  61           HE2      TYR  61  24.115   7.209  -5.666
 1020    HE2  TYR  61           HE1      TYR  61  23.002   6.349  -9.746
 1021    HH   TYR  61           HH       TYR  61  25.618   6.661  -7.729
 1022    H    ILE  62           H        ILE  62  18.130  11.186  -5.897
 1023    HA   ILE  62           HA       ILE  62  16.174  11.266  -8.014
 1024    HB   ILE  62           HB       ILE  62  16.282  12.585  -5.283
 1025   1HG1  ILE  62          1HG1      ILE  62  14.553  10.273  -6.126
 1026   2HG1  ILE  62          2HG1      ILE  62  16.219   9.997  -5.628
 1027   1HG2  ILE  62          3HG2      ILE  62  14.350  12.779  -7.500
 1028   2HG2  ILE  62          1HG2      ILE  62  13.636  12.359  -5.943
 1029   3HG2  ILE  62          2HG2      ILE  62  14.581  13.839  -6.110
 1030   1HD1  ILE  62          1HD1      ILE  62  14.880  11.794  -3.785
 1031   2HD1  ILE  62          2HD1      ILE  62  13.985  10.283  -3.944
 1032   3HD1  ILE  62          3HD1      ILE  62  15.679  10.257  -3.455
 1033    H    ASN  63           H        ASN  63  18.599  13.501  -6.843
 1034    HA   ASN  63           HA       ASN  63  17.429  15.692  -8.479
 1035   1HB   ASN  63          2HB       ASN  63  19.491  15.567  -6.302
 1036   2HB   ASN  63          1HB       ASN  63  19.478  16.926  -7.398
 1037   1HD2  ASN  63          2HD2      ASN  63  17.018  18.622  -6.091
 1038   2HD2  ASN  63          1HD2      ASN  63  16.780  17.828  -7.571
 1039    H    SER  64           H        SER  64  20.130  13.467  -8.356
 1040    HA   SER  64           HA       SER  64  21.640  14.861 -10.439
 1041   1HB   SER  64          2HB       SER  64  22.624  13.355  -8.612
 1042   2HB   SER  64          1HB       SER  64  22.017  11.995  -9.554
 1043    HG   SER  64           HG       SER  64  24.188  12.570 -10.072
 1044    H    LEU  65           H        LEU  65  19.048  12.578 -10.341
 1045    HA   LEU  65           HA       LEU  65  19.469  11.141 -12.745
 1046   1HB   LEU  65          1HB       LEU  65  17.110  11.882 -11.093
 1047   2HB   LEU  65          2HB       LEU  65  16.780  11.398 -12.756
 1048    HG   LEU  65           HG       LEU  65  18.665   9.731 -11.132
 1049   1HD1  LEU  65          2HD1      LEU  65  16.259  10.350 -10.023
 1050   2HD1  LEU  65          3HD1      LEU  65  15.812   8.962 -11.015
 1051   3HD1  LEU  65          1HD1      LEU  65  17.072   8.802  -9.793
 1052   1HD2  LEU  65          3HD2      LEU  65  17.291   9.599 -13.645
 1053   2HD2  LEU  65          1HD2      LEU  65  18.475   8.473 -12.980
 1054   3HD2  LEU  65          2HD2      LEU  65  16.761   8.256 -12.632
 1055    H    GLU  66           H        GLU  66  19.147  11.660 -14.900
 1056    HA   GLU  66           HA       GLU  66  18.561  14.526 -15.469
 1057   1HB   GLU  66          1HB       GLU  66  20.711  13.612 -16.316
 1058   2HB   GLU  66          2HB       GLU  66  19.816  12.412 -17.248
 1059   1HG   GLU  66          1HG       GLU  66  18.596  14.342 -18.360
 1060   2HG   GLU  66          2HG       GLU  66  19.751  15.422 -17.579
 1061    H    MET  67           H        MET  67  17.995  11.389 -17.114
 1062    HA   MET  67           HA       MET  67  15.133  11.814 -17.241
 1063   1HB   MET  67          1HB       MET  67  15.916  13.467 -18.943
 1064   2HB   MET  67          2HB       MET  67  16.686  12.149 -19.825
 1065   1HG   MET  67          1HG       MET  67  14.630  11.157 -20.387
 1066   2HG   MET  67          2HG       MET  67  13.766  11.998 -19.099
 1067   1HE   MET  67          1HE       MET  67  12.045  12.526 -20.185
 1068   2HE   MET  67          3HE       MET  67  12.109  14.279 -20.010
 1069   3HE   MET  67          2HE       MET  67  11.796  13.562 -21.590
 1070    H    SER  68           H        SER  68  17.721  10.320 -19.229
 1071    HA   SER  68           HA       SER  68  16.959   7.648 -18.386
 1072   1HB   SER  68          1HB       SER  68  16.460   7.076 -20.932
 1073   2HB   SER  68          2HB       SER  68  15.173   7.636 -19.866
 1074    HG   SER  68           HG       SER  68  14.968   9.254 -21.157
   
  No H/Q in entry =        1074
  Start of MODEL   10
    1    H    SER   1           H        SER   1   8.999 -15.986  -2.752
    2    HA   SER   1           HA       SER   1  11.365 -14.384  -3.571
    3   1HB   SER   1          1HB       SER   1   9.013 -13.896  -4.809
    4   2HB   SER   1          2HB       SER   1   8.800 -12.892  -3.375
    5    HG   SER   1           HG       SER   1   9.890 -11.571  -4.654
    6    HA   PRO   2           HA       PRO   2  10.396 -14.410   1.000
    7   1HB   PRO   2          1HB       PRO   2  13.246 -14.532   1.430
    8   2HB   PRO   2          2HB       PRO   2  12.039 -15.766   1.809
    9   1HG   PRO   2          1HG       PRO   2  14.001 -15.805  -0.307
   10   2HG   PRO   2          2HG       PRO   2  12.792 -17.038   0.069
   11   1HD   PRO   2          1HD       PRO   2  12.817 -15.200  -2.155
   12   2HD   PRO   2          2HD       PRO   2  11.604 -16.439  -1.780
   13    H    TYR   3           H        TYR   3  13.128 -12.874  -0.728
   14    HA   TYR   3           HA       TYR   3  12.716 -10.440   0.950
   15   1HB   TYR   3          1HB       TYR   3  15.057 -11.569  -0.549
   16   2HB   TYR   3          2HB       TYR   3  14.970  -9.826  -0.287
   17    HD1  TYR   3           HD2      TYR   3  14.075  -9.245   2.258
   18    HD2  TYR   3           HD1      TYR   3  16.278 -12.756   1.047
   19    HE1  TYR   3           HE2      TYR   3  14.863  -9.560   4.602
   20    HE2  TYR   3           HE1      TYR   3  17.066 -13.071   3.392
   21    HH   TYR   3           HH       TYR   3  17.284 -11.044   5.550
   22    H    SER   4           H        SER   4  11.904  -8.618   0.001
   23    HA   SER   4           HA       SER   4  11.523  -8.692  -2.961
   24   1HB   SER   4          1HB       SER   4   9.695  -8.208  -0.859
   25   2HB   SER   4          2HB       SER   4   9.965  -6.650  -1.641
   26    HG   SER   4           HG       SER   4   8.362  -8.404  -2.494
   27    H    SER   5           H        SER   5  12.010  -6.791  -4.158
   28    HA   SER   5           HA       SER   5  13.292  -4.549  -2.706
   29   1HB   SER   5          1HB       SER   5  15.203  -4.671  -4.425
   30   2HB   SER   5          2HB       SER   5  15.225  -5.877  -3.138
   31    HG   SER   5           HG       SER   5  15.521  -6.949  -5.048
   32    H    ASP   6           H        ASP   6  10.821  -4.451  -3.952
   33    HA   ASP   6           HA       ASP   6  11.256  -2.387  -5.924
   34   1HB   ASP   6          1HB       ASP   6  10.373  -3.527  -7.875
   35   2HB   ASP   6          2HB       ASP   6  11.715  -4.455  -7.263
   36    H    THR   7           H        THR   7   8.687  -2.853  -7.274
   37    HA   THR   7           HA       THR   7   7.029  -1.541  -5.350
   38    HB   THR   7           HB       THR   7   6.627  -0.973  -7.613
   39    HG1  THR   7           HG1      THR   7   4.681  -1.083  -6.660
   40   1HG2  THR   7          2HG2      THR   7   6.571  -3.955  -8.049
   41   2HG2  THR   7          3HG2      THR   7   5.848  -2.853  -9.223
   42   3HG2  THR   7          1HG2      THR   7   7.569  -2.743  -8.855
   43    H    THR   8           H        THR   8   4.645  -2.433  -5.084
   44    HA   THR   8           HA       THR   8   4.509  -5.351  -4.750
   45    HB   THR   8           HB       THR   8   4.026  -3.654  -2.307
   46    HG1  THR   8           HG1      THR   8   6.476  -4.864  -3.058
   47   1HG2  THR   8          2HG2      THR   8   3.274  -6.075  -2.513
   48   2HG2  THR   8          3HG2      THR   8   4.981  -6.512  -2.581
   49   3HG2  THR   8          1HG2      THR   8   4.328  -5.728  -1.143
   50    HA   PRO   9           HA       PRO   9   0.488  -3.787  -6.078
   51   1HB   PRO   9          1HB       PRO   9  -0.448  -6.529  -5.933
   52   2HB   PRO   9          2HB       PRO   9  -0.151  -5.550  -7.375
   53   1HG   PRO   9          1HG       PRO   9   1.456  -7.727  -6.361
   54   2HG   PRO   9          2HG       PRO   9   1.758  -6.743  -7.793
   55   1HD   PRO   9          1HD       PRO   9   3.187  -6.705  -5.331
   56   2HD   PRO   9          2HD       PRO   9   3.439  -5.679  -6.734
   57    H    CYS  10           H        CYS  10   0.032  -2.772  -4.067
   58    HA   CYS  10           HA       CYS  10  -1.418  -4.485  -2.089
   59   1HB   CYS  10          2HB       CYS  10   0.851  -2.663  -1.744
   60   2HB   CYS  10          1HB       CYS  10  -0.453  -2.343  -0.641
   61    H    CYS  11           H        CYS  11  -3.341  -3.689  -1.412
   62    HA   CYS  11           HA       CYS  11  -4.274  -1.254  -2.741
   63   1HB   CYS  11          2HB       CYS  11  -6.223  -2.350  -2.801
   64   2HB   CYS  11          1HB       CYS  11  -5.553  -3.652  -1.865
   65    H    PHE  12           H        PHE  12  -5.021   0.620  -1.578
   66    HA   PHE  12           HA       PHE  12  -3.725   0.864   1.088
   67   1HB   PHE  12          2HB       PHE  12  -3.043   2.544  -0.543
   68   2HB   PHE  12          1HB       PHE  12  -4.725   2.961  -0.862
   69    HD1  PHE  12           HD1      PHE  12  -3.165   2.220   2.456
   70    HD2  PHE  12           HD2      PHE  12  -4.832   5.238  -0.143
   71    HE1  PHE  12           HE1      PHE  12  -3.140   3.854   4.338
   72    HE2  PHE  12           HE2      PHE  12  -4.803   6.873   1.739
   73    HZ   PHE  12           HZ       PHE  12  -3.959   6.181   3.980
   74    H    ALA  13           H        ALA  13  -6.563   2.534  -0.283
   75    HA   ALA  13           HA       ALA  13  -7.978   1.963   2.276
   76   1HB   ALA  13          2HB       ALA  13  -8.048   4.180   0.297
   77   2HB   ALA  13          3HB       ALA  13  -9.583   3.754   1.055
   78   3HB   ALA  13          1HB       ALA  13  -8.209   4.238   2.052
   79    H    TYR  14           H        TYR  14 -10.116   1.146   2.251
   80    HA   TYR  14           HA       TYR  14 -10.730  -0.240  -0.290
   81   1HB   TYR  14          2HB       TYR  14 -12.341  -1.509   1.496
   82   2HB   TYR  14          1HB       TYR  14 -10.746  -2.057   1.054
   83    HD1  TYR  14           HD2      TYR  14  -8.731  -1.271   2.456
   84    HD2  TYR  14           HD1      TYR  14 -12.840  -0.847   3.716
   85    HE1  TYR  14           HE2      TYR  14  -7.977  -0.928   4.799
   86    HE2  TYR  14           HE1      TYR  14 -12.081  -0.516   6.069
   87    HH   TYR  14           HH       TYR  14  -9.437   0.415   7.044
   88    H    ILE  15           H        ILE  15 -12.857  -0.205  -1.116
   89    HA   ILE  15           HA       ILE  15 -14.339   2.227  -0.417
   90    HB   ILE  15           HB       ILE  15 -14.012   1.566  -2.780
   91   1HG1  ILE  15          2HG1      ILE  15 -16.945   1.229  -2.181
   92   2HG1  ILE  15          1HG1      ILE  15 -16.136   2.760  -1.843
   93   1HG2  ILE  15          3HG2      ILE  15 -14.720  -0.987  -1.767
   94   2HG2  ILE  15          1HG2      ILE  15 -15.986  -0.528  -2.906
   95   3HG2  ILE  15          2HG2      ILE  15 -14.302  -0.570  -3.429
   96   1HD1  ILE  15          2HD1      ILE  15 -15.249   2.069  -4.400
   97   2HD1  ILE  15          3HD1      ILE  15 -16.959   1.632  -4.404
   98   3HD1  ILE  15          1HD1      ILE  15 -16.470   3.283  -4.016
   99    H    ALA  16           H        ALA  16 -16.505   2.268   0.322
  100    HA   ALA  16           HA       ALA  16 -17.319  -0.168   1.817
  101   1HB   ALA  16          1HB       ALA  16 -18.076   2.749   1.967
  102   2HB   ALA  16          2HB       ALA  16 -19.064   1.512   2.747
  103   3HB   ALA  16          3HB       ALA  16 -17.381   1.729   3.226
  104    H    ARG  17           H        ARG  17 -18.141  -1.382   0.023
  105    HA   ARG  17           HA       ARG  17 -20.884  -1.126  -0.549
  106   1HB   ARG  17          2HB       ARG  17 -19.393   0.790  -1.970
  107   2HB   ARG  17          1HB       ARG  17 -19.777  -0.454  -3.134
  108   1HG   ARG  17          1HG       ARG  17 -22.177  -0.292  -1.979
  109   2HG   ARG  17          2HG       ARG  17 -21.611   1.337  -1.606
  110   1HD   ARG  17          1HD       ARG  17 -21.388   0.210  -4.396
  111   2HD   ARG  17          2HD       ARG  17 -22.871   0.986  -3.843
  112    HE   ARG  17           HE       ARG  17 -20.679   2.711  -3.256
  113   1HH1  ARG  17          2HH1      ARG  17 -22.721   4.251  -4.718
  114   2HH1  ARG  17          1HH1      ARG  17 -22.968   3.362  -6.184
  115   1HH2  ARG  17          2HH2      ARG  17 -19.887   1.893  -6.093
  116   2HH2  ARG  17          1HH2      ARG  17 -20.277   3.473  -6.685
  117    HA   PRO  18           HA       PRO  18 -19.185  -5.206  -1.559
  118   1HB   PRO  18          2HB       PRO  18 -21.896  -6.063  -2.036
  119   2HB   PRO  18          1HB       PRO  18 -20.838  -6.517  -0.729
  120   1HG   PRO  18          1HG       PRO  18 -23.092  -4.730  -0.614
  121   2HG   PRO  18          2HG       PRO  18 -22.023  -5.205   0.709
  122   1HD   PRO  18          2HD       PRO  18 -22.154  -2.658  -0.582
  123   2HD   PRO  18          1HD       PRO  18 -21.015  -3.163   0.655
  124    H    LEU  19           H        LEU  19 -18.247  -4.845  -3.549
  125    HA   LEU  19           HA       LEU  19 -19.511  -3.904  -5.893
  126   1HB   LEU  19          2HB       LEU  19 -17.248  -5.902  -5.764
  127   2HB   LEU  19          1HB       LEU  19 -17.603  -4.831  -7.091
  128    HG   LEU  19           HG       LEU  19 -16.669  -4.053  -4.322
  129   1HD1  LEU  19          2HD1      LEU  19 -15.319  -4.679  -6.753
  130   2HD1  LEU  19          3HD1      LEU  19 -15.149  -2.946  -6.477
  131   3HD1  LEU  19          1HD1      LEU  19 -14.621  -4.091  -5.244
  132   1HD2  LEU  19          1HD2      LEU  19 -18.063  -2.517  -6.423
  133   2HD2  LEU  19          2HD2      LEU  19 -17.882  -2.163  -4.705
  134   3HD2  LEU  19          3HD2      LEU  19 -16.580  -1.768  -5.828
  135    HA   PRO  20           HA       PRO  20 -22.204  -7.416  -6.645
  136   1HB   PRO  20          1HB       PRO  20 -22.497  -6.573  -9.404
  137   2HB   PRO  20          2HB       PRO  20 -23.682  -6.465  -8.097
  138   1HG   PRO  20          1HG       PRO  20 -22.202  -4.311  -9.288
  139   2HG   PRO  20          2HG       PRO  20 -23.328  -4.217  -7.930
  140   1HD   PRO  20          1HD       PRO  20 -20.446  -3.984  -7.875
  141   2HD   PRO  20          2HD       PRO  20 -21.578  -3.849  -6.517
  142    H    ARG  21           H        ARG  21 -21.399  -9.425  -7.108
  143    HA   ARG  21           HA       ARG  21 -18.917  -9.970  -8.271
  144   1HB   ARG  21          2HB       ARG  21 -20.557 -11.557  -7.043
  145   2HB   ARG  21          1HB       ARG  21 -21.241 -11.852  -8.623
  146   1HG   ARG  21          2HG       ARG  21 -18.276 -12.024  -8.316
  147   2HG   ARG  21          1HG       ARG  21 -19.244 -13.344  -7.706
  148   1HD   ARG  21          2HD       ARG  21 -20.159 -12.522 -10.334
  149   2HD   ARG  21          1HD       ARG  21 -18.449 -12.951 -10.364
  150    HE   ARG  21           HE       ARG  21 -19.688 -14.999  -8.922
  151   1HH1  ARG  21          2HH1      ARG  21 -18.989 -14.426 -12.345
  152   2HH1  ARG  21          1HH1      ARG  21 -19.002 -16.149 -12.164
  153   1HH2  ARG  21          2HH2      ARG  21 -21.790 -15.939 -10.090
  154   2HH2  ARG  21          1HH2      ARG  21 -21.780 -15.728 -11.809
  155    H    ALA  22           H        ALA  22 -21.944  -9.265  -9.877
  156    HA   ALA  22           HA       ALA  22 -21.191 -10.308 -12.464
  157   1HB   ALA  22          2HB       ALA  22 -23.549  -9.726 -11.722
  158   2HB   ALA  22          3HB       ALA  22 -23.110  -8.029 -11.917
  159   3HB   ALA  22          1HB       ALA  22 -23.098  -9.109 -13.311
  160    H    HIS  23           H        HIS  23 -21.040  -7.064 -10.992
  161    HA   HIS  23           HA       HIS  23 -19.836  -5.827 -13.306
  162   1HB   HIS  23          2HB       HIS  23 -19.728  -4.974 -10.402
  163   2HB   HIS  23          1HB       HIS  23 -19.333  -3.968 -11.772
  164    HD2  HIS  23           HD2      HIS  23 -22.475  -6.134 -12.366
  165    HE1  HIS  23           HE1      HIS  23 -23.831  -2.284 -11.267
  166    HE2  HIS  23           HE2      HIS  23 -24.543  -4.556 -12.163
  167    H    ILE  24           H        ILE  24 -18.589  -7.761 -10.685
  168    HA   ILE  24           HA       ILE  24 -15.846  -6.828 -11.131
  169    HB   ILE  24           HB       ILE  24 -16.707  -9.184  -9.467
  170   1HG1  ILE  24          2HG1      ILE  24 -16.392  -6.282  -8.646
  171   2HG1  ILE  24          1HG1      ILE  24 -17.923  -7.152  -8.753
  172   1HG2  ILE  24          2HG2      ILE  24 -14.203  -7.624  -9.883
  173   2HG2  ILE  24          3HG2      ILE  24 -14.546  -8.172  -8.243
  174   3HG2  ILE  24          1HG2      ILE  24 -14.412  -9.344  -9.553
  175   1HD1  ILE  24          2HD1      ILE  24 -16.214  -8.770  -7.187
  176   2HD1  ILE  24          3HD1      ILE  24 -16.004  -7.122  -6.592
  177   3HD1  ILE  24          1HD1      ILE  24 -17.612  -7.848  -6.633
  178    H    LYS  25           H        LYS  25 -14.116  -8.503 -11.631
  179    HA   LYS  25           HA       LYS  25 -15.181 -10.580 -13.507
  180   1HB   LYS  25          1HB       LYS  25 -12.705  -8.852 -13.793
  181   2HB   LYS  25          2HB       LYS  25 -13.088 -10.215 -14.843
  182   1HG   LYS  25          1HG       LYS  25 -15.419  -8.917 -15.038
  183   2HG   LYS  25          2HG       LYS  25 -14.392  -7.534 -14.656
  184   1HD   LYS  25          1HD       LYS  25 -13.990  -7.512 -16.900
  185   2HD   LYS  25          2HD       LYS  25 -12.866  -8.819 -16.527
  186   1HE   LYS  25          1HE       LYS  25 -15.137 -10.255 -16.726
  187   2HE   LYS  25          2HE       LYS  25 -15.547  -8.932 -17.817
  188   1HZ   LYS  25          3HZ       LYS  25 -13.455  -9.323 -18.990
  189   2HZ   LYS  25          1HZ       LYS  25 -13.119 -10.636 -17.965
  190   3HZ   LYS  25          2HZ       LYS  25 -14.453 -10.697 -19.015
  191    H    GLU  26           H        GLU  26 -12.767  -9.725 -11.084
  192    HA   GLU  26           HA       GLU  26 -12.368 -12.517 -10.386
  193   1HB   GLU  26          1HB       GLU  26  -9.741 -12.055 -10.716
  194   2HB   GLU  26          2HB       GLU  26 -10.718 -12.740 -11.993
  195   1HG   GLU  26          2HG       GLU  26 -10.748  -9.814 -11.983
  196   2HG   GLU  26          1HG       GLU  26  -9.159 -10.488 -12.234
  197    H    TYR  27           H        TYR  27  -9.905 -12.065  -8.907
  198    HA   TYR  27           HA       TYR  27 -10.253  -9.620  -7.396
  199   1HB   TYR  27          1HB       TYR  27 -10.745 -10.688  -5.250
  200   2HB   TYR  27          2HB       TYR  27 -11.997 -11.102  -6.394
  201    HD1  TYR  27           HD2      TYR  27  -8.942 -12.341  -4.680
  202    HD2  TYR  27           HD1      TYR  27 -12.324 -13.377  -7.157
  203    HE1  TYR  27           HE2      TYR  27  -8.447 -14.760  -4.343
  204    HE2  TYR  27           HE1      TYR  27 -11.830 -15.796  -6.817
  205    HH   TYR  27           HH       TYR  27  -8.921 -16.934  -5.646
  206    H    PHE  28           H        PHE  28  -8.650  -9.836  -5.343
  207    HA   PHE  28           HA       PHE  28  -6.410 -11.596  -6.016
  208   1HB   PHE  28          2HB       PHE  28  -5.877  -9.765  -7.477
  209   2HB   PHE  28          1HB       PHE  28  -6.240  -8.581  -6.224
  210    HD1  PHE  28           HD1      PHE  28  -3.915 -11.418  -7.043
  211    HD2  PHE  28           HD2      PHE  28  -4.548  -7.803  -4.770
  212    HE1  PHE  28           HE1      PHE  28  -1.545 -11.490  -6.268
  213    HE2  PHE  28           HE2      PHE  28  -2.180  -7.874  -3.996
  214    HZ   PHE  28           HZ       PHE  28  -0.680  -9.720  -4.740
  215    H    TYR  29           H        TYR  29  -6.992 -12.387  -3.840
  216    HA   TYR  29           HA       TYR  29  -6.977 -10.722  -1.520
  217   1HB   TYR  29          1HB       TYR  29  -7.830 -13.023  -1.472
  218   2HB   TYR  29          2HB       TYR  29  -6.212 -13.641  -1.786
  219    HD1  TYR  29           HD2      TYR  29  -7.576 -10.983   0.501
  220    HD2  TYR  29           HD1      TYR  29  -5.324 -14.646   0.133
  221    HE1  TYR  29           HE2      TYR  29  -7.063 -10.912   2.940
  222    HE2  TYR  29           HE1      TYR  29  -4.828 -14.588   2.574
  223    HH   TYR  29           HH       TYR  29  -6.476 -12.776   4.744
  224    H    THR  30           H        THR  30  -5.327  -9.812  -0.445
  225    HA   THR  30           HA       THR  30  -2.569 -10.309  -1.439
  226    HB   THR  30           HB       THR  30  -1.974  -8.229  -0.328
  227    HG1  THR  30           HG1      THR  30  -3.272  -8.460   1.501
  228   1HG2  THR  30          1HG2      THR  30  -3.930  -8.470  -2.372
  229   2HG2  THR  30          2HG2      THR  30  -4.441  -7.141  -1.332
  230   3HG2  THR  30          3HG2      THR  30  -2.844  -7.112  -2.079
  231    H    SER  31           H        SER  31  -1.025 -11.271  -0.170
  232    HA   SER  31           HA       SER  31  -1.775 -12.803   2.111
  233   1HB   SER  31          1HB       SER  31   0.674 -12.220   0.632
  234   2HB   SER  31          2HB       SER  31   0.970 -12.378   2.363
  235    HG   SER  31           HG       SER  31  -0.293 -14.348   2.228
  236    H    GLY  32           H        GLY  32  -0.399  -9.564   1.804
  237   1HA   GLY  32          2HA       GLY  32  -0.978  -7.906   3.548
  238   2HA   GLY  32          1HA       GLY  32  -0.859  -9.205   4.736
  239    H    LYS  33           H        LYS  33   1.155  -7.592   2.249
  240    HA   LYS  33           HA       LYS  33   3.508  -8.061   4.028
  241   1HB   LYS  33          1HB       LYS  33   3.447  -7.393   1.068
  242   2HB   LYS  33          2HB       LYS  33   4.884  -7.767   2.018
  243   1HG   LYS  33          1HG       LYS  33   3.271  -9.924   2.558
  244   2HG   LYS  33          2HG       LYS  33   2.860  -9.583   0.895
  245   1HD   LYS  33          2HD       LYS  33   5.431  -9.422   0.531
  246   2HD   LYS  33          1HD       LYS  33   5.546 -10.272   2.052
  247   1HE   LYS  33          1HE       LYS  33   3.594 -11.672   0.614
  248   2HE   LYS  33          2HE       LYS  33   4.845 -11.301  -0.572
  249   1HZ   LYS  33          3HZ       LYS  33   6.482 -12.160   1.076
  250   2HZ   LYS  33          1HZ       LYS  33   5.179 -12.701   2.020
  251   3HZ   LYS  33          2HZ       LYS  33   5.422 -13.337   0.464
  252    H    CYS  34           H        CYS  34   1.627  -5.575   2.388
  253    HA   CYS  34           HA       CYS  34   3.596  -3.518   3.246
  254   1HB   CYS  34          2HB       CYS  34   1.058  -2.757   1.868
  255   2HB   CYS  34          1HB       CYS  34   2.667  -2.065   1.711
  256    H    SER  35           H        SER  35   1.795  -4.993   5.167
  257    HA   SER  35           HA       SER  35   0.558  -4.392   7.086
  258   1HB   SER  35          1HB       SER  35   2.061  -2.017   6.311
  259   2HB   SER  35          2HB       SER  35   0.518  -1.584   7.046
  260    HG   SER  35           HG       SER  35   2.662  -2.279   8.297
  261    H    ASN  36           H        ASN  36  -0.578  -4.361   4.204
  262    HA   ASN  36           HA       ASN  36  -3.117  -2.954   4.927
  263   1HB   ASN  36          1HB       ASN  36  -1.438  -2.719   2.473
  264   2HB   ASN  36          2HB       ASN  36  -3.171  -2.721   2.255
  265   1HD2  ASN  36          2HD2      ASN  36  -2.718  -0.207   5.169
  266   2HD2  ASN  36          1HD2      ASN  36  -4.057  -1.044   4.548
  267    HA   PRO  37           HA       PRO  37  -3.598  -7.489   3.726
  268   1HB   PRO  37          1HB       PRO  37  -5.318  -7.752   6.031
  269   2HB   PRO  37          2HB       PRO  37  -3.764  -8.541   5.743
  270   1HG   PRO  37          2HG       PRO  37  -4.335  -6.402   7.588
  271   2HG   PRO  37          1HG       PRO  37  -2.793  -7.181   7.299
  272   1HD   PRO  37          1HD       PRO  37  -3.597  -4.539   6.507
  273   2HD   PRO  37          2HD       PRO  37  -2.052  -5.323   6.212
  274    H    ALA  38           H        ALA  38  -5.298  -7.848   2.306
  275    HA   ALA  38           HA       ALA  38  -8.024  -7.118   2.901
  276   1HB   ALA  38          2HB       ALA  38  -6.763  -4.885   2.332
  277   2HB   ALA  38          3HB       ALA  38  -6.870  -5.462   0.669
  278   3HB   ALA  38          1HB       ALA  38  -8.340  -5.193   1.606
  279    H    VAL  39           H        VAL  39  -8.896  -6.702   0.250
  280    HA   VAL  39           HA       VAL  39  -7.895  -9.027  -1.272
  281    HB   VAL  39           HB       VAL  39 -10.154  -9.260   0.285
  282   1HG1  VAL  39          1HG1      VAL  39 -11.244  -7.605  -1.399
  283   2HG1  VAL  39          2HG1      VAL  39 -11.260  -8.989  -2.492
  284   3HG1  VAL  39          3HG1      VAL  39 -12.129  -9.066  -0.959
  285   1HG2  VAL  39          2HG2      VAL  39  -8.934 -10.674  -1.972
  286   2HG2  VAL  39          3HG2      VAL  39  -9.472 -11.292  -0.410
  287   3HG2  VAL  39          1HG2      VAL  39 -10.636 -11.059  -1.714
  288    H    VAL  40           H        VAL  40  -7.879  -8.502  -3.441
  289    HA   VAL  40           HA       VAL  40  -9.003  -5.803  -4.002
  290    HB   VAL  40           HB       VAL  40  -6.478  -7.111  -4.982
  291   1HG1  VAL  40          3HG1      VAL  40  -8.084  -5.274  -6.404
  292   2HG1  VAL  40          1HG1      VAL  40  -6.788  -4.326  -5.687
  293   3HG1  VAL  40          2HG1      VAL  40  -6.405  -5.692  -6.728
  294   1HG2  VAL  40          2HG2      VAL  40  -7.124  -4.616  -3.393
  295   2HG2  VAL  40          3HG2      VAL  40  -6.482  -6.119  -2.728
  296   3HG2  VAL  40          1HG2      VAL  40  -5.497  -5.152  -3.829
  297    H    PHE  41           H        PHE  41 -10.756  -5.967  -5.170
  298    HA   PHE  41           HA       PHE  41 -11.150  -8.115  -7.048
  299   1HB   PHE  41          1HB       PHE  41 -12.734  -5.644  -6.361
  300   2HB   PHE  41          2HB       PHE  41 -13.233  -6.753  -7.636
  301    HD1  PHE  41           HD2      PHE  41 -12.950  -9.393  -6.787
  302    HD2  PHE  41           HD1      PHE  41 -13.829  -5.947  -4.338
  303    HE1  PHE  41           HE2      PHE  41 -14.089 -10.864  -5.123
  304    HE2  PHE  41           HE1      PHE  41 -14.977  -7.414  -2.687
  305    HZ   PHE  41           HZ       PHE  41 -15.116  -9.868  -3.082
  306    H    VAL  42           H        VAL  42 -11.205  -8.052  -9.166
  307    HA   VAL  42           HA       VAL  42 -10.037  -5.656 -10.526
  308    HB   VAL  42           HB       VAL  42  -9.700  -7.913 -12.183
  309   1HG1  VAL  42          3HG2      VAL  42  -8.036  -6.093 -10.518
  310   2HG1  VAL  42          1HG2      VAL  42  -7.244  -7.519 -11.183
  311   3HG1  VAL  42          2HG2      VAL  42  -7.997  -6.347 -12.267
  312   1HG2  VAL  42          2HG1      VAL  42  -8.814  -8.518  -9.351
  313   2HG2  VAL  42          3HG1      VAL  42 -10.051  -9.387 -10.247
  314   3HG2  VAL  42          1HG1      VAL  42  -8.379  -9.451 -10.784
  315    H    THR  43           H        THR  43 -12.270  -4.899 -10.782
  316    HA   THR  43           HA       THR  43 -14.327  -6.628 -11.896
  317    HB   THR  43           HB       THR  43 -15.831  -4.842 -11.472
  318    HG1  THR  43           HG1      THR  43 -13.602  -3.103 -11.333
  319   1HG2  THR  43          1HG2      THR  43 -14.637  -5.789  -9.441
  320   2HG2  THR  43          2HG2      THR  43 -13.603  -4.360  -9.480
  321   3HG2  THR  43          3HG2      THR  43 -15.338  -4.187  -9.220
  322    H    ARG  44           H        ARG  44 -15.712  -4.481 -13.372
  323    HA   ARG  44           HA       ARG  44 -14.899  -5.198 -16.036
  324   1HB   ARG  44          2HB       ARG  44 -16.663  -3.467 -16.663
  325   2HB   ARG  44          1HB       ARG  44 -17.239  -4.747 -15.592
  326   1HG   ARG  44          1HG       ARG  44 -17.670  -3.265 -13.937
  327   2HG   ARG  44          2HG       ARG  44 -16.064  -2.554 -14.079
  328   1HD   ARG  44          1HD       ARG  44 -17.847  -0.901 -14.553
  329   2HD   ARG  44          2HD       ARG  44 -16.815  -1.172 -15.957
  330    HE   ARG  44           HE       ARG  44 -18.625  -2.423 -16.986
  331   1HH1  ARG  44          2HH2      ARG  44 -19.378  -2.168 -13.710
  332   2HH1  ARG  44          1HH2      ARG  44 -21.022  -1.668 -13.934
  333   1HH2  ARG  44          2HH1      ARG  44 -21.219  -2.338 -17.068
  334   2HH2  ARG  44          1HH1      ARG  44 -21.433  -0.768 -16.368
  335    H    LYS  45           H        LYS  45 -12.718  -4.316 -15.536
  336    HA   LYS  45           HA       LYS  45 -11.804  -2.259 -17.092
  337   1HB   LYS  45          2HB       LYS  45 -13.067  -0.641 -15.683
  338   2HB   LYS  45          1HB       LYS  45 -12.266  -1.275 -14.245
  339   1HG   LYS  45          1HG       LYS  45 -11.013   0.660 -14.845
  340   2HG   LYS  45          2HG       LYS  45 -10.057  -0.701 -15.431
  341   1HD   LYS  45          1HD       LYS  45 -11.134  -0.420 -17.677
  342   2HD   LYS  45          2HD       LYS  45 -11.937   1.026 -17.069
  343   1HE   LYS  45          1HE       LYS  45  -9.123   1.158 -16.451
  344   2HE   LYS  45          2HE       LYS  45  -9.334   0.838 -18.173
  345   1HZ   LYS  45          1HZ       LYS  45 -10.670   3.012 -16.654
  346   2HZ   LYS  45          2HZ       LYS  45  -9.338   3.210 -17.689
  347   3HZ   LYS  45          3HZ       LYS  45 -10.834   2.711 -18.318
  348    H    ASN  46           H        ASN  46 -11.770  -3.856 -14.011
  349    HA   ASN  46           HA       ASN  46 -10.296  -5.246 -13.001
  350   1HB   ASN  46          1HB       ASN  46  -9.366  -5.132 -15.760
  351   2HB   ASN  46          2HB       ASN  46  -8.038  -5.341 -14.654
  352   1HD2  ASN  46          2HD2      ASN  46  -8.337  -8.364 -13.843
  353   2HD2  ASN  46          1HD2      ASN  46  -8.061  -8.008 -15.480
  354    H    ARG  47           H        ARG  47 -10.118  -2.214 -12.911
  355    HA   ARG  47           HA       ARG  47  -7.357  -1.632 -12.241
  356   1HB   ARG  47          1HB       ARG  47  -9.916  -0.537 -11.001
  357   2HB   ARG  47          2HB       ARG  47  -8.303   0.125 -10.746
  358   1HG   ARG  47          1HG       ARG  47  -8.976  -0.167 -13.582
  359   2HG   ARG  47          2HG       ARG  47 -10.069   0.920 -12.724
  360   1HD   ARG  47          1HD       ARG  47  -7.313   1.367 -11.919
  361   2HD   ARG  47          2HD       ARG  47  -7.497   1.536 -13.665
  362    HE   ARG  47           HE       ARG  47  -9.567   3.039 -12.845
  363   1HH1  ARG  47          1HH1      ARG  47  -8.431   3.308 -10.034
  364   2HH1  ARG  47          2HH1      ARG  47  -6.939   4.161 -10.253
  365   1HH2  ARG  47          2HH2      ARG  47  -6.686   4.847 -13.037
  366   2HH2  ARG  47          1HH2      ARG  47  -8.161   5.681 -12.678
  367    H    GLN  48           H        GLN  48  -6.500  -1.926  -9.943
  368    HA   GLN  48           HA       GLN  48  -7.721  -4.371  -8.937
  369   1HB   GLN  48          1HB       GLN  48  -5.118  -3.051  -8.692
  370   2HB   GLN  48          2HB       GLN  48  -5.644  -3.902  -7.239
  371   1HG   GLN  48          1HG       GLN  48  -6.147  -5.897  -8.618
  372   2HG   GLN  48          2HG       GLN  48  -5.617  -5.043 -10.054
  373   1HE2  GLN  48          2HE2      GLN  48  -3.362  -7.025  -7.536
  374   2HE2  GLN  48          1HE2      GLN  48  -3.945  -7.513  -9.054
  375    H    VAL  49           H        VAL  49  -9.610  -3.224  -8.464
  376    HA   VAL  49           HA       VAL  49  -9.967  -1.235  -6.508
  377    HB   VAL  49           HB       VAL  49 -12.089  -3.278  -6.659
  378   1HG1  VAL  49          1HG1      VAL  49 -11.849  -0.297  -7.039
  379   2HG1  VAL  49          2HG1      VAL  49 -13.374  -1.160  -7.243
  380   3HG1  VAL  49          3HG1      VAL  49 -12.564  -1.161  -5.677
  381   1HG2  VAL  49          3HG2      VAL  49 -11.093  -1.883  -9.171
  382   2HG2  VAL  49          1HG2      VAL  49 -11.429  -3.603  -8.981
  383   3HG2  VAL  49          2HG2      VAL  49 -12.755  -2.439  -9.012
  384    H    CYS  50           H        CYS  50 -10.647  -1.492  -4.258
  385    HA   CYS  50           HA       CYS  50  -9.664  -4.045  -3.069
  386   1HB   CYS  50          2HB       CYS  50  -8.779  -1.558  -2.481
  387   2HB   CYS  50          1HB       CYS  50 -10.098  -1.676  -1.347
  388    H    ALA  51           H        ALA  51 -10.869  -3.928  -0.595
  389    HA   ALA  51           HA       ALA  51 -13.510  -3.086  -0.339
  390   1HB   ALA  51          2HB       ALA  51 -13.213  -5.431  -2.127
  391   2HB   ALA  51          3HB       ALA  51 -14.470  -5.563  -0.900
  392   3HB   ALA  51          1HB       ALA  51 -14.504  -4.231  -2.051
  393    H    ASN  52           H        ASN  52 -11.135  -3.935   1.226
  394    HA   ASN  52           HA       ASN  52 -10.794  -4.818   3.352
  395   1HB   ASN  52          1HB       ASN  52 -13.105  -3.838   3.679
  396   2HB   ASN  52          2HB       ASN  52 -13.753  -5.432   3.288
  397   1HD2  ASN  52          2HD2      ASN  52 -11.452  -5.047   6.686
  398   2HD2  ASN  52          1HD2      ASN  52 -11.800  -3.673   5.753
  399    HA   PRO  53           HA       PRO  53 -10.459  -9.140   2.394
  400   1HB   PRO  53          1HB       PRO  53  -9.181  -9.896   4.727
  401   2HB   PRO  53          2HB       PRO  53  -8.362  -9.111   3.389
  402   1HG   PRO  53          1HG       PRO  53  -9.081  -8.004   6.033
  403   2HG   PRO  53          2HG       PRO  53  -7.890  -7.425   4.885
  404   1HD   PRO  53          1HD       PRO  53 -10.497  -6.354   5.344
  405   2HD   PRO  53          2HD       PRO  53  -9.350  -5.849   4.112
  406    H    GLU  54           H        GLU  54 -11.722  -8.025   5.513
  407    HA   GLU  54           HA       GLU  54 -13.222 -10.595   5.784
  408   1HB   GLU  54          1HB       GLU  54 -12.348  -8.617   7.907
  409   2HB   GLU  54          2HB       GLU  54 -13.290 -10.076   8.213
  410   1HG   GLU  54          1HG       GLU  54 -11.439 -11.426   7.211
  411   2HG   GLU  54          2HG       GLU  54 -10.495  -9.947   7.039
  412    H    LYS  55           H        LYS  55 -14.248  -8.375   4.192
  413    HA   LYS  55           HA       LYS  55 -16.349  -7.174   5.896
  414   1HB   LYS  55          2HB       LYS  55 -15.232  -6.609   3.237
  415   2HB   LYS  55          1HB       LYS  55 -16.985  -6.462   3.314
  416   1HG   LYS  55          1HG       LYS  55 -15.390  -5.259   5.537
  417   2HG   LYS  55          2HG       LYS  55 -15.372  -4.434   3.979
  418   1HD   LYS  55          1HD       LYS  55 -17.464  -3.653   4.292
  419   2HD   LYS  55          2HD       LYS  55 -18.066  -5.266   4.676
  420   1HE   LYS  55          1HE       LYS  55 -16.403  -3.929   6.753
  421   2HE   LYS  55          2HE       LYS  55 -18.018  -3.272   6.489
  422   1HZ   LYS  55          3HZ       LYS  55 -17.869  -6.159   6.618
  423   2HZ   LYS  55          1HZ       LYS  55 -17.487  -5.362   8.068
  424   3HZ   LYS  55          2HZ       LYS  55 -18.989  -5.094   7.321
  425    H    LYS  56           H        LYS  56 -16.339 -10.075   5.516
  426    HA   LYS  56           HA       LYS  56 -17.808 -11.814   5.035
  427   1HB   LYS  56          1HB       LYS  56 -19.581  -9.418   5.377
  428   2HB   LYS  56          2HB       LYS  56 -20.286 -10.956   4.878
  429   1HG   LYS  56          1HG       LYS  56 -19.869 -11.956   6.898
  430   2HG   LYS  56          2HG       LYS  56 -18.365 -11.065   7.143
  431   1HD   LYS  56          1HD       LYS  56 -20.686  -9.298   7.131
  432   2HD   LYS  56          2HD       LYS  56 -20.808 -10.533   8.384
  433   1HE   LYS  56          1HE       LYS  56 -19.045  -9.689   9.564
  434   2HE   LYS  56          2HE       LYS  56 -18.143  -9.272   8.107
  435   1HZ   LYS  56          3HZ       LYS  56 -19.922  -7.480   7.815
  436   2HZ   LYS  56          1HZ       LYS  56 -20.282  -7.748   9.454
  437   3HZ   LYS  56          2HZ       LYS  56 -18.729  -7.230   8.998
  438    H    TRP  57           H        TRP  57 -19.791  -9.550   3.212
  439    HA   TRP  57           HA       TRP  57 -20.229 -11.111   0.987
  440   1HB   TRP  57          1HB       TRP  57 -20.778  -9.072  -0.213
  441   2HB   TRP  57          2HB       TRP  57 -21.325  -8.934   1.462
  442    HD1  TRP  57           HD1      TRP  57 -20.338  -6.928   2.810
  443    HE1  TRP  57           HE1      TRP  57 -18.651  -5.067   2.214
  444    HE3  TRP  57           HE3      TRP  57 -18.627  -8.771  -1.575
  445    HZ2  TRP  57           HZ2      TRP  57 -16.788  -4.453   0.086
  446    HZ3  TRP  57           HZ3      TRP  57 -17.015  -7.524  -2.945
  447    HH2  TRP  57           HH2      TRP  57 -16.103  -5.357  -2.139
  448    H    VAL  58           H        VAL  58 -17.271  -9.301   1.619
  449    HA   VAL  58           HA       VAL  58 -16.211  -9.378  -1.029
  450    HB   VAL  58           HB       VAL  58 -13.929  -9.612   0.294
  451   1HG1  VAL  58          2HG1      VAL  58 -15.266  -7.588  -0.788
  452   2HG1  VAL  58          3HG1      VAL  58 -15.367  -7.092   0.899
  453   3HG1  VAL  58          1HG1      VAL  58 -13.794  -7.347   0.143
  454   1HG2  VAL  58          2HG2      VAL  58 -15.658 -10.011   2.380
  455   2HG2  VAL  58          3HG2      VAL  58 -13.983  -9.487   2.528
  456   3HG2  VAL  58          1HG2      VAL  58 -15.282  -8.298   2.508
  457    H    ARG  59           H        ARG  59 -15.672 -11.720   1.636
  458    HA   ARG  59           HA       ARG  59 -14.239 -13.587   0.011
  459   1HB   ARG  59          2HB       ARG  59 -15.350 -13.506   2.707
  460   2HB   ARG  59          1HB       ARG  59 -15.517 -15.087   1.983
  461   1HG   ARG  59          1HG       ARG  59 -12.934 -14.276   1.279
  462   2HG   ARG  59          2HG       ARG  59 -13.121 -13.760   2.955
  463   1HD   ARG  59          1HD       ARG  59 -12.604 -15.905   3.485
  464   2HD   ARG  59          2HD       ARG  59 -14.251 -16.280   2.979
  465    HE   ARG  59           HE       ARG  59 -12.492 -16.269   0.701
  466   1HH1  ARG  59          1HH2      ARG  59 -14.567 -18.556   1.969
  467   2HH1  ARG  59          2HH2      ARG  59 -13.393 -19.298   3.003
  468   1HH2  ARG  59          1HH1      ARG  59 -11.476 -18.679   0.208
  469   2HH2  ARG  59          2HH1      ARG  59 -10.971 -19.044   1.823
  470    H    GLU  60           H        GLU  60 -17.661 -13.052   0.615
  471    HA   GLU  60           HA       GLU  60 -18.649 -15.508  -0.456
  472   1HB   GLU  60          1HB       GLU  60 -19.750 -12.792   0.042
  473   2HB   GLU  60          2HB       GLU  60 -20.608 -13.774  -1.147
  474   1HG   GLU  60          1HG       GLU  60 -20.544 -15.651   0.594
  475   2HG   GLU  60          2HG       GLU  60 -20.047 -14.437   1.745
  476    H    TYR  61           H        TYR  61 -17.353 -12.638  -1.945
  477    HA   TYR  61           HA       TYR  61 -18.258 -13.494  -4.630
  478   1HB   TYR  61          1HB       TYR  61 -16.591 -11.103  -3.781
  479   2HB   TYR  61          2HB       TYR  61 -17.216 -11.394  -5.401
  480    HD1  TYR  61           HD2      TYR  61 -19.836 -12.689  -3.695
  481    HD2  TYR  61           HD1      TYR  61 -17.874  -8.866  -4.155
  482    HE1  TYR  61           HE2      TYR  61 -21.960 -11.526  -3.109
  483    HE2  TYR  61           HE1      TYR  61 -20.003  -7.708  -3.577
  484    HH   TYR  61           HH       TYR  61 -23.027  -9.492  -3.187
  485    H    ILE  62           H        ILE  62 -15.413 -13.525  -2.586
  486    HA   ILE  62           HA       ILE  62 -13.452 -13.941  -4.631
  487    HB   ILE  62           HB       ILE  62 -13.626 -14.360  -1.681
  488   1HG1  ILE  62          2HG1      ILE  62 -11.423 -13.153  -1.863
  489   2HG1  ILE  62          1HG1      ILE  62 -11.649 -13.102  -3.592
  490   1HG2  ILE  62          3HG2      ILE  62 -11.561 -15.750  -3.415
  491   2HG2  ILE  62          1HG2      ILE  62 -11.349 -15.452  -1.690
  492   3HG2  ILE  62          2HG2      ILE  62 -12.652 -16.501  -2.250
  493   1HD1  ILE  62          3HD1      ILE  62 -13.934 -12.016  -3.074
  494   2HD1  ILE  62          1HD1      ILE  62 -13.291 -11.764  -1.451
  495   3HD1  ILE  62          2HD1      ILE  62 -12.495 -11.027  -2.839
  496    H    ASN  63           H        ASN  63 -15.276 -16.293  -2.632
  497    HA   ASN  63           HA       ASN  63 -14.295 -18.568  -4.145
  498   1HB   ASN  63          2HB       ASN  63 -16.177 -18.099  -1.914
  499   2HB   ASN  63          1HB       ASN  63 -16.570 -19.482  -2.936
  500   1HD2  ASN  63          1HD2      ASN  63 -13.873 -19.524  -0.127
  501   2HD2  ASN  63          2HD2      ASN  63 -13.513 -18.223  -1.156
  502    H    SER  64           H        SER  64 -17.263 -16.617  -4.185
  503    HA   SER  64           HA       SER  64 -18.701 -18.198  -6.076
  504   1HB   SER  64          2HB       SER  64 -18.793 -15.237  -5.468
  505   2HB   SER  64          1HB       SER  64 -19.918 -16.028  -6.545
  506    HG   SER  64           HG       SER  64 -20.445 -17.432  -4.790
  507    H    LEU  65           H        LEU  65 -15.991 -16.071  -6.451
  508    HA   LEU  65           HA       LEU  65 -16.426 -15.625  -9.314
  509   1HB   LEU  65          2HB       LEU  65 -14.254 -14.952  -7.353
  510   2HB   LEU  65          1HB       LEU  65 -13.931 -14.843  -9.066
  511    HG   LEU  65           HG       LEU  65 -16.405 -13.572  -7.931
  512   1HD1  LEU  65          1HD1      LEU  65 -14.367 -12.831  -6.614
  513   2HD1  LEU  65          2HD1      LEU  65 -13.711 -12.199  -8.123
  514   3HD1  LEU  65          3HD1      LEU  65 -15.206 -11.536  -7.465
  515   1HD2  LEU  65          3HD2      LEU  65 -15.594 -13.884 -10.470
  516   2HD2  LEU  65          1HD2      LEU  65 -16.465 -12.445  -9.940
  517   3HD2  LEU  65          2HD2      LEU  65 -14.709 -12.407 -10.092
  518    H    GLU  66           H        GLU  66 -15.482 -16.786 -10.981
  519    HA   GLU  66           HA       GLU  66 -13.720 -19.069 -10.187
  520   1HB   GLU  66          1HB       GLU  66 -15.740 -19.143 -12.440
  521   2HB   GLU  66          2HB       GLU  66 -14.831 -20.495 -11.765
  522   1HG   GLU  66          1HG       GLU  66 -16.104 -19.434  -9.545
  523   2HG   GLU  66          2HG       GLU  66 -17.314 -19.255 -10.814
  524    H    MET  67           H        MET  67 -13.146 -19.966 -12.775
  525    HA   MET  67           HA       MET  67 -11.595 -17.641 -13.821
  526   1HB   MET  67          1HB       MET  67 -10.508 -19.895 -13.023
  527   2HB   MET  67          2HB       MET  67 -11.057 -20.497 -14.588
  528   1HG   MET  67          1HG       MET  67  -9.921 -18.422 -15.597
  529   2HG   MET  67          2HG       MET  67  -9.136 -18.232 -14.029
  530   1HE   MET  67          1HE       MET  67  -7.369 -18.036 -15.498
  531   2HE   MET  67          3HE       MET  67  -6.175 -19.230 -14.989
  532   3HE   MET  67          2HE       MET  67  -6.753 -19.217 -16.654
  533    H    SER  68           H        SER  68 -14.438 -18.256 -14.457
  534    HA   SER  68           HA       SER  68 -14.436 -19.317 -17.181
  535   1HB   SER  68          1HB       SER  68 -16.450 -19.705 -15.997
  536   2HB   SER  68          2HB       SER  68 -16.523 -18.044 -15.410
  537    HG   SER  68           HG       SER  68 -17.937 -18.153 -17.081
  538    H    SER   1           H        SER   1  -6.108  12.856  -4.255
  539    HA   SER   1           HA       SER   1  -8.537  11.218  -4.737
  540   1HB   SER   1          1HB       SER   1  -6.283  10.518  -6.042
  541   2HB   SER   1          2HB       SER   1  -5.970   9.725  -4.499
  542    HG   SER   1           HG       SER   1  -7.147   8.250  -5.506
  543    HA   PRO   2           HA       PRO   2  -7.278  11.871  -0.284
  544   1HB   PRO   2          1HB       PRO   2 -10.099  12.076   0.302
  545   2HB   PRO   2          2HB       PRO   2  -8.869  13.339   0.429
  546   1HG   PRO   2          1HG       PRO   2 -10.958  13.101  -1.548
  547   2HG   PRO   2          2HG       PRO   2  -9.726  14.362  -1.423
  548   1HD   PRO   2          1HD       PRO   2  -9.890  12.235  -3.365
  549   2HD   PRO   2          2HD       PRO   2  -8.651  13.498  -3.236
  550    H    TYR   3           H        TYR   3 -10.108  10.123  -1.600
  551    HA   TYR   3           HA       TYR   3  -9.583   7.951   0.377
  552   1HB   TYR   3          1HB       TYR   3 -12.021   8.873  -1.108
  553   2HB   TYR   3          2HB       TYR   3 -11.913   7.185  -0.606
  554    HD1  TYR   3           HD2      TYR   3 -10.845   6.968   1.930
  555    HD2  TYR   3           HD1      TYR   3 -13.138  10.282   0.380
  556    HE1  TYR   3           HE2      TYR   3 -11.474   7.619   4.253
  557    HE2  TYR   3           HE1      TYR   3 -13.767  10.933   2.704
  558    HH   TYR   3           HH       TYR   3 -13.831   9.234   5.140
  559    H    SER   4           H        SER   4  -8.821   6.014  -0.355
  560    HA   SER   4           HA       SER   4  -8.641   5.664  -3.317
  561   1HB   SER   4          1HB       SER   4  -6.675   5.474  -1.294
  562   2HB   SER   4          2HB       SER   4  -6.991   3.822  -1.825
  563    HG   SER   4           HG       SER   4  -5.454   5.425  -3.026
  564    H    SER   5           H        SER   5  -9.196   3.614  -4.196
  565    HA   SER   5           HA       SER   5 -10.372   1.607  -2.359
  566   1HB   SER   5          1HB       SER   5 -12.393   1.495  -3.949
  567   2HB   SER   5          2HB       SER   5 -12.334   2.872  -2.846
  568    HG   SER   5           HG       SER   5 -12.759   3.669  -4.862
  569    H    ASP   6           H        ASP   6  -7.988   1.324  -3.741
  570    HA   ASP   6           HA       ASP   6  -8.544  -0.999  -5.365
  571   1HB   ASP   6          2HB       ASP   6  -7.797  -0.153  -7.514
  572   2HB   ASP   6          1HB       ASP   6  -9.100   0.859  -6.951
  573    H    THR   7           H        THR   7  -6.074  -0.746  -6.934
  574    HA   THR   7           HA       THR   7  -4.286  -1.778  -4.957
  575    HB   THR   7           HB       THR   7  -4.032  -2.666  -7.137
  576    HG1  THR   7           HG1      THR   7  -2.028  -2.430  -6.341
  577   1HG2  THR   7          2HG2      THR   7  -4.024   0.222  -7.998
  578   2HG2  THR   7          3HG2      THR   7  -3.370  -1.036  -9.046
  579   3HG2  THR   7          1HG2      THR   7  -5.062  -1.089  -8.556
  580    H    THR   8           H        THR   8  -1.895  -0.871  -4.978
  581    HA   THR   8           HA       THR   8  -1.747   2.064  -5.074
  582    HB   THR   8           HB       THR   8  -1.097   0.729  -2.452
  583    HG1  THR   8           HG1      THR   8  -3.595   1.834  -3.204
  584   1HG2  THR   8          2HG2      THR   8  -0.370   3.091  -3.048
  585   2HG2  THR   8          3HG2      THR   8  -2.079   3.525  -3.066
  586   3HG2  THR   8          1HG2      THR   8  -1.330   2.950  -1.577
  587    HA   PRO   9           HA       PRO   9   2.184   0.306  -6.429
  588   1HB   PRO   9          1HB       PRO   9   3.116   3.035  -6.737
  589   2HB   PRO   9          2HB       PRO   9   2.728   1.863  -8.002
  590   1HG   PRO   9          1HG       PRO   9   1.183   4.171  -7.204
  591   2HG   PRO   9          2HG       PRO   9   0.791   2.996  -8.458
  592   1HD   PRO   9          2HD       PRO   9  -0.472   3.314  -5.928
  593   2HD   PRO   9          1HD       PRO   9  -0.812   2.102  -7.152
  594    H    CYS  10           H        CYS  10   2.775  -0.416  -4.328
  595    HA   CYS  10           HA       CYS  10   4.347   1.552  -2.713
  596   1HB   CYS  10          1HB       CYS  10   2.112  -0.189  -1.964
  597   2HB   CYS  10          2HB       CYS  10   3.487  -0.357  -0.915
  598    H    CYS  11           H        CYS  11   6.315   0.848  -2.067
  599    HA   CYS  11           HA       CYS  11   7.163  -1.758  -3.092
  600   1HB   CYS  11          1HB       CYS  11   9.101  -0.696  -3.436
  601   2HB   CYS  11          2HB       CYS  11   8.491   0.732  -2.656
  602    H    PHE  12           H        PHE  12   7.993  -3.452  -1.726
  603    HA   PHE  12           HA       PHE  12   6.878  -3.306   1.028
  604   1HB   PHE  12          2HB       PHE  12   6.097  -5.198  -0.296
  605   2HB   PHE  12          1HB       PHE  12   7.756  -5.665  -0.665
  606    HD1  PHE  12           HD1      PHE  12   6.419  -4.450   2.612
  607    HD2  PHE  12           HD2      PHE  12   7.920  -7.817   0.361
  608    HE1  PHE  12           HE1      PHE  12   6.526  -5.801   4.703
  609    HE2  PHE  12           HE2      PHE  12   8.022  -9.169   2.454
  610    HZ   PHE  12           HZ       PHE  12   7.327  -8.159   4.625
  611    H    ALA  13           H        ALA  13   9.624  -5.170  -0.276
  612    HA   ALA  13           HA       ALA  13  11.206  -4.249   2.075
  613   1HB   ALA  13          2HB       ALA  13  11.155  -6.725   0.429
  614   2HB   ALA  13          3HB       ALA  13  12.733  -6.204   1.020
  615   3HB   ALA  13          1HB       ALA  13  11.429  -6.533   2.161
  616    H    TYR  14           H        TYR  14  13.336  -3.458   1.794
  617    HA   TYR  14           HA       TYR  14  13.773  -2.449  -0.954
  618   1HB   TYR  14          1HB       TYR  14  15.490  -0.944   0.521
  619   2HB   TYR  14          2HB       TYR  14  13.865  -0.463   0.114
  620    HD1  TYR  14           HD2      TYR  14  11.956  -1.026   1.746
  621    HD2  TYR  14           HD1      TYR  14  16.141  -1.291   2.776
  622    HE1  TYR  14           HE2      TYR  14  11.361  -1.029   4.159
  623    HE2  TYR  14           HE1      TYR  14  15.545  -1.279   5.196
  624    HH   TYR  14           HH       TYR  14  12.974  -2.047   6.470
  625    H    ILE  15           H        ILE  15  15.838  -2.616  -1.906
  626    HA   ILE  15           HA       ILE  15  17.375  -4.930  -0.969
  627    HB   ILE  15           HB       ILE  15  16.889  -4.606  -3.374
  628   1HG1  ILE  15          2HG1      ILE  15  19.854  -4.205  -3.026
  629   2HG1  ILE  15          1HG1      ILE  15  19.075  -5.667  -2.420
  630   1HG2  ILE  15          3HG2      ILE  15  17.653  -1.940  -2.782
  631   2HG2  ILE  15          1HG2      ILE  15  18.843  -2.563  -3.925
  632   3HG2  ILE  15          2HG2      ILE  15  17.128  -2.586  -4.337
  633   1HD1  ILE  15          2HD1      ILE  15  18.017  -5.343  -4.983
  634   2HD1  ILE  15          3HD1      ILE  15  19.720  -4.922  -5.165
  635   3HD1  ILE  15          1HD1      ILE  15  19.265  -6.496  -4.512
  636    H    ALA  16           H        ALA  16  19.587  -4.876  -0.378
  637    HA   ALA  16           HA       ALA  16  20.487  -2.256   0.699
  638   1HB   ALA  16          1HB       ALA  16  21.264  -5.126   1.213
  639   2HB   ALA  16          2HB       ALA  16  22.296  -3.797   1.742
  640   3HB   ALA  16          3HB       ALA  16  20.649  -3.933   2.357
  641    H    ARG  17           H        ARG  17  21.184  -1.314  -1.298
  642    HA   ARG  17           HA       ARG  17  23.883  -1.665  -2.009
  643   1HB   ARG  17          1HB       ARG  17  22.309  -3.753  -3.042
  644   2HB   ARG  17          2HB       ARG  17  22.611  -2.689  -4.394
  645   1HG   ARG  17          1HG       ARG  17  25.082  -2.702  -3.388
  646   2HG   ARG  17          2HG       ARG  17  24.547  -4.257  -2.751
  647   1HD   ARG  17          1HD       ARG  17  24.136  -3.536  -5.652
  648   2HD   ARG  17          2HD       ARG  17  25.656  -4.233  -5.093
  649    HE   ARG  17           HE       ARG  17  23.517  -5.848  -4.122
  650   1HH1  ARG  17          2HH1      ARG  17  25.462  -7.590  -5.486
  651   2HH1  ARG  17          1HH1      ARG  17  25.605  -6.919  -7.076
  652   1HH2  ARG  17          2HH2      ARG  17  22.534  -5.434  -6.989
  653   2HH2  ARG  17          1HH2      ARG  17  22.887  -7.086  -7.372
  654    HA   PRO  18           HA       PRO  18  22.102   2.239  -3.475
  655   1HB   PRO  18          1HB       PRO  18  24.771   3.004  -4.249
  656   2HB   PRO  18          2HB       PRO  18  23.802   3.646  -2.951
  657   1HG   PRO  18          1HG       PRO  18  26.065   1.882  -2.735
  658   2HG   PRO  18          2HG       PRO  18  25.087   2.548  -1.425
  659   1HD   PRO  18          1HD       PRO  18  25.141  -0.159  -2.344
  660   2HD   PRO  18          2HD       PRO  18  24.086   0.524  -1.119
  661    H    LEU  19           H        LEU  19  21.036   1.604  -5.333
  662    HA   LEU  19           HA       LEU  19  22.167   0.327  -7.588
  663   1HB   LEU  19          1HB       LEU  19  19.896   2.319  -7.652
  664   2HB   LEU  19          2HB       LEU  19  20.186   1.035  -8.794
  665    HG   LEU  19           HG       LEU  19  19.425   0.728  -5.882
  666   1HD1  LEU  19          2HD1      LEU  19  17.908   1.001  -8.273
  667   2HD1  LEU  19          3HD1      LEU  19  17.762  -0.676  -7.747
  668   3HD1  LEU  19          1HD1      LEU  19  17.318   0.634  -6.652
  669   1HD2  LEU  19          1HD2      LEU  19  20.672  -1.127  -7.810
  670   2HD2  LEU  19          2HD2      LEU  19  20.602  -1.217  -6.050
  671   3HD2  LEU  19          3HD2      LEU  19  19.229  -1.760  -7.017
  672    HA   PRO  20           HA       PRO  20  24.774   3.687  -9.008
  673   1HB   PRO  20          1HB       PRO  20  24.885   2.462 -11.634
  674   2HB   PRO  20          2HB       PRO  20  26.157   2.537 -10.408
  675   1HG   PRO  20          1HG       PRO  20  24.615   0.241 -11.182
  676   2HG   PRO  20          2HG       PRO  20  25.828   0.336  -9.901
  677   1HD   PRO  20          1HD       PRO  20  22.957   0.122  -9.625
  678   2HD   PRO  20          2HD       PRO  20  24.178   0.176  -8.340
  679    H    ARG  21           H        ARG  21  23.939   5.615  -9.703
  680    HA   ARG  21           HA       ARG  21  21.379   6.003 -10.759
  681   1HB   ARG  21          1HB       ARG  21  23.086   7.741  -9.880
  682   2HB   ARG  21          2HB       ARG  21  23.663   7.805 -11.528
  683   1HG   ARG  21          1HG       ARG  21  20.725   8.033 -11.055
  684   2HG   ARG  21          2HG       ARG  21  21.725   9.421 -10.705
  685   1HD   ARG  21          2HD       ARG  21  22.469   8.229 -13.243
  686   2HD   ARG  21          1HD       ARG  21  20.758   8.658 -13.221
  687    HE   ARG  21           HE       ARG  21  22.082  10.885 -12.171
  688   1HH1  ARG  21          2HH1      ARG  21  21.157   9.835 -15.421
  689   2HH1  ARG  21          1HH1      ARG  21  21.179  11.565 -15.492
  690   1HH2  ARG  21          2HH2      ARG  21  24.098  11.635 -13.598
  691   2HH2  ARG  21          1HH2      ARG  21  23.973  11.183 -15.266
  692    H    ALA  22           H        ALA  22  24.296   5.065 -12.445
  693    HA   ALA  22           HA       ALA  22  23.369   5.734 -15.098
  694   1HB   ALA  22          2HB       ALA  22  25.774   5.247 -14.440
  695   2HB   ALA  22          3HB       ALA  22  25.328   3.543 -14.362
  696   3HB   ALA  22          1HB       ALA  22  25.219   4.414 -15.892
  697    H    HIS  23           H        HIS  23  23.323   2.734 -13.171
  698    HA   HIS  23           HA       HIS  23  21.970   1.197 -15.207
  699   1HB   HIS  23          1HB       HIS  23  22.046   0.742 -12.214
  700   2HB   HIS  23          2HB       HIS  23  21.578  -0.434 -13.413
  701    HD2  HIS  23           HD2      HIS  23  24.667   1.609 -14.494
  702    HE1  HIS  23           HE1      HIS  23  26.102  -2.057 -12.953
  703    HE2  HIS  23           HE2      HIS  23  26.747   0.060 -14.209
  704    H    ILE  24           H        ILE  24  20.888   3.478 -12.789
  705    HA   ILE  24           HA       ILE  24  18.125   2.504 -12.938
  706    HB   ILE  24           HB       ILE  24  19.080   5.061 -11.660
  707   1HG1  ILE  24          2HG1      ILE  24  18.720   2.343 -10.379
  708   2HG1  ILE  24          1HG1      ILE  24  20.287   3.065 -10.755
  709   1HG2  ILE  24          2HG2      ILE  24  16.555   3.467 -11.692
  710   2HG2  ILE  24          3HG2      ILE  24  16.993   4.295 -10.198
  711   3HG2  ILE  24          1HG2      ILE  24  16.773   5.217 -11.685
  712   1HD1  ILE  24          2HD1      ILE  24  18.769   5.021  -9.351
  713   2HD1  ILE  24          3HD1      ILE  24  18.605   3.504  -8.464
  714   3HD1  ILE  24          1HD1      ILE  24  20.208   4.167  -8.790
  715    H    LYS  25           H        LYS  25  16.361   4.089 -13.565
  716    HA   LYS  25           HA       LYS  25  17.300   5.880 -15.774
  717   1HB   LYS  25          1HB       LYS  25  14.809   4.152 -15.648
  718   2HB   LYS  25          2HB       LYS  25  15.125   5.347 -16.905
  719   1HG   LYS  25          1HG       LYS  25  17.436   4.009 -17.064
  720   2HG   LYS  25          2HG       LYS  25  16.434   2.707 -16.422
  721   1HD   LYS  25          1HD       LYS  25  15.889   2.370 -18.610
  722   2HD   LYS  25          2HD       LYS  25  14.789   3.724 -18.352
  723   1HE   LYS  25          1HE       LYS  25  17.039   5.101 -18.901
  724   2HE   LYS  25          2HE       LYS  25  17.380   3.635 -19.818
  725   1HZ   LYS  25          3HZ       LYS  25  15.214   3.871 -20.895
  726   2HZ   LYS  25          1HZ       LYS  25  14.944   5.318 -20.047
  727   3HZ   LYS  25          2HZ       LYS  25  16.205   5.220 -21.180
  728    H    GLU  26           H        GLU  26  15.046   5.388 -13.110
  729    HA   GLU  26           HA       GLU  26  14.691   8.255 -12.785
  730   1HB   GLU  26          1HB       GLU  26  12.049   7.766 -12.867
  731   2HB   GLU  26          2HB       GLU  26  12.934   8.259 -14.291
  732   1HG   GLU  26          1HG       GLU  26  12.974   5.363 -13.869
  733   2HG   GLU  26          2HG       GLU  26  11.370   6.006 -14.107
  734    H    TYR  27           H        TYR  27  12.332   8.026 -11.096
  735    HA   TYR  27           HA       TYR  27  12.792   5.821  -9.282
  736   1HB   TYR  27          2HB       TYR  27  13.491   7.154  -7.365
  737   2HB   TYR  27          1HB       TYR  27  14.612   7.426  -8.669
  738    HD1  TYR  27           HD2      TYR  27  11.675   8.880  -6.891
  739    HD2  TYR  27           HD1      TYR  27  14.873   9.574  -9.708
  740    HE1  TYR  27           HE2      TYR  27  11.177  11.324  -6.857
  741    HE2  TYR  27           HE1      TYR  27  14.374  12.015  -9.675
  742    HH   TYR  27           HH       TYR  27  11.545  13.301  -8.495
  743    H    PHE  28           H        PHE  28  11.332   6.334  -7.172
  744    HA   PHE  28           HA       PHE  28   9.050   8.007  -7.934
  745   1HB   PHE  28          2HB       PHE  28   8.421   5.992  -9.081
  746   2HB   PHE  28          1HB       PHE  28   8.871   4.993  -7.701
  747    HD1  PHE  28           HD1      PHE  28   6.487   7.700  -8.757
  748    HD2  PHE  28           HD2      PHE  28   7.282   4.440  -6.040
  749    HE1  PHE  28           HE1      PHE  28   4.172   7.890  -7.849
  750    HE2  PHE  28           HE2      PHE  28   4.970   4.631  -5.131
  751    HZ   PHE  28           HZ       PHE  28   3.415   6.360  -6.032
  752    H    TYR  29           H        TYR  29   9.766   9.095  -5.935
  753    HA   TYR  29           HA       TYR  29   9.909   7.776  -3.405
  754   1HB   TYR  29          1HB       TYR  29  10.754  10.056  -3.744
  755   2HB   TYR  29          2HB       TYR  29   9.116  10.632  -4.034
  756    HD1  TYR  29           HD2      TYR  29  10.641   8.319  -1.488
  757    HD2  TYR  29           HD1      TYR  29   8.351  11.902  -2.222
  758    HE1  TYR  29           HE2      TYR  29  10.293   8.597   0.964
  759    HE2  TYR  29           HE1      TYR  29   8.018  12.193   0.230
  760    HH   TYR  29           HH       TYR  29   9.815  10.703   2.522
  761    H    THR  30           H        THR  30   8.336   7.039  -2.104
  762    HA   THR  30           HA       THR  30   5.516   7.402  -2.977
  763    HB   THR  30           HB       THR  30   5.006   5.504  -1.544
  764    HG1  THR  30           HG1      THR  30   6.421   5.982   0.144
  765   1HG2  THR  30          1HG2      THR  30   6.820   5.443  -3.727
  766   2HG2  THR  30          2HG2      THR  30   7.405   4.271  -2.545
  767   3HG2  THR  30          3HG2      THR  30   5.761   4.146  -3.172
  768    H    SER  31           H        SER  31   4.057   8.546  -1.759
  769    HA   SER  31           HA       SER  31   4.950  10.380   0.227
  770   1HB   SER  31          1HB       SER  31   2.411   9.606  -0.987
  771   2HB   SER  31          2HB       SER  31   2.230  10.011   0.719
  772    HG   SER  31           HG       SER  31   3.472  11.936   0.222
  773    H    GLY  32           H        GLY  32   3.568   7.139   0.475
  774   1HA   GLY  32          2HA       GLY  32   4.269   5.740   2.395
  775   2HA   GLY  32          1HA       GLY  32   4.224   7.196   3.392
  776    H    LYS  33           H        LYS  33   2.056   5.258   1.298
  777    HA   LYS  33           HA       LYS  33  -0.175   5.989   3.145
  778   1HB   LYS  33          1HB       LYS  33  -0.309   4.907   0.312
  779   2HB   LYS  33          2HB       LYS  33  -1.681   5.420   1.293
  780   1HG   LYS  33          2HG       LYS  33  -0.045   7.623   1.413
  781   2HG   LYS  33          1HG       LYS  33   0.256   7.047  -0.209
  782   1HD   LYS  33          1HD       LYS  33  -2.334   6.849  -0.372
  783   2HD   LYS  33          2HD       LYS  33  -2.350   7.910   1.016
  784   1HE   LYS  33          1HE       LYS  33  -0.504   9.076  -0.738
  785   2HE   LYS  33          2HE       LYS  33  -1.832   8.546  -1.769
  786   1HZ   LYS  33          3HZ       LYS  33  -3.356   9.645  -0.159
  787   2HZ   LYS  33          1HZ       LYS  33  -1.994  10.305   0.612
  788   3HZ   LYS  33          2HZ       LYS  33  -2.340  10.715  -0.999
  789    H    CYS  34           H        CYS  34   1.602   3.285   1.755
  790    HA   CYS  34           HA       CYS  34  -0.299   1.382   3.024
  791   1HB   CYS  34          2HB       CYS  34   2.146   0.418   1.604
  792   2HB   CYS  34          1HB       CYS  34   0.534  -0.281   1.653
  793    H    SER  35           H        SER  35   1.621   3.105   4.592
  794    HA   SER  35           HA       SER  35   2.985   2.776   6.491
  795   1HB   SER  35          1HB       SER  35   1.444   0.323   6.163
  796   2HB   SER  35          2HB       SER  35   3.034  -0.011   6.848
  797    HG   SER  35           HG       SER  35   0.975   0.869   8.127
  798    H    ASN  36           H        ASN  36   3.926   2.326   3.572
  799    HA   ASN  36           HA       ASN  36   6.512   1.025   4.319
  800   1HB   ASN  36          2HB       ASN  36   4.676   0.450   2.041
  801   2HB   ASN  36          1HB       ASN  36   6.391   0.414   1.709
  802   1HD2  ASN  36          2HD2      ASN  36   6.145  -1.658   4.975
  803   2HD2  ASN  36          1HD2      ASN  36   7.437  -0.927   4.151
  804    HA   PRO  37           HA       PRO  37   6.892   5.340   2.462
  805   1HB   PRO  37          1HB       PRO  37   8.763   5.915   4.585
  806   2HB   PRO  37          2HB       PRO  37   7.190   6.666   4.294
  807   1HG   PRO  37          1HG       PRO  37   7.890   4.805   6.379
  808   2HG   PRO  37          2HG       PRO  37   6.330   5.546   6.088
  809   1HD   PRO  37          2HD       PRO  37   7.088   2.813   5.625
  810   2HD   PRO  37          1HD       PRO  37   5.524   3.558   5.326
  811    H    ALA  38           H        ALA  38   8.490   5.476   0.893
  812    HA   ALA  38           HA       ALA  38  11.250   4.822   1.406
  813   1HB   ALA  38          2HB       ALA  38   9.962   2.539   1.250
  814   2HB   ALA  38          3HB       ALA  38   9.957   2.870  -0.482
  815   3HB   ALA  38          1HB       ALA  38  11.487   2.729   0.385
  816    H    VAL  39           H        VAL  39  11.931   4.019  -1.213
  817    HA   VAL  39           HA       VAL  39  10.844   6.124  -2.973
  818    HB   VAL  39           HB       VAL  39  13.177   6.516  -1.556
  819   1HG1  VAL  39          1HG1      VAL  39  14.199   4.710  -3.082
  820   2HG1  VAL  39          2HG1      VAL  39  14.125   5.943  -4.342
  821   3HG1  VAL  39          3HG1      VAL  39  15.077   6.226  -2.882
  822   1HG2  VAL  39          2HG2      VAL  39  11.814   7.713  -3.842
  823   2HG2  VAL  39          3HG2      VAL  39  12.473   8.469  -2.386
  824   3HG2  VAL  39          1HG2      VAL  39  13.533   8.104  -3.752
  825    H    VAL  40           H        VAL  40  10.678   5.291  -5.033
  826    HA   VAL  40           HA       VAL  40  11.789   2.542  -5.292
  827    HB   VAL  40           HB       VAL  40   9.200   3.715  -6.277
  828   1HG1  VAL  40          3HG1      VAL  40  10.711   1.687  -7.533
  829   2HG1  VAL  40          1HG1      VAL  40   9.468   0.857  -6.607
  830   3HG1  VAL  40          2HG1      VAL  40   9.014   2.069  -7.800
  831   1HG2  VAL  40          2HG2      VAL  40   9.955   1.461  -4.403
  832   2HG2  VAL  40          3HG2      VAL  40   9.357   3.047  -3.912
  833   3HG2  VAL  40          1HG2      VAL  40   8.303   1.945  -4.799
  834    H    PHE  41           H        PHE  41  13.461   2.529  -6.589
  835    HA   PHE  41           HA       PHE  41  13.713   4.385  -8.778
  836   1HB   PHE  41          1HB       PHE  41  15.354   2.031  -7.856
  837   2HB   PHE  41          2HB       PHE  41  15.760   2.948  -9.306
  838    HD1  PHE  41           HD2      PHE  41  15.516   5.680  -8.823
  839    HD2  PHE  41           HD1      PHE  41  16.578   2.618  -5.969
  840    HE1  PHE  41           HE2      PHE  41  16.735   7.374  -7.456
  841    HE2  PHE  41           HE1      PHE  41  17.803   4.308  -4.613
  842    HZ   PHE  41           HZ       PHE  41  17.877   6.688  -5.350
  843    H    VAL  42           H        VAL  42  13.623   4.019 -10.866
  844    HA   VAL  42           HA       VAL  42  12.367   1.465 -11.791
  845    HB   VAL  42           HB       VAL  42  11.914   3.468 -13.722
  846   1HG1  VAL  42          3HG2      VAL  42  10.381   1.892 -11.725
  847   2HG1  VAL  42          1HG2      VAL  42   9.537   3.239 -12.484
  848   3HG1  VAL  42          2HG2      VAL  42  10.201   1.945 -13.483
  849   1HG2  VAL  42          2HG1      VAL  42  11.226   4.476 -10.951
  850   2HG2  VAL  42          3HG1      VAL  42  12.395   5.198 -12.046
  851   3HG2  VAL  42          1HG1      VAL  42  10.689   5.199 -12.467
  852    H    THR  43           H        THR  43  14.562   0.641 -12.114
  853    HA   THR  43           HA       THR  43  16.544   2.193 -13.550
  854    HB   THR  43           HB       THR  43  18.064   0.445 -13.037
  855    HG1  THR  43           HG1      THR  43  15.859  -1.228 -12.457
  856   1HG2  THR  43          1HG2      THR  43  17.014   1.684 -11.076
  857   2HG2  THR  43          2HG2      THR  43  15.991   0.266 -10.841
  858   3HG2  THR  43          3HG2      THR  43  17.742   0.125 -10.689
  859    H    ARG  44           H        ARG  44  17.858  -0.041 -14.882
  860    HA   ARG  44           HA       ARG  44  17.117   0.502 -17.507
  861   1HB   ARG  44          2HB       ARG  44  18.426  -1.707 -18.008
  862   2HB   ARG  44          1HB       ARG  44  19.277  -0.348 -17.279
  863   1HG   ARG  44          1HG       ARG  44  19.566  -1.424 -15.291
  864   2HG   ARG  44          2HG       ARG  44  17.980  -2.192 -15.359
  865   1HD   ARG  44          1HD       ARG  44  19.891  -3.813 -15.553
  866   2HD   ARG  44          2HD       ARG  44  18.792  -3.854 -16.931
  867    HE   ARG  44           HE       ARG  44  20.480  -2.650 -18.236
  868   1HH1  ARG  44          2HH2      ARG  44  21.477  -2.493 -15.025
  869   2HH1  ARG  44          1HH2      ARG  44  23.101  -3.031 -15.305
  870   1HH2  ARG  44          2HH1      ARG  44  23.056  -2.809 -18.506
  871   2HH2  ARG  44          1HH1      ARG  44  23.327  -4.265 -17.609
  872    H    LYS  45           H        LYS  45  15.510  -1.563 -15.406
  873    HA   LYS  45           HA       LYS  45  14.056  -2.843 -17.680
  874   1HB   LYS  45          2HB       LYS  45  15.056  -4.494 -16.178
  875   2HB   LYS  45          1HB       LYS  45  14.346  -3.689 -14.780
  876   1HG   LYS  45          1HG       LYS  45  12.871  -5.479 -15.211
  877   2HG   LYS  45          2HG       LYS  45  12.074  -4.093 -15.954
  878   1HD   LYS  45          1HD       LYS  45  12.988  -4.720 -18.146
  879   2HD   LYS  45          2HD       LYS  45  13.844  -6.078 -17.415
  880   1HE   LYS  45          1HE       LYS  45  11.052  -6.142 -16.665
  881   2HE   LYS  45          2HE       LYS  45  11.206  -6.070 -18.419
  882   1HZ   LYS  45          1HZ       LYS  45  12.638  -7.986 -16.661
  883   2HZ   LYS  45          2HZ       LYS  45  11.250  -8.350 -17.570
  884   3HZ   LYS  45          3HZ       LYS  45  12.698  -7.941 -18.358
  885    H    ASN  46           H        ASN  46  14.001  -0.753 -14.957
  886    HA   ASN  46           HA       ASN  46  12.515   0.774 -14.192
  887   1HB   ASN  46          2HB       ASN  46  11.547   0.162 -16.867
  888   2HB   ASN  46          1HB       ASN  46  10.219   0.507 -15.790
  889   1HD2  ASN  46          2HD2      ASN  46  10.466   3.619 -15.348
  890   2HD2  ASN  46          1HD2      ASN  46  10.071   3.046 -16.897
  891    H    ARG  47           H        ARG  47  12.361  -2.268 -13.648
  892    HA   ARG  47           HA       ARG  47   9.635  -2.709 -12.765
  893   1HB   ARG  47          1HB       ARG  47  12.249  -3.660 -11.520
  894   2HB   ARG  47          2HB       ARG  47  10.648  -4.247 -11.077
  895   1HG   ARG  47          1HG       ARG  47  11.134  -4.387 -13.959
  896   2HG   ARG  47          2HG       ARG  47  12.289  -5.340 -13.030
  897   1HD   ARG  47          1HD       ARG  47   9.601  -5.656 -11.975
  898   2HD   ARG  47          2HD       ARG  47   9.659  -6.073 -13.688
  899    HE   ARG  47           HE       ARG  47  11.792  -7.455 -12.811
  900   1HH1  ARG  47          1HH1      ARG  47  10.849  -7.328  -9.919
  901   2HH1  ARG  47          2HH1      ARG  47   9.348  -8.194  -9.918
  902   1HH2  ARG  47          2HH2      ARG  47   8.915  -9.261 -12.555
  903   2HH2  ARG  47          1HH2      ARG  47  10.416 -10.042 -12.180
  904    H    GLN  48           H        GLN  48   8.918  -2.123 -10.455
  905    HA   GLN  48           HA       GLN  48  10.179   0.440  -9.878
  906   1HB   GLN  48          1HB       GLN  48   7.607  -0.829  -9.276
  907   2HB   GLN  48          2HB       GLN  48   8.225   0.221  -8.000
  908   1HG   GLN  48          1HG       GLN  48   8.620   1.997  -9.681
  909   2HG   GLN  48          2HG       GLN  48   7.997   0.947 -10.940
  910   1HE2  GLN  48          2HE2      GLN  48   5.909   3.280  -8.583
  911   2HE2  GLN  48          1HE2      GLN  48   6.389   3.542 -10.190
  912    H    VAL  49           H        VAL  49  12.103  -0.647  -9.379
  913    HA   VAL  49           HA       VAL  49  12.597  -2.341  -7.190
  914    HB   VAL  49           HB       VAL  49  14.696  -0.348  -7.766
  915   1HG1  VAL  49          1HG1      VAL  49  14.444  -3.352  -7.705
  916   2HG1  VAL  49          2HG1      VAL  49  15.948  -2.534  -8.132
  917   3HG1  VAL  49          3HG1      VAL  49  15.245  -2.308  -6.530
  918   1HG2  VAL  49          3HG2      VAL  49  13.541  -2.076  -9.986
  919   2HG2  VAL  49          1HG2      VAL  49  13.881  -0.349 -10.063
  920   3HG2  VAL  49          2HG2      VAL  49  15.208  -1.514 -10.017
  921    H    CYS  50           H        CYS  50  13.424  -1.772  -5.047
  922    HA   CYS  50           HA       CYS  50  12.512   0.931  -4.169
  923   1HB   CYS  50          1HB       CYS  50  11.676  -1.444  -3.178
  924   2HB   CYS  50          2HB       CYS  50  13.068  -1.174  -2.161
  925    H    ALA  51           H        ALA  51  13.882   1.146  -1.783
  926    HA   ALA  51           HA       ALA  51  16.539   0.337  -1.589
  927   1HB   ALA  51          2HB       ALA  51  16.113   2.407  -3.666
  928   2HB   ALA  51          3HB       ALA  51  17.446   2.707  -2.554
  929   3HB   ALA  51          1HB       ALA  51  17.412   1.226  -3.506
  930    H    ASN  52           H        ASN  52  14.276   1.403   0.001
  931    HA   ASN  52           HA       ASN  52  14.064   2.603   1.988
  932   1HB   ASN  52          1HB       ASN  52  16.398   1.658   2.304
  933   2HB   ASN  52          2HB       ASN  52  17.014   3.175   1.645
  934   1HD2  ASN  52          2HD2      ASN  52  14.935   3.301   5.203
  935   2HD2  ASN  52          1HD2      ASN  52  15.223   1.804   4.457
  936    HA   PRO  53           HA       PRO  53  13.718   6.705   0.362
  937   1HB   PRO  53          2HB       PRO  53  12.469   7.856   2.476
  938   2HB   PRO  53          1HB       PRO  53  11.649   6.743   1.412
  939   1HG   PRO  53          2HG       PRO  53  12.599   6.272   4.192
  940   2HG   PRO  53          1HG       PRO  53  11.291   5.486   3.328
  941   1HD   PRO  53          2HD       PRO  53  13.909   4.451   3.733
  942   2HD   PRO  53          1HD       PRO  53  12.672   3.773   2.684
  943    H    GLU  54           H        GLU  54  15.125   6.061   3.548
  944    HA   GLU  54           HA       GLU  54  16.608   8.656   3.395
  945   1HB   GLU  54          1HB       GLU  54  15.865   6.979   5.811
  946   2HB   GLU  54          2HB       GLU  54  16.832   8.452   5.868
  947   1HG   GLU  54          1HG       GLU  54  14.927   9.683   4.806
  948   2HG   GLU  54          2HG       GLU  54  13.964   8.209   4.910
  949    H    LYS  55           H        LYS  55  17.544   6.210   2.075
  950    HA   LYS  55           HA       LYS  55  19.758   5.270   3.796
  951   1HB   LYS  55          2HB       LYS  55  18.480   4.330   1.323
  952   2HB   LYS  55          1HB       LYS  55  20.234   4.188   1.310
  953   1HG   LYS  55          1HG       LYS  55  18.794   3.326   3.780
  954   2HG   LYS  55          2HG       LYS  55  18.672   2.286   2.362
  955   1HD   LYS  55          1HD       LYS  55  20.782   1.542   2.642
  956   2HD   LYS  55          2HD       LYS  55  21.405   3.189   2.749
  957   1HE   LYS  55          1HE       LYS  55  19.890   2.170   5.103
  958   2HE   LYS  55          2HE       LYS  55  21.489   1.478   4.828
  959   1HZ   LYS  55          3HZ       LYS  55  21.325   4.355   4.553
  960   2HZ   LYS  55          1HZ       LYS  55  21.052   3.772   6.124
  961   3HZ   LYS  55          2HZ       LYS  55  22.501   3.400   5.321
  962    H    LYS  56           H        LYS  56  19.720   8.082   3.015
  963    HA   LYS  56           HA       LYS  56  21.146   9.726   2.192
  964   1HB   LYS  56          1HB       LYS  56  22.946   7.393   2.754
  965   2HB   LYS  56          2HB       LYS  56  23.611   8.839   1.995
  966   1HG   LYS  56          1HG       LYS  56  23.326  10.119   3.875
  967   2HG   LYS  56          2HG       LYS  56  21.846   9.282   4.344
  968   1HD   LYS  56          1HD       LYS  56  24.168   7.517   4.428
  969   2HD   LYS  56          2HD       LYS  56  24.366   8.917   5.483
  970   1HE   LYS  56          1HE       LYS  56  22.689   8.256   6.885
  971   2HE   LYS  56          2HE       LYS  56  21.694   7.643   5.564
  972   1HZ   LYS  56          3HZ       LYS  56  23.455   5.817   5.412
  973   2HZ   LYS  56          1HZ       LYS  56  23.922   6.313   6.969
  974   3HZ   LYS  56          2HZ       LYS  56  22.345   5.745   6.694
  975    H    TRP  57           H        TRP  57  23.013   7.214   0.582
  976    HA   TRP  57           HA       TRP  57  23.295   8.441  -1.867
  977   1HB   TRP  57          1HB       TRP  57  23.771   6.250  -2.799
  978   2HB   TRP  57          2HB       TRP  57  24.429   6.348  -1.160
  979    HD1  TRP  57           HD1      TRP  57  23.540   4.561   0.523
  980    HE1  TRP  57           HE1      TRP  57  21.825   2.643   0.310
  981    HE3  TRP  57           HE3      TRP  57  21.536   5.768  -3.959
  982    HZ2  TRP  57           HZ2      TRP  57  19.827   1.743  -1.582
  983    HZ3  TRP  57           HZ3      TRP  57  19.842   4.349  -5.028
  984    HH2  TRP  57           HH2      TRP  57  18.997   2.322  -3.863
  985    H    VAL  58           H        VAL  58  20.395   6.756  -0.790
  986    HA   VAL  58           HA       VAL  58  19.163   6.462  -3.347
  987    HB   VAL  58           HB       VAL  58  16.973   6.891  -1.928
  988   1HG1  VAL  58          2HG1      VAL  58  18.244   4.727  -2.790
  989   2HG1  VAL  58          3HG1      VAL  58  18.456   4.477  -1.058
  990   3HG1  VAL  58          1HG1      VAL  58  16.836   4.631  -1.742
  991   1HG2  VAL  58          2HG2      VAL  58  18.831   7.575  -0.034
  992   2HG2  VAL  58          3HG2      VAL  58  17.169   7.087   0.294
  993   3HG2  VAL  58          1HG2      VAL  58  18.468   5.902   0.362
  994    H    ARG  59           H        ARG  59  18.794   9.162  -1.012
  995    HA   ARG  59           HA       ARG  59  17.245  10.785  -2.785
  996   1HB   ARG  59          1HB       ARG  59  18.532  11.083  -0.186
  997   2HB   ARG  59          2HB       ARG  59  18.646  12.544  -1.136
  998   1HG   ARG  59          1HG       ARG  59  16.025  11.656  -1.545
  999   2HG   ARG  59          2HG       ARG  59  16.324  11.382   0.171
 1000   1HD   ARG  59          1HD       ARG  59  15.836  13.583   0.425
 1001   2HD   ARG  59          2HD       ARG  59  17.444  13.873  -0.237
 1002    HE   ARG  59           HE       ARG  59  15.537  13.550  -2.369
 1003   1HH1  ARG  59          1HH2      ARG  59  17.682  15.984  -1.577
 1004   2HH1  ARG  59          2HH2      ARG  59  16.575  16.868  -0.582
 1005   1HH2  ARG  59          1HH1      ARG  59  14.480  15.867  -3.130
 1006   2HH2  ARG  59          2HH1      ARG  59  14.083  16.467  -1.555
 1007    H    GLU  60           H        GLU  60  20.700  10.322  -2.342
 1008    HA   GLU  60           HA       GLU  60  21.606  12.596  -3.814
 1009   1HB   GLU  60          1HB       GLU  60  22.750   9.971  -3.011
 1010   2HB   GLU  60          2HB       GLU  60  23.522  10.772  -4.380
 1011   1HG   GLU  60          2HG       GLU  60  23.565  12.877  -2.920
 1012   2HG   GLU  60          1HG       GLU  60  23.152  11.838  -1.579
 1013    H    TYR  61           H        TYR  61  20.225   9.551  -4.790
 1014    HA   TYR  61           HA       TYR  61  20.945  10.014  -7.623
 1015   1HB   TYR  61          1HB       TYR  61  19.348   7.775  -6.337
 1016   2HB   TYR  61          2HB       TYR  61  19.864   7.830  -8.019
 1017    HD1  TYR  61           HD2      TYR  61  22.587   9.339  -6.690
 1018    HD2  TYR  61           HD1      TYR  61  20.613   5.501  -6.475
 1019    HE1  TYR  61           HE2      TYR  61  24.748   8.259  -6.086
 1020    HE2  TYR  61           HE1      TYR  61  22.779   4.425  -5.878
 1021    HH   TYR  61           HH       TYR  61  25.816   6.229  -5.941
 1022    H    ILE  62           H        ILE  62  18.252  10.357  -5.418
 1023    HA   ILE  62           HA       ILE  62  16.152  10.485  -7.366
 1024    HB   ILE  62           HB       ILE  62  16.512  11.309  -4.521
 1025   1HG1  ILE  62          1HG1      ILE  62  14.295  10.103  -4.399
 1026   2HG1  ILE  62          2HG1      ILE  62  14.428   9.807  -6.115
 1027   1HG2  ILE  62          3HG2      ILE  62  14.333  12.456  -6.295
 1028   2HG2  ILE  62          1HG2      ILE  62  14.240  12.409  -4.533
 1029   3HG2  ILE  62          2HG2      ILE  62  15.499  13.358  -5.325
 1030   1HD1  ILE  62          3HD1      ILE  62  16.742   8.796  -5.582
 1031   2HD1  ILE  62          1HD1      ILE  62  16.199   8.784  -3.903
 1032   3HD1  ILE  62          2HD1      ILE  62  15.323   7.856  -5.119
 1033    H    ASN  63           H        ASN  63  18.105  13.084  -5.855
 1034    HA   ASN  63           HA       ASN  63  17.006  15.126  -7.603
 1035   1HB   ASN  63          2HB       ASN  63  19.037  14.972  -5.459
 1036   2HB   ASN  63          1HB       ASN  63  19.352  16.194  -6.691
 1037   1HD2  ASN  63          1HD2      ASN  63  16.848  16.645  -3.742
 1038   2HD2  ASN  63          2HD2      ASN  63  16.425  15.214  -4.552
 1039    H    SER  64           H        SER  64  19.973  13.174  -7.562
 1040    HA   SER  64           HA       SER  64  21.277  14.461  -9.751
 1041   1HB   SER  64          1HB       SER  64  21.418  11.615  -8.735
 1042   2HB   SER  64          2HB       SER  64  22.467  12.239  -9.984
 1043    HG   SER  64           HG       SER  64  23.104  13.874  -8.484
 1044    H    LEU  65           H        LEU  65  18.555  12.315  -9.637
 1045    HA   LEU  65           HA       LEU  65  18.799  11.465 -12.430
 1046   1HB   LEU  65          1HB       LEU  65  16.766  11.092 -10.254
 1047   2HB   LEU  65          2HB       LEU  65  16.329  10.742 -11.908
 1048    HG   LEU  65           HG       LEU  65  18.877   9.630 -10.772
 1049   1HD1  LEU  65          1HD1      LEU  65  16.934   9.097  -9.230
 1050   2HD1  LEU  65          2HD1      LEU  65  16.183   8.259 -10.588
 1051   3HD1  LEU  65          3HD1      LEU  65  17.721   7.689  -9.942
 1052   1HD2  LEU  65          3HD2      LEU  65  17.898   9.584 -13.269
 1053   2HD2  LEU  65          1HD2      LEU  65  18.807   8.228 -12.601
 1054   3HD2  LEU  65          2HD2      LEU  65  17.045   8.181 -12.627
 1055    H    GLU  66           H        GLU  66  17.742  12.385 -14.179
 1056    HA   GLU  66           HA       GLU  66  16.028  14.767 -13.602
 1057   1HB   GLU  66          1HB       GLU  66  17.893  14.508 -15.973
 1058   2HB   GLU  66          2HB       GLU  66  17.027  15.947 -15.437
 1059   1HG   GLU  66          1HG       GLU  66  18.448  15.205 -13.179
 1060   2HG   GLU  66          2HG       GLU  66  19.572  14.843 -14.489
 1061    H    MET  67           H        MET  67  15.281  15.291 -16.250
 1062    HA   MET  67           HA       MET  67  13.671  12.849 -16.848
 1063   1HB   MET  67          1HB       MET  67  12.631  15.200 -16.308
 1064   2HB   MET  67          2HB       MET  67  13.072  15.572 -17.975
 1065   1HG   MET  67          1HG       MET  67  11.880  13.382 -18.602
 1066   2HG   MET  67          2HG       MET  67  11.203  13.418 -16.974
 1067   1HE   MET  67          1HE       MET  67   9.341  13.027 -18.280
 1068   2HE   MET  67          3HE       MET  67   8.179  14.288 -17.868
 1069   3HE   MET  67          2HE       MET  67   8.648  14.036 -19.550
 1070    H    SER  68           H        SER  68  16.464  13.354 -17.753
 1071    HA   SER  68           HA       SER  68  16.276  14.017 -20.594
 1072   1HB   SER  68          1HB       SER  68  18.363  14.558 -19.613
 1073   2HB   SER  68          2HB       SER  68  18.481  12.995 -18.803
 1074    HG   SER  68           HG       SER  68  19.781  12.862 -20.564
   
  No H/Q in entry =        1074
  Start of MODEL   11
    1    H    SER   1           H        SER   1  10.262 -15.716   4.491
    2    HA   SER   1           HA       SER   1  10.215 -16.694   1.683
    3   1HB   SER   1          1HB       SER   1   9.339 -14.093   1.601
    4   2HB   SER   1          2HB       SER   1   8.284 -15.493   1.795
    5    HG   SER   1           HG       SER   1   8.237 -15.180   3.954
    6    HA   PRO   2           HA       PRO   2  13.990 -14.722   0.637
    7   1HB   PRO   2          1HB       PRO   2  13.043 -13.632  -1.858
    8   2HB   PRO   2          2HB       PRO   2  14.009 -15.092  -1.612
    9   1HG   PRO   2          1HG       PRO   2  11.223 -14.915  -2.357
   10   2HG   PRO   2          2HG       PRO   2  12.193 -16.375  -2.127
   11   1HD   PRO   2          1HD       PRO   2  10.120 -15.340  -0.410
   12   2HD   PRO   2          2HD       PRO   2  11.098 -16.801  -0.175
   13    H    TYR   3           H        TYR   3  14.750 -12.447  -0.308
   14    HA   TYR   3           HA       TYR   3  13.281 -10.405   1.246
   15   1HB   TYR   3          1HB       TYR   3  15.944 -10.330  -0.205
   16   2HB   TYR   3          2HB       TYR   3  15.269  -8.977   0.703
   17    HD1  TYR   3           HD1      TYR   3  14.818  -9.234   3.183
   18    HD2  TYR   3           HD2      TYR   3  17.011 -12.171   0.900
   19    HE1  TYR   3           HE1      TYR   3  15.720 -10.204   5.295
   20    HE2  TYR   3           HE2      TYR   3  17.913 -13.140   3.011
   21    HH   TYR   3           HH       TYR   3  17.586 -11.547   6.058
   22    H    SER   4           H        SER   4  11.923  -8.972   0.273
   23    HA   SER   4           HA       SER   4  11.970  -8.842  -2.709
   24   1HB   SER   4          1HB       SER   4   9.844  -9.598  -1.710
   25   2HB   SER   4          2HB       SER   4   9.761  -8.114  -0.760
   26    HG   SER   4           HG       SER   4   8.631  -7.576  -2.496
   27    H    SER   5           H        SER   5  13.262  -7.130  -3.271
   28    HA   SER   5           HA       SER   5  12.869  -4.560  -1.793
   29   1HB   SER   5          1HB       SER   5  15.085  -3.931  -2.488
   30   2HB   SER   5          2HB       SER   5  15.196  -5.573  -1.857
   31    HG   SER   5           HG       SER   5  14.848  -6.209  -4.138
   32    H    ASP   6           H        ASP   6  10.873  -4.403  -3.210
   33    HA   ASP   6           HA       ASP   6  11.400  -2.667  -5.463
   34   1HB   ASP   6          2HB       ASP   6  10.521  -4.088  -7.236
   35   2HB   ASP   6          1HB       ASP   6  11.868  -4.902  -6.485
   36    H    THR   7           H        THR   7   8.819  -3.346  -6.760
   37    HA   THR   7           HA       THR   7   7.159  -1.839  -4.930
   38    HB   THR   7           HB       THR   7   7.025  -1.515  -7.385
   39    HG1  THR   7           HG1      THR   7   5.194  -0.927  -6.382
   40   1HG2  THR   7          3HG2      THR   7   7.371  -4.000  -7.862
   41   2HG2  THR   7          1HG2      THR   7   5.667  -4.218  -7.465
   42   3HG2  THR   7          2HG2      THR   7   6.132  -3.203  -8.829
   43    H    THR   8           H        THR   8   4.772  -2.702  -4.653
   44    HA   THR   8           HA       THR   8   4.642  -5.627  -4.286
   45    HB   THR   8           HB       THR   8   3.876  -4.060  -1.875
   46    HG1  THR   8           HG1      THR   8   6.566  -4.771  -2.354
   47   1HG2  THR   8          3HG2      THR   8   4.546  -6.784  -2.663
   48   2HG2  THR   8          1HG2      THR   8   5.444  -6.283  -1.230
   49   3HG2  THR   8          2HG2      THR   8   3.683  -6.216  -1.233
   50    HA   PRO   9           HA       PRO   9   0.628  -4.210  -5.757
   51   1HB   PRO   9          1HB       PRO   9  -0.246  -6.961  -5.711
   52   2HB   PRO   9          2HB       PRO   9   0.160  -5.976  -7.121
   53   1HG   PRO   9          1HG       PRO   9   1.695  -8.140  -5.973
   54   2HG   PRO   9          2HG       PRO   9   2.100  -7.160  -7.384
   55   1HD   PRO   9          2HD       PRO   9   3.307  -7.088  -4.793
   56   2HD   PRO   9          1HD       PRO   9   3.701  -6.105  -6.194
   57    H    CYS  10           H        CYS  10  -0.248  -3.249  -3.894
   58    HA   CYS  10           HA       CYS  10  -1.794  -5.059  -2.132
   59   1HB   CYS  10          2HB       CYS  10   0.103  -2.946  -1.070
   60   2HB   CYS  10          1HB       CYS  10  -0.972  -3.951  -0.100
   61    H    CYS  11           H        CYS  11  -3.455  -3.932  -0.934
   62    HA   CYS  11           HA       CYS  11  -4.320  -1.528  -2.408
   63   1HB   CYS  11          2HB       CYS  11  -6.283  -2.619  -2.400
   64   2HB   CYS  11          1HB       CYS  11  -5.676  -3.825  -1.284
   65    H    PHE  12           H        PHE  12  -5.408   0.211  -0.996
   66    HA   PHE  12           HA       PHE  12  -3.728   0.618   1.439
   67   1HB   PHE  12          2HB       PHE  12  -3.472   2.341  -0.311
   68   2HB   PHE  12          1HB       PHE  12  -5.191   2.652  -0.263
   69    HD1  PHE  12           HD2      PHE  12  -2.318   2.340   2.149
   70    HD2  PHE  12           HD1      PHE  12  -5.914   4.458   1.042
   71    HE1  PHE  12           HE2      PHE  12  -1.991   3.897   4.068
   72    HE2  PHE  12           HE1      PHE  12  -5.589   6.013   2.963
   73    HZ   PHE  12           HZ       PHE  12  -3.628   5.733   4.476
   74    H    ALA  13           H        ALA  13  -6.943   1.745   0.320
   75    HA   ALA  13           HA       ALA  13  -7.964   1.094   3.056
   76   1HB   ALA  13          1HB       ALA  13  -8.289   3.441   1.316
   77   2HB   ALA  13          2HB       ALA  13  -9.809   2.823   1.960
   78   3HB   ALA  13          3HB       ALA  13  -8.515   3.297   3.060
   79    H    TYR  14           H        TYR  14 -10.127   0.247   3.187
   80    HA   TYR  14           HA       TYR  14 -10.795  -1.303   0.749
   81   1HB   TYR  14          1HB       TYR  14 -12.201  -1.852   3.322
   82   2HB   TYR  14          2HB       TYR  14 -11.644  -2.976   2.090
   83    HD1  TYR  14           HD1      TYR  14  -9.248  -3.678   1.994
   84    HD2  TYR  14           HD2      TYR  14 -10.763  -1.155   5.152
   85    HE1  TYR  14           HE1      TYR  14  -7.221  -4.168   3.360
   86    HE2  TYR  14           HE2      TYR  14  -8.739  -1.649   6.519
   87    HH   TYR  14           HH       TYR  14  -6.585  -2.481   6.388
   88    H    ILE  15           H        ILE  15 -12.843  -1.132  -0.211
   89    HA   ILE  15           HA       ILE  15 -14.350   1.292   0.406
   90    HB   ILE  15           HB       ILE  15 -14.097   0.512  -1.920
   91   1HG1  ILE  15          2HG1      ILE  15 -16.996   0.172  -1.143
   92   2HG1  ILE  15          1HG1      ILE  15 -16.192   1.738  -1.045
   93   1HG2  ILE  15          3HG2      ILE  15 -14.602  -1.999  -0.795
   94   2HG2  ILE  15          1HG2      ILE  15 -16.037  -1.656  -1.761
   95   3HG2  ILE  15          2HG2      ILE  15 -14.443  -1.639  -2.514
   96   1HD1  ILE  15          2HD1      ILE  15 -15.442   1.191  -3.505
   97   2HD1  ILE  15          3HD1      ILE  15 -16.808   0.075  -3.471
   98   3HD1  ILE  15          1HD1      ILE  15 -17.071   1.799  -3.208
   99    H    ALA  16           H        ALA  16 -15.913   1.378   1.946
  100    HA   ALA  16           HA       ALA  16 -16.903  -1.050   3.219
  101   1HB   ALA  16          3HB       ALA  16 -16.721   1.662   3.922
  102   2HB   ALA  16          1HB       ALA  16 -18.452   1.338   3.811
  103   3HB   ALA  16          2HB       ALA  16 -17.442   0.373   4.887
  104    H    ARG  17           H        ARG  17 -17.911  -2.089   1.369
  105    HA   ARG  17           HA       ARG  17 -20.680  -1.888   1.173
  106   1HB   ARG  17          1HB       ARG  17 -19.382   0.248  -0.270
  107   2HB   ARG  17          2HB       ARG  17 -20.235  -0.788  -1.387
  108   1HG   ARG  17          1HG       ARG  17 -21.747  -0.218   1.066
  109   2HG   ARG  17          2HG       ARG  17 -21.401   1.215   0.098
  110   1HD   ARG  17          1HD       ARG  17 -22.814   0.573  -1.557
  111   2HD   ARG  17          2HD       ARG  17 -22.261  -1.100  -1.497
  112    HE   ARG  17           HE       ARG  17 -24.005  -0.234   0.722
  113   1HH1  ARG  17          1HH2      ARG  17 -23.996  -3.313  -0.086
  114   2HH1  ARG  17          2HH2      ARG  17 -25.649  -2.965   0.295
  115   1HH2  ARG  17          1HH1      ARG  17 -24.985  -1.335  -2.621
  116   2HH2  ARG  17          2HH1      ARG  17 -26.288  -0.834  -1.594
  117    HA   PRO  18           HA       PRO  18 -19.032  -5.616  -0.773
  118   1HB   PRO  18          1HB       PRO  18 -21.747  -6.500  -1.169
  119   2HB   PRO  18          2HB       PRO  18 -20.556  -7.128  -0.041
  120   1HG   PRO  18          1HG       PRO  18 -22.853  -5.484   0.555
  121   2HG   PRO  18          2HG       PRO  18 -21.672  -6.151   1.686
  122   1HD   PRO  18          1HD       PRO  18 -21.976  -3.414   0.900
  123   2HD   PRO  18          2HD       PRO  18 -20.712  -4.098   1.939
  124    H    LEU  19           H        LEU  19 -18.294  -4.843  -2.723
  125    HA   LEU  19           HA       LEU  19 -19.623  -3.436  -4.711
  126   1HB   LEU  19          2HB       LEU  19 -17.561  -5.633  -5.047
  127   2HB   LEU  19          1HB       LEU  19 -18.010  -4.490  -6.310
  128    HG   LEU  19           HG       LEU  19 -16.811  -3.799  -3.612
  129   1HD1  LEU  19          1HD1      LEU  19 -15.655  -4.532  -6.132
  130   2HD1  LEU  19          2HD1      LEU  19 -15.311  -2.829  -5.830
  131   3HD1  LEU  19          3HD1      LEU  19 -14.831  -4.047  -4.650
  132   1HD2  LEU  19          1HD2      LEU  19 -18.104  -2.187  -5.759
  133   2HD2  LEU  19          2HD2      LEU  19 -18.036  -1.893  -4.022
  134   3HD2  LEU  19          3HD2      LEU  19 -16.640  -1.525  -5.034
  135    HA   PRO  20           HA       PRO  20 -22.739  -6.121  -6.304
  136   1HB   PRO  20          1HB       PRO  20 -22.412  -5.195  -9.018
  137   2HB   PRO  20          2HB       PRO  20 -23.666  -4.735  -7.859
  138   1HG   PRO  20          1HG       PRO  20 -21.459  -3.133  -8.781
  139   2HG   PRO  20          2HG       PRO  20 -22.686  -2.692  -7.591
  140   1HD   PRO  20          1HD       PRO  20 -19.903  -3.349  -7.133
  141   2HD   PRO  20          2HD       PRO  20 -21.119  -2.839  -5.946
  142    H    ARG  21           H        ARG  21 -22.386  -8.264  -6.731
  143    HA   ARG  21           HA       ARG  21 -19.931  -9.272  -7.788
  144   1HB   ARG  21          1HB       ARG  21 -21.819 -10.448  -6.386
  145   2HB   ARG  21          2HB       ARG  21 -22.492 -10.837  -7.970
  146   1HG   ARG  21          1HG       ARG  21 -20.993 -12.497  -8.207
  147   2HG   ARG  21          2HG       ARG  21 -19.680 -11.360  -8.030
  148   1HD   ARG  21          2HD       ARG  21 -19.382 -12.926  -6.265
  149   2HD   ARG  21          1HD       ARG  21 -20.081 -11.517  -5.507
  150    HE   ARG  21           HE       ARG  21 -21.731 -13.887  -6.274
  151   1HH1  ARG  21          1HH2      ARG  21 -23.509 -11.563  -4.666
  152   2HH1  ARG  21          2HH2      ARG  21 -23.950 -13.224  -4.444
  153   1HH2  ARG  21          2HH1      ARG  21 -20.328 -13.138  -3.507
  154   2HH2  ARG  21          1HH1      ARG  21 -21.758 -12.759  -2.607
  155    H    ALA  22           H        ALA  22 -22.739  -8.020  -9.366
  156    HA   ALA  22           HA       ALA  22 -22.131  -9.413 -11.895
  157   1HB   ALA  22          2HB       ALA  22 -24.396  -7.961 -10.776
  158   2HB   ALA  22          3HB       ALA  22 -24.024  -7.422 -12.414
  159   3HB   ALA  22          1HB       ALA  22 -24.362  -9.124 -12.100
  160    H    HIS  23           H        HIS  23 -21.429  -6.399 -10.328
  161    HA   HIS  23           HA       HIS  23 -20.649  -5.130 -12.884
  162   1HB   HIS  23          1HB       HIS  23 -20.355  -4.036 -10.082
  163   2HB   HIS  23          2HB       HIS  23 -20.252  -3.138 -11.574
  164    HD2  HIS  23           HD2      HIS  23 -23.180  -5.483 -11.974
  165    HE1  HIS  23           HE1      HIS  23 -24.814  -1.926 -10.378
  166    HE2  HIS  23           HE2      HIS  23 -25.368  -4.155 -11.472
  167    H    ILE  24           H        ILE  24 -19.215  -7.002 -10.358
  168    HA   ILE  24           HA       ILE  24 -16.531  -5.912 -10.845
  169    HB   ILE  24           HB       ILE  24 -17.371  -8.318  -9.229
  170   1HG1  ILE  24          2HG1      ILE  24 -16.542  -5.554  -8.331
  171   2HG1  ILE  24          1HG1      ILE  24 -18.201  -6.152  -8.329
  172   1HG2  ILE  24          1HG2      ILE  24 -14.730  -6.943  -9.671
  173   2HG2  ILE  24          2HG2      ILE  24 -15.037  -7.878  -8.207
  174   3HG2  ILE  24          3HG2      ILE  24 -15.103  -8.663  -9.785
  175   1HD1  ILE  24          1HD1      ILE  24 -16.555  -8.088  -7.020
  176   2HD1  ILE  24          2HD1      ILE  24 -16.183  -6.506  -6.332
  177   3HD1  ILE  24          3HD1      ILE  24 -17.843  -7.105  -6.321
  178    H    LYS  25           H        LYS  25 -14.754  -7.398 -11.581
  179    HA   LYS  25           HA       LYS  25 -15.810  -9.350 -13.588
  180   1HB   LYS  25          1HB       LYS  25 -14.451  -7.377 -14.440
  181   2HB   LYS  25          2HB       LYS  25 -13.081  -8.052 -13.604
  182   1HG   LYS  25          1HG       LYS  25 -13.111 -10.037 -14.926
  183   2HG   LYS  25          2HG       LYS  25 -14.706  -9.657 -15.576
  184   1HD   LYS  25          1HD       LYS  25 -13.464  -7.460 -16.408
  185   2HD   LYS  25          2HD       LYS  25 -12.038  -8.491 -16.280
  186   1HE   LYS  25          1HE       LYS  25 -14.414  -9.683 -17.613
  187   2HE   LYS  25          2HE       LYS  25 -13.582  -8.404 -18.496
  188   1HZ   LYS  25          2HZ       LYS  25 -11.965 -10.503 -17.252
  189   2HZ   LYS  25          3HZ       LYS  25 -12.822 -10.893 -18.666
  190   3HZ   LYS  25          1HZ       LYS  25 -11.690  -9.626 -18.681
  191    H    GLU  26           H        GLU  26 -12.648  -8.926 -11.951
  192    HA   GLU  26           HA       GLU  26 -12.829 -11.746 -11.085
  193   1HB   GLU  26          2HB       GLU  26 -11.214 -10.930 -13.010
  194   2HB   GLU  26          1HB       GLU  26 -10.252 -10.347 -11.679
  195   1HG   GLU  26          1HG       GLU  26  -9.589 -12.395 -11.158
  196   2HG   GLU  26          2HG       GLU  26 -11.237 -12.999 -11.154
  197    H    TYR  27           H        TYR  27 -10.153 -11.235  -9.714
  198    HA   TYR  27           HA       TYR  27 -10.628  -9.114  -7.835
  199   1HB   TYR  27          2HB       TYR  27 -11.057 -10.429  -5.870
  200   2HB   TYR  27          1HB       TYR  27 -12.223 -10.921  -7.067
  201    HD1  TYR  27           HD2      TYR  27 -11.951 -13.060  -8.332
  202    HD2  TYR  27           HD1      TYR  27  -9.319 -11.958  -5.091
  203    HE1  TYR  27           HE2      TYR  27 -11.133 -15.411  -8.196
  204    HE2  TYR  27           HE1      TYR  27  -8.498 -14.309  -4.959
  205    HH   TYR  27           HH       TYR  27  -8.384 -16.295  -6.236
  206    H    PHE  28           H        PHE  28  -8.824  -9.543  -5.924
  207    HA   PHE  28           HA       PHE  28  -6.597 -11.115  -6.955
  208   1HB   PHE  28          1HB       PHE  28  -6.355  -9.144  -8.355
  209   2HB   PHE  28          2HB       PHE  28  -6.462  -8.088  -6.951
  210    HD1  PHE  28           HD2      PHE  28  -4.342 -10.523  -8.766
  211    HD2  PHE  28           HD1      PHE  28  -4.590  -7.825  -5.405
  212    HE1  PHE  28           HE2      PHE  28  -1.880 -10.712  -8.430
  213    HE2  PHE  28           HE1      PHE  28  -2.134  -8.021  -5.063
  214    HZ   PHE  28           HZ       PHE  28  -0.774  -9.466  -6.576
  215    H    TYR  29           H        TYR  29  -6.627 -12.090  -4.861
  216    HA   TYR  29           HA       TYR  29  -6.682 -10.689  -2.400
  217   1HB   TYR  29          2HB       TYR  29  -6.950 -13.111  -2.498
  218   2HB   TYR  29          1HB       TYR  29  -5.318 -13.297  -3.085
  219    HD1  TYR  29           HD2      TYR  29  -7.093 -11.571  -0.248
  220    HD2  TYR  29           HD1      TYR  29  -3.697 -13.915  -1.520
  221    HE1  TYR  29           HE2      TYR  29  -6.247 -11.616   2.095
  222    HE2  TYR  29           HE1      TYR  29  -2.851 -13.960   0.823
  223    HH   TYR  29           HH       TYR  29  -4.257 -13.667   3.298
  224    H    THR  30           H        THR  30  -5.205  -9.485  -1.393
  225    HA   THR  30           HA       THR  30  -2.848  -8.532  -2.630
  226    HB   THR  30           HB       THR  30  -3.054  -8.711   0.367
  227    HG1  THR  30           HG1      THR  30  -4.432  -6.843   0.177
  228   1HG2  THR  30          2HG2      THR  30  -1.802  -6.970  -1.694
  229   2HG2  THR  30          3HG2      THR  30  -2.421  -6.159  -0.254
  230   3HG2  THR  30          1HG2      THR  30  -1.207  -7.430  -0.099
  231    H    SER  31           H        SER  31  -0.573  -8.847  -1.582
  232    HA   SER  31           HA       SER  31  -0.027 -11.746  -1.614
  233   1HB   SER  31          1HB       SER  31   1.330  -9.805  -2.784
  234   2HB   SER  31          2HB       SER  31   2.097  -9.667  -1.202
  235    HG   SER  31           HG       SER  31   3.197 -11.139  -2.550
  236    H    GLY  32           H        GLY  32   2.339 -11.630   0.040
  237   1HA   GLY  32          2HA       GLY  32   1.044 -11.324   2.721
  238   2HA   GLY  32          1HA       GLY  32   2.225 -12.580   2.352
  239    H    LYS  33           H        LYS  33   2.758  -9.427   1.010
  240    HA   LYS  33           HA       LYS  33   4.767  -8.860   3.152
  241   1HB   LYS  33          2HB       LYS  33   5.250  -8.204   0.249
  242   2HB   LYS  33          1HB       LYS  33   6.413  -8.282   1.550
  243   1HG   LYS  33          2HG       LYS  33   6.009 -10.733   1.721
  244   2HG   LYS  33          1HG       LYS  33   4.921 -10.625   0.358
  245   1HD   LYS  33          1HD       LYS  33   7.762  -9.628   0.181
  246   2HD   LYS  33          2HD       LYS  33   7.360 -11.315  -0.132
  247   1HE   LYS  33          1HE       LYS  33   5.468 -10.054  -1.639
  248   2HE   LYS  33          2HE       LYS  33   6.803  -8.909  -1.761
  249   1HZ   LYS  33          3HZ       LYS  33   8.158 -11.086  -2.178
  250   2HZ   LYS  33          1HZ       LYS  33   6.650 -11.692  -2.669
  251   3HZ   LYS  33          2HZ       LYS  33   7.314 -10.336  -3.447
  252    H    CYS  34           H        CYS  34   2.690  -7.570   3.746
  253    HA   CYS  34           HA       CYS  34   3.150  -4.797   2.981
  254   1HB   CYS  34          1HB       CYS  34   0.960  -6.378   1.753
  255   2HB   CYS  34          2HB       CYS  34   0.506  -4.788   2.369
  256    H    SER  35           H        SER  35   1.340  -3.391   4.059
  257    HA   SER  35           HA       SER  35   0.698  -4.644   6.696
  258   1HB   SER  35          1HB       SER  35   2.155  -2.366   6.194
  259   2HB   SER  35          2HB       SER  35   0.545  -1.710   6.494
  260    HG   SER  35           HG       SER  35   1.116  -1.957   8.501
  261    H    ASN  36           H        ASN  36  -0.865  -4.406   3.994
  262    HA   ASN  36           HA       ASN  36  -3.421  -3.598   5.290
  263   1HB   ASN  36          1HB       ASN  36  -2.193  -1.907   3.540
  264   2HB   ASN  36          2HB       ASN  36  -3.154  -2.865   2.440
  265   1HD2  ASN  36          1HD2      ASN  36  -4.461  -0.903   5.656
  266   2HD2  ASN  36          2HD2      ASN  36  -3.842   0.086   4.422
  267    HA   PRO  37           HA       PRO  37  -3.282  -7.691   2.931
  268   1HB   PRO  37          1HB       PRO  37  -4.721  -8.774   5.210
  269   2HB   PRO  37          2HB       PRO  37  -3.138  -9.252   4.588
  270   1HG   PRO  37          2HG       PRO  37  -3.689  -7.763   6.978
  271   2HG   PRO  37          1HG       PRO  37  -2.120  -8.181   6.326
  272   1HD   PRO  37          1HD       PRO  37  -3.365  -5.586   6.387
  273   2HD   PRO  37          2HD       PRO  37  -1.778  -6.012   5.719
  274    H    ALA  38           H        ALA  38  -5.070  -8.212   1.668
  275    HA   ALA  38           HA       ALA  38  -7.790  -7.957   2.537
  276   1HB   ALA  38          3HB       ALA  38  -6.639  -5.501   2.082
  277   2HB   ALA  38          1HB       ALA  38  -7.373  -5.853   0.518
  278   3HB   ALA  38          2HB       ALA  38  -8.368  -5.830   1.974
  279    H    VAL  39           H        VAL  39  -8.754  -7.068  -0.112
  280    HA   VAL  39           HA       VAL  39  -7.631  -9.080  -1.942
  281    HB   VAL  39           HB       VAL  39  -9.917  -9.643  -0.442
  282   1HG1  VAL  39          1HG1      VAL  39 -11.223  -8.009  -1.784
  283   2HG1  VAL  39          2HG1      VAL  39 -10.800  -8.907  -3.242
  284   3HG1  VAL  39          3HG1      VAL  39 -11.794  -9.663  -1.997
  285   1HG2  VAL  39          2HG2      VAL  39  -8.964 -10.725  -3.093
  286   2HG2  VAL  39          3HG2      VAL  39  -8.566 -11.325  -1.483
  287   3HG2  VAL  39          1HG2      VAL  39 -10.206 -11.503  -2.109
  288    H    VAL  40           H        VAL  40  -8.160  -8.440  -4.155
  289    HA   VAL  40           HA       VAL  40  -9.214  -5.660  -4.208
  290    HB   VAL  40           HB       VAL  40  -6.773  -6.763  -5.586
  291   1HG1  VAL  40          3HG1      VAL  40  -8.530  -4.850  -6.652
  292   2HG1  VAL  40          1HG1      VAL  40  -7.252  -3.911  -5.894
  293   3HG1  VAL  40          2HG1      VAL  40  -6.855  -5.110  -7.122
  294   1HG2  VAL  40          3HG2      VAL  40  -6.607  -6.039  -3.223
  295   2HG2  VAL  40          1HG2      VAL  40  -5.688  -4.980  -4.293
  296   3HG2  VAL  40          2HG2      VAL  40  -7.262  -4.464  -3.677
  297    H    PHE  41           H        PHE  41 -10.998  -5.561  -5.347
  298    HA   PHE  41           HA       PHE  41 -11.553  -7.576  -7.362
  299   1HB   PHE  41          2HB       PHE  41 -13.121  -5.236  -6.287
  300   2HB   PHE  41          1HB       PHE  41 -13.702  -6.203  -7.620
  301    HD1  PHE  41           HD2      PHE  41 -13.349  -8.903  -7.127
  302    HD2  PHE  41           HD1      PHE  41 -13.985  -5.797  -4.196
  303    HE1  PHE  41           HE2      PHE  41 -14.262 -10.591  -5.536
  304    HE2  PHE  41           HE1      PHE  41 -14.907  -7.482  -2.609
  305    HZ   PHE  41           HZ       PHE  41 -15.054  -9.877  -3.282
  306    H    VAL  42           H        VAL  42 -11.558  -7.329  -9.477
  307    HA   VAL  42           HA       VAL  42 -10.526  -4.736 -10.557
  308    HB   VAL  42           HB       VAL  42 -10.337  -6.505 -12.616
  309   1HG1  VAL  42          3HG2      VAL  42  -8.504  -5.450 -10.539
  310   2HG1  VAL  42          1HG2      VAL  42  -7.876  -6.751 -11.550
  311   3HG1  VAL  42          2HG2      VAL  42  -8.441  -5.255 -12.292
  312   1HG2  VAL  42          1HG1      VAL  42 -10.992  -8.383 -11.071
  313   2HG2  VAL  42          2HG1      VAL  42  -9.432  -8.598 -11.865
  314   3HG2  VAL  42          3HG1      VAL  42  -9.500  -8.077 -10.182
  315    H    THR  43           H        THR  43 -12.908  -4.151 -10.242
  316    HA   THR  43           HA       THR  43 -15.017  -5.499 -11.585
  317    HB   THR  43           HB       THR  43 -16.400  -3.680 -10.998
  318    HG1  THR  43           HG1      THR  43 -15.345  -1.639 -10.436
  319   1HG2  THR  43          3HG2      THR  43 -14.744  -4.821  -9.150
  320   2HG2  THR  43          1HG2      THR  43 -14.396  -3.110  -8.901
  321   3HG2  THR  43          2HG2      THR  43 -16.049  -3.705  -8.748
  322    H    ARG  44           H        ARG  44 -16.426  -3.534 -12.946
  323    HA   ARG  44           HA       ARG  44 -15.746  -4.007 -15.578
  324   1HB   ARG  44          2HB       ARG  44 -16.978  -1.759 -16.055
  325   2HB   ARG  44          1HB       ARG  44 -17.873  -3.071 -15.293
  326   1HG   ARG  44          1HG       ARG  44 -16.623  -1.604 -13.198
  327   2HG   ARG  44          2HG       ARG  44 -17.359  -0.428 -14.282
  328   1HD   ARG  44          1HD       ARG  44 -19.512  -1.456 -14.080
  329   2HD   ARG  44          2HD       ARG  44 -18.831  -2.877 -13.286
  330    HE   ARG  44           HE       ARG  44 -18.992  -1.692 -11.264
  331   1HH1  ARG  44          2HH1      ARG  44 -16.991   0.460 -11.845
  332   2HH1  ARG  44          1HH1      ARG  44 -17.906   1.779 -12.495
  333   1HH2  ARG  44          1HH2      ARG  44 -20.959   0.251 -11.876
  334   2HH2  ARG  44          2HH2      ARG  44 -20.117   1.728 -11.547
  335    H    LYS  45           H        LYS  45 -15.021  -0.870 -13.945
  336    HA   LYS  45           HA       LYS  45 -13.243   0.085 -15.963
  337   1HB   LYS  45          1HB       LYS  45 -13.628   0.633 -13.056
  338   2HB   LYS  45          2HB       LYS  45 -12.107   1.129 -13.757
  339   1HG   LYS  45          1HG       LYS  45 -13.371   2.327 -15.553
  340   2HG   LYS  45          2HG       LYS  45 -14.869   1.910 -14.720
  341   1HD   LYS  45          1HD       LYS  45 -13.878   3.040 -12.657
  342   2HD   LYS  45          2HD       LYS  45 -12.617   3.666 -13.719
  343   1HE   LYS  45          1HE       LYS  45 -14.814   4.322 -15.165
  344   2HE   LYS  45          2HE       LYS  45 -15.486   4.411 -13.537
  345   1HZ   LYS  45          1HZ       LYS  45 -13.432   5.770 -12.991
  346   2HZ   LYS  45          2HZ       LYS  45 -13.206   5.914 -14.668
  347   3HZ   LYS  45          3HZ       LYS  45 -14.619   6.521 -13.946
  348    H    ASN  46           H        ASN  46 -12.945  -2.169 -13.356
  349    HA   ASN  46           HA       ASN  46 -11.469  -3.871 -12.950
  350   1HB   ASN  46          1HB       ASN  46 -11.149  -3.308 -15.724
  351   2HB   ASN  46          2HB       ASN  46  -9.531  -3.499 -15.057
  352   1HD2  ASN  46          2HD2      ASN  46  -9.316  -6.489 -14.344
  353   2HD2  ASN  46          1HD2      ASN  46  -9.415  -6.147 -16.004
  354    H    ARG  47           H        ARG  47 -10.868  -0.826 -12.433
  355    HA   ARG  47           HA       ARG  47  -8.005  -0.713 -12.116
  356   1HB   ARG  47          2HB       ARG  47 -10.209   0.926 -11.382
  357   2HB   ARG  47          1HB       ARG  47  -9.364   0.528  -9.889
  358   1HG   ARG  47          1HG       ARG  47  -7.207   1.173 -11.121
  359   2HG   ARG  47          2HG       ARG  47  -8.249   1.865 -12.364
  360   1HD   ARG  47          1HD       ARG  47  -9.006   2.661  -9.640
  361   2HD   ARG  47          2HD       ARG  47  -7.386   3.188 -10.097
  362    HE   ARG  47           HE       ARG  47  -9.899   3.962 -11.496
  363   1HH1  ARG  47          2HH1      ARG  47  -7.000   4.237 -13.276
  364   2HH1  ARG  47          1HH1      ARG  47  -8.219   5.379 -13.735
  365   1HH2  ARG  47          1HH2      ARG  47  -7.539   5.740 -10.091
  366   2HH2  ARG  47          2HH2      ARG  47  -7.822   6.829 -11.409
  367    H    GLN  48           H        GLN  48  -6.988  -1.086  -9.801
  368    HA   GLN  48           HA       GLN  48  -8.124  -3.644  -8.959
  369   1HB   GLN  48          2HB       GLN  48  -5.474  -2.363  -8.728
  370   2HB   GLN  48          1HB       GLN  48  -5.939  -3.421  -7.390
  371   1HG   GLN  48          2HG       GLN  48  -6.529  -5.188  -9.004
  372   2HG   GLN  48          1HG       GLN  48  -6.112  -4.147 -10.329
  373   1HE2  GLN  48          2HE2      GLN  48  -3.604  -5.445  -7.494
  374   2HE2  GLN  48          1HE2      GLN  48  -3.479  -3.782  -7.810
  375    H    VAL  49           H        VAL  49  -9.962  -2.645  -8.207
  376    HA   VAL  49           HA       VAL  49 -10.125  -0.766  -6.091
  377    HB   VAL  49           HB       VAL  49 -12.252  -2.819  -6.309
  378   1HG1  VAL  49          1HG1      VAL  49 -12.078   0.189  -6.218
  379   2HG1  VAL  49          2HG1      VAL  49 -13.605  -0.675  -6.403
  380   3HG1  VAL  49          3HG1      VAL  49 -12.638  -0.896  -4.944
  381   1HG2  VAL  49          1HG2      VAL  49 -11.253  -1.268  -8.663
  382   2HG2  VAL  49          2HG2      VAL  49 -12.122  -2.800  -8.644
  383   3HG2  VAL  49          3HG2      VAL  49 -12.997  -1.285  -8.421
  384    H    CYS  50           H        CYS  50 -10.772  -1.232  -3.839
  385    HA   CYS  50           HA       CYS  50  -9.600  -3.807  -2.895
  386   1HB   CYS  50          2HB       CYS  50  -8.657  -1.468  -2.196
  387   2HB   CYS  50          1HB       CYS  50 -10.062  -1.387  -1.161
  388    H    ALA  51           H        ALA  51 -10.664  -4.561  -0.734
  389    HA   ALA  51           HA       ALA  51 -13.330  -3.636  -0.161
  390   1HB   ALA  51          2HB       ALA  51 -12.948  -5.918  -2.041
  391   2HB   ALA  51          3HB       ALA  51 -14.236  -6.052  -0.847
  392   3HB   ALA  51          1HB       ALA  51 -14.232  -4.711  -1.988
  393    H    ASN  52           H        ASN  52 -10.774  -4.557   1.189
  394    HA   ASN  52           HA       ASN  52 -10.317  -5.545   3.269
  395   1HB   ASN  52          1HB       ASN  52 -12.583  -4.499   3.752
  396   2HB   ASN  52          2HB       ASN  52 -13.290  -6.075   3.394
  397   1HD2  ASN  52          1HD2      ASN  52 -11.513  -5.172   6.872
  398   2HD2  ASN  52          2HD2      ASN  52 -10.497  -4.899   5.540
  399    HA   PRO  53           HA       PRO  53 -10.178  -9.863   2.206
  400   1HB   PRO  53          1HB       PRO  53  -8.908 -10.711   4.539
  401   2HB   PRO  53          2HB       PRO  53  -8.080 -10.032   3.130
  402   1HG   PRO  53          1HG       PRO  53  -8.539  -8.810   5.773
  403   2HG   PRO  53          2HG       PRO  53  -7.418  -8.323   4.518
  404   1HD   PRO  53          1HD       PRO  53  -9.926  -7.101   5.177
  405   2HD   PRO  53          2HD       PRO  53  -8.835  -6.661   3.850
  406    H    GLU  54           H        GLU  54 -10.598  -9.527   5.750
  407    HA   GLU  54           HA       GLU  54 -12.498 -11.763   5.772
  408   1HB   GLU  54          1HB       GLU  54 -10.661 -11.134   7.541
  409   2HB   GLU  54          2HB       GLU  54 -11.904 -10.051   8.167
  410   1HG   GLU  54          1HG       GLU  54 -12.832 -12.791   7.548
  411   2HG   GLU  54          2HG       GLU  54 -11.680 -12.677   8.878
  412    H    LYS  55           H        LYS  55 -13.595  -9.621   4.317
  413    HA   LYS  55           HA       LYS  55 -15.502  -8.306   6.169
  414   1HB   LYS  55          2HB       LYS  55 -14.367  -7.633   3.620
  415   2HB   LYS  55          1HB       LYS  55 -16.121  -7.695   3.465
  416   1HG   LYS  55          1HG       LYS  55 -16.251  -6.265   5.558
  417   2HG   LYS  55          2HG       LYS  55 -14.507  -6.045   5.425
  418   1HD   LYS  55          1HD       LYS  55 -14.680  -4.732   3.533
  419   2HD   LYS  55          2HD       LYS  55 -16.151  -5.534   2.984
  420   1HE   LYS  55          1HE       LYS  55 -17.213  -3.678   3.751
  421   2HE   LYS  55          2HE       LYS  55 -16.965  -4.381   5.350
  422   1HZ   LYS  55          3HZ       LYS  55 -14.973  -2.637   4.018
  423   2HZ   LYS  55          1HZ       LYS  55 -16.163  -2.046   5.076
  424   3HZ   LYS  55          2HZ       LYS  55 -14.992  -3.140   5.640
  425    H    LYS  56           H        LYS  56 -15.408 -11.277   5.258
  426    HA   LYS  56           HA       LYS  56 -16.996 -12.944   4.892
  427   1HB   LYS  56          1HB       LYS  56 -18.587 -10.623   5.832
  428   2HB   LYS  56          2HB       LYS  56 -19.485 -11.893   5.001
  429   1HG   LYS  56          1HG       LYS  56 -19.299 -13.276   6.772
  430   2HG   LYS  56          2HG       LYS  56 -17.557 -13.018   6.862
  431   1HD   LYS  56          1HD       LYS  56 -18.049 -10.799   7.988
  432   2HD   LYS  56          2HD       LYS  56 -19.736 -11.303   8.081
  433   1HE   LYS  56          1HE       LYS  56 -19.326 -12.756   9.778
  434   2HE   LYS  56          2HE       LYS  56 -17.836 -13.338   9.035
  435   1HZ   LYS  56          2HZ       LYS  56 -17.851 -10.622  10.116
  436   2HZ   LYS  56          3HZ       LYS  56 -17.817 -11.909  11.225
  437   3HZ   LYS  56          1HZ       LYS  56 -16.592 -11.759  10.058
  438    H    TRP  57           H        TRP  57 -19.095 -10.459   3.524
  439    HA   TRP  57           HA       TRP  57 -19.753 -11.793   1.188
  440   1HB   TRP  57          1HB       TRP  57 -20.436  -9.652   0.285
  441   2HB   TRP  57          2HB       TRP  57 -20.802  -9.684   2.013
  442    HD1  TRP  57           HD1      TRP  57 -19.689  -7.802   3.434
  443    HE1  TRP  57           HE1      TRP  57 -18.064  -5.880   2.858
  444    HE3  TRP  57           HE3      TRP  57 -18.434  -9.194  -1.258
  445    HZ2  TRP  57           HZ2      TRP  57 -16.452  -5.025   0.603
  446    HZ3  TRP  57           HZ3      TRP  57 -16.985  -7.801  -2.664
  447    HH2  TRP  57           HH2      TRP  57 -15.989  -5.712  -1.749
  448    H    VAL  58           H        VAL  58 -16.725 -10.168   1.814
  449    HA   VAL  58           HA       VAL  58 -15.943  -9.934  -0.967
  450    HB   VAL  58           HB       VAL  58 -13.547 -10.087   0.136
  451   1HG1  VAL  58          3HG1      VAL  58 -15.028  -8.101  -0.769
  452   2HG1  VAL  58          1HG1      VAL  58 -15.074  -7.668   0.939
  453   3HG1  VAL  58          2HG1      VAL  58 -13.528  -7.803   0.098
  454   1HG2  VAL  58          3HG2      VAL  58 -14.471 -10.881   2.302
  455   2HG2  VAL  58          1HG2      VAL  58 -13.467  -9.439   2.422
  456   3HG2  VAL  58          2HG2      VAL  58 -15.219  -9.300   2.494
  457    H    ARG  59           H        ARG  59 -15.278 -12.395   1.524
  458    HA   ARG  59           HA       ARG  59 -13.716 -14.074  -0.212
  459   1HB   ARG  59          1HB       ARG  59 -15.109 -14.425   2.420
  460   2HB   ARG  59          2HB       ARG  59 -14.599 -15.869   1.544
  461   1HG   ARG  59          2HG       ARG  59 -12.334 -15.306   1.676
  462   2HG   ARG  59          1HG       ARG  59 -12.672 -13.590   1.901
  463   1HD   ARG  59          1HD       ARG  59 -13.447 -13.972   4.159
  464   2HD   ARG  59          2HD       ARG  59 -13.367 -15.721   3.942
  465    HE   ARG  59           HE       ARG  59 -10.809 -14.342   3.547
  466   1HH1  ARG  59          2HH2      ARG  59 -11.121 -17.310   4.987
  467   2HH1  ARG  59          1HH2      ARG  59 -12.197 -16.725   6.212
  468   1HH2  ARG  59          1HH1      ARG  59  -9.898 -13.872   5.814
  469   2HH2  ARG  59          2HH1      ARG  59 -10.445 -14.929   7.071
  470    H    GLU  60           H        GLU  60 -17.147 -13.751   0.485
  471    HA   GLU  60           HA       GLU  60 -17.989 -16.127  -0.943
  472   1HB   GLU  60          1HB       GLU  60 -19.330 -13.665   0.106
  473   2HB   GLU  60          2HB       GLU  60 -20.184 -14.628  -1.075
  474   1HG   GLU  60          1HG       GLU  60 -19.130 -16.489   0.731
  475   2HG   GLU  60          2HG       GLU  60 -19.714 -15.182   1.731
  476    H    TYR  61           H        TYR  61 -16.797 -13.080  -1.908
  477    HA   TYR  61           HA       TYR  61 -18.059 -13.143  -4.573
  478   1HB   TYR  61          2HB       TYR  61 -16.559 -11.193  -2.927
  479   2HB   TYR  61          1HB       TYR  61 -16.210 -11.123  -4.632
  480    HD1  TYR  61           HD1      TYR  61 -19.250 -11.662  -2.478
  481    HD2  TYR  61           HD2      TYR  61 -17.502  -9.574  -5.827
  482    HE1  TYR  61           HE1      TYR  61 -21.358 -10.377  -2.774
  483    HE2  TYR  61           HE2      TYR  61 -19.623  -8.301  -6.137
  484    HH   TYR  61           HH       TYR  61 -22.535  -9.110  -4.370
  485    H    ILE  62           H        ILE  62 -15.032 -13.766  -2.930
  486    HA   ILE  62           HA       ILE  62 -13.324 -13.948  -5.211
  487    HB   ILE  62           HB       ILE  62 -13.222 -15.354  -2.524
  488   1HG1  ILE  62          2HG1      ILE  62 -11.674 -12.958  -3.545
  489   2HG1  ILE  62          1HG1      ILE  62 -13.137 -12.829  -2.571
  490   1HG2  ILE  62          1HG2      ILE  62 -11.514 -15.514  -4.919
  491   2HG2  ILE  62          2HG2      ILE  62 -10.644 -15.174  -3.422
  492   3HG2  ILE  62          3HG2      ILE  62 -11.645 -16.621  -3.552
  493   1HD1  ILE  62          2HD1      ILE  62 -11.544 -14.678  -1.199
  494   2HD1  ILE  62          3HD1      ILE  62 -10.417 -13.429  -1.730
  495   3HD1  ILE  62          1HD1      ILE  62 -11.817 -12.995  -0.749
  496    H    ASN  63           H        ASN  63 -15.311 -16.396  -3.541
  497    HA   ASN  63           HA       ASN  63 -14.509 -18.520  -5.366
  498   1HB   ASN  63          1HB       ASN  63 -16.820 -18.339  -3.408
  499   2HB   ASN  63          2HB       ASN  63 -16.330 -19.804  -4.257
  500   1HD2  ASN  63          1HD2      ASN  63 -12.992 -18.847  -3.087
  501   2HD2  ASN  63          2HD2      ASN  63 -13.562 -20.406  -3.447
  502    H    SER  64           H        SER  64 -17.329 -16.376  -5.048
  503    HA   SER  64           HA       SER  64 -18.974 -17.528  -7.032
  504   1HB   SER  64          2HB       SER  64 -18.609 -14.700  -6.055
  505   2HB   SER  64          1HB       SER  64 -19.731 -15.060  -7.368
  506    HG   SER  64           HG       SER  64 -21.067 -15.753  -5.934
  507    H    LEU  65           H        LEU  65 -16.112 -15.510  -7.345
  508    HA   LEU  65           HA       LEU  65 -16.514 -15.069 -10.213
  509   1HB   LEU  65          1HB       LEU  65 -14.100 -14.607  -8.441
  510   2HB   LEU  65          2HB       LEU  65 -14.230 -14.090 -10.105
  511    HG   LEU  65           HG       LEU  65 -16.333 -13.295  -8.108
  512   1HD1  LEU  65          1HD1      LEU  65 -14.034 -12.691  -7.237
  513   2HD1  LEU  65          2HD1      LEU  65 -13.814 -11.716  -8.691
  514   3HD1  LEU  65          3HD1      LEU  65 -15.088 -11.309  -7.540
  515   1HD2  LEU  65          1HD2      LEU  65 -15.867 -12.873 -10.870
  516   2HD2  LEU  65          2HD2      LEU  65 -17.117 -12.132  -9.870
  517   3HD2  LEU  65          3HD2      LEU  65 -15.559 -11.331 -10.073
  518    H    GLU  66           H        GLU  66 -14.178 -16.945  -8.246
  519    HA   GLU  66           HA       GLU  66 -14.001 -18.872 -10.515
  520   1HB   GLU  66          1HB       GLU  66 -12.017 -17.093 -10.155
  521   2HB   GLU  66          2HB       GLU  66 -11.505 -18.310  -8.987
  522   1HG   GLU  66          1HG       GLU  66 -11.284 -19.975 -10.634
  523   2HG   GLU  66          2HG       GLU  66 -12.314 -19.113 -11.776
  524    H    MET  67           H        MET  67 -15.155 -20.467  -9.397
  525    HA   MET  67           HA       MET  67 -14.164 -21.229  -6.695
  526   1HB   MET  67          1HB       MET  67 -16.647 -20.862  -7.148
  527   2HB   MET  67          2HB       MET  67 -16.592 -22.322  -8.136
  528   1HG   MET  67          1HG       MET  67 -16.217 -23.707  -6.312
  529   2HG   MET  67          2HG       MET  67 -15.459 -22.427  -5.365
  530   1HE   MET  67          3HE       MET  67 -17.744 -24.708  -5.441
  531   2HE   MET  67          2HE       MET  67 -17.885 -24.209  -3.755
  532   3HE   MET  67          1HE       MET  67 -19.302 -24.181  -4.804
  533    H    SER  68           H        SER  68 -12.194 -22.193  -7.648
  534    HA   SER  68           HA       SER  68 -12.592 -24.587  -9.333
  535   1HB   SER  68          1HB       SER  68 -10.491 -22.723  -8.960
  536   2HB   SER  68          2HB       SER  68  -9.889 -24.275  -8.379
  537    HG   SER  68           HG       SER  68  -9.786 -23.687 -10.759
  538    H    SER   1           H        SER   1  -6.933  13.721   3.009
  539    HA   SER   1           HA       SER   1  -7.062  14.207   0.079
  540   1HB   SER   1          1HB       SER   1  -6.186  11.627   0.355
  541   2HB   SER   1          2HB       SER   1  -5.123  13.033   0.280
  542    HG   SER   1           HG       SER   1  -4.919  13.026   2.436
  543    HA   PRO   2           HA       PRO   2 -10.895  12.128  -0.407
  544   1HB   PRO   2          1HB       PRO   2 -10.113  10.694  -2.780
  545   2HB   PRO   2          2HB       PRO   2 -11.065  12.180  -2.677
  546   1HG   PRO   2          1HG       PRO   2  -8.336  11.884  -3.577
  547   2HG   PRO   2          2HG       PRO   2  -9.294  13.367  -3.492
  548   1HD   PRO   2          1HD       PRO   2  -7.107  12.571  -1.787
  549   2HD   PRO   2          2HD       PRO   2  -8.069  14.058  -1.700
  550    H    TYR   3           H        TYR   3 -11.700   9.746  -0.977
  551    HA   TYR   3           HA       TYR   3 -10.121   7.935   0.747
  552   1HB   TYR   3          1HB       TYR   3 -12.875   7.669  -0.497
  553   2HB   TYR   3          2HB       TYR   3 -12.133   6.455   0.545
  554    HD1  TYR   3           HD1      TYR   3 -11.519   7.054   2.928
  555    HD2  TYR   3           HD2      TYR   3 -13.875   9.652   0.408
  556    HE1  TYR   3           HE1      TYR   3 -12.282   8.315   4.940
  557    HE2  TYR   3           HE2      TYR   3 -14.639  10.911   2.420
  558    HH   TYR   3           HH       TYR   3 -14.098   9.759   5.630
  559    H    SER   4           H        SER   4  -8.825   6.374  -0.105
  560    HA   SER   4           HA       SER   4  -9.072   5.828  -3.030
  561   1HB   SER   4          1HB       SER   4  -6.887   6.706  -2.293
  562   2HB   SER   4          2HB       SER   4  -6.734   5.371  -1.152
  563    HG   SER   4           HG       SER   4  -5.720   4.589  -2.867
  564    H    SER   5           H        SER   5 -10.390   4.060  -3.258
  565    HA   SER   5           HA       SER   5  -9.885   1.721  -1.465
  566   1HB   SER   5          1HB       SER   5 -12.140   1.009  -1.913
  567   2HB   SER   5          2HB       SER   5 -12.216   2.726  -1.513
  568    HG   SER   5           HG       SER   5 -12.026   3.032  -3.879
  569    H    ASP   6           H        ASP   6  -7.988   1.357  -2.977
  570    HA   ASP   6           HA       ASP   6  -8.657  -0.674  -4.924
  571   1HB   ASP   6          1HB       ASP   6  -7.906   0.481  -6.932
  572   2HB   ASP   6          2HB       ASP   6  -9.204   1.398  -6.215
  573    H    THR   7           H        THR   7  -6.173  -0.193  -6.474
  574    HA   THR   7           HA       THR   7  -4.385  -1.438  -4.566
  575    HB   THR   7           HB       THR   7  -4.416  -2.103  -6.957
  576    HG1  THR   7           HG1      THR   7  -2.518  -2.555  -6.006
  577   1HG2  THR   7          3HG2      THR   7  -4.805   0.291  -7.752
  578   2HG2  THR   7          1HG2      THR   7  -3.079   0.556  -7.505
  579   3HG2  THR   7          2HG2      THR   7  -3.629  -0.639  -8.679
  580    H    THR   8           H        THR   8  -1.990  -0.555  -4.577
  581    HA   THR   8           HA       THR   8  -1.851   2.392  -4.632
  582    HB   THR   8           HB       THR   8  -0.916   1.175  -2.082
  583    HG1  THR   8           HG1      THR   8  -3.637   1.823  -2.474
  584   1HG2  THR   8          3HG2      THR   8  -1.652   3.764  -3.196
  585   2HG2  THR   8          1HG2      THR   8  -2.449   3.472  -1.649
  586   3HG2  THR   8          2HG2      THR   8  -0.690   3.398  -1.763
  587    HA   PRO   9           HA       PRO   9   2.063   0.764  -6.155
  588   1HB   PRO   9          1HB       PRO   9   2.924   3.490  -6.555
  589   2HB   PRO   9          2HB       PRO   9   2.428   2.319  -7.782
  590   1HG   PRO   9          1HG       PRO   9   0.964   4.630  -6.848
  591   2HG   PRO   9          2HG       PRO   9   0.470   3.463  -8.077
  592   1HD   PRO   9          1HD       PRO   9  -0.560   3.760  -5.426
  593   2HD   PRO   9          2HD       PRO   9  -1.041   2.593  -6.647
  594    H    CYS  10           H        CYS  10   3.066   0.070  -4.239
  595    HA   CYS  10           HA       CYS  10   4.718   2.103  -2.856
  596   1HB   CYS  10          2HB       CYS  10   2.909   0.166  -1.383
  597   2HB   CYS  10          1HB       CYS  10   4.041   1.293  -0.638
  598    H    CYS  11           H        CYS  11   6.462   1.147  -1.627
  599    HA   CYS  11           HA       CYS  11   7.238  -1.444  -2.807
  600   1HB   CYS  11          2HB       CYS  11   9.192  -0.373  -3.082
  601   2HB   CYS  11          1HB       CYS  11   8.657   0.982  -2.110
  602    H    PHE  12           H        PHE  12   8.429  -2.973  -1.241
  603    HA   PHE  12           HA       PHE  12   6.917  -3.026   1.335
  604   1HB   PHE  12          1HB       PHE  12   6.553  -4.977  -0.133
  605   2HB   PHE  12          2HB       PHE  12   8.273  -5.286  -0.159
  606    HD1  PHE  12           HD2      PHE  12   5.568  -4.627   2.374
  607    HD2  PHE  12           HD1      PHE  12   9.092  -6.894   1.335
  608    HE1  PHE  12           HE2      PHE  12   5.380  -5.897   4.511
  609    HE2  PHE  12           HE1      PHE  12   8.905  -8.163   3.473
  610    HZ   PHE  12           HZ       PHE  12   7.049  -7.664   5.060
  611    H    ALA  13           H        ALA  13  10.056  -4.314   0.172
  612    HA   ALA  13           HA       ALA  13  11.255  -3.291   2.713
  613   1HB   ALA  13          1HB       ALA  13  11.474  -5.859   1.302
  614   2HB   ALA  13          2HB       ALA  13  13.031  -5.164   1.749
  615   3HB   ALA  13          3HB       ALA  13  11.816  -5.473   2.989
  616    H    TYR  14           H        TYR  14  13.418  -2.442   2.579
  617    HA   TYR  14           HA       TYR  14  13.912  -1.253  -0.091
  618   1HB   TYR  14          1HB       TYR  14  15.486  -0.355   2.278
  619   2HB   TYR  14          2HB       TYR  14  14.840   0.588   0.942
  620    HD1  TYR  14           HD1      TYR  14  12.439   1.280   0.910
  621    HD2  TYR  14           HD2      TYR  14  14.177  -0.781   4.280
  622    HE1  TYR  14           HE1      TYR  14  10.508   1.966   2.328
  623    HE2  TYR  14           HE2      TYR  14  12.247  -0.093   5.698
  624    HH   TYR  14           HH       TYR  14  10.086   0.722   5.598
  625    H    ILE  15           H        ILE  15  15.892  -1.566  -1.154
  626    HA   ILE  15           HA       ILE  15  17.449  -3.885  -0.306
  627    HB   ILE  15           HB       ILE  15  17.036  -3.438  -2.696
  628   1HG1  ILE  15          2HG1      ILE  15  19.979  -3.005  -2.173
  629   2HG1  ILE  15          1HG1      ILE  15  19.191  -4.538  -1.800
  630   1HG2  ILE  15          3HG2      ILE  15  17.603  -0.796  -1.971
  631   2HG2  ILE  15          1HG2      ILE  15  18.971  -1.278  -2.974
  632   3HG2  ILE  15          2HG2      ILE  15  17.330  -1.393  -3.607
  633   1HD1  ILE  15          2HD1      ILE  15  18.275  -4.338  -4.258
  634   2HD1  ILE  15          3HD1      ILE  15  19.634  -3.235  -4.471
  635   3HD1  ILE  15          1HD1      ILE  15  19.923  -4.906  -3.988
  636    H    ALA  16           H        ALA  16  19.112  -3.761   1.121
  637    HA   ALA  16           HA       ALA  16  20.173  -1.184   1.974
  638   1HB   ALA  16          3HB       ALA  16  20.054  -3.769   3.059
  639   2HB   ALA  16          1HB       ALA  16  21.771  -3.472   2.788
  640   3HB   ALA  16          2HB       ALA  16  20.831  -2.361   3.784
  641    H    ARG  17           H        ARG  17  21.050  -0.418  -0.067
  642    HA   ARG  17           HA       ARG  17  23.800  -0.657  -0.420
  643   1HB   ARG  17          2HB       ARG  17  22.419  -2.969  -1.458
  644   2HB   ARG  17          1HB       ARG  17  23.190  -2.103  -2.765
  645   1HG   ARG  17          1HG       ARG  17  24.866  -2.330  -0.363
  646   2HG   ARG  17          2HG       ARG  17  24.463  -3.883  -1.095
  647   1HD   ARG  17          1HD       ARG  17  25.758  -3.487  -2.916
  648   2HD   ARG  17          2HD       ARG  17  25.201  -1.819  -3.054
  649    HE   ARG  17           HE       ARG  17  27.096  -2.374  -0.859
  650   1HH1  ARG  17          1HH2      ARG  17  27.016   0.562  -2.088
  651   2HH1  ARG  17          2HH2      ARG  17  28.694   0.264  -1.773
  652   1HH2  ARG  17          1HH1      ARG  17  27.843  -1.756  -4.381
  653   2HH2  ARG  17          2HH1      ARG  17  29.214  -2.113  -3.385
  654    HA   PRO  18           HA       PRO  18  22.005   2.768  -2.755
  655   1HB   PRO  18          1HB       PRO  18  24.683   3.576  -3.454
  656   2HB   PRO  18          2HB       PRO  18  23.566   4.363  -2.348
  657   1HG   PRO  18          1HG       PRO  18  25.906   2.811  -1.679
  658   2HG   PRO  18          2HG       PRO  18  24.798   3.635  -0.578
  659   1HD   PRO  18          1HD       PRO  18  25.067   0.813  -0.992
  660   2HD   PRO  18          2HD       PRO  18  23.872   1.639   0.025
  661    H    LEU  19           H        LEU  19  21.143   1.731  -4.521
  662    HA   LEU  19           HA       LEU  19  22.341   0.054  -6.378
  663   1HB   LEU  19          2HB       LEU  19  20.250   2.192  -6.870
  664   2HB   LEU  19          1HB       LEU  19  20.617   0.885  -7.994
  665    HG   LEU  19           HG       LEU  19  19.609   0.574  -5.151
  666   1HD1  LEU  19          1HD1      LEU  19  18.281   0.957  -7.665
  667   2HD1  LEU  19          2HD1      LEU  19  17.966  -0.686  -7.106
  668   3HD1  LEU  19          3HD1      LEU  19  17.563   0.688  -6.077
  669   1HD2  LEU  19          1HD2      LEU  19  20.763  -1.321  -7.141
  670   2HD2  LEU  19          2HD2      LEU  19  20.815  -1.374  -5.379
  671   3HD2  LEU  19          3HD2      LEU  19  19.355  -1.873  -6.234
  672    HA   PRO  20           HA       PRO  20  25.330   2.477  -8.537
  673   1HB   PRO  20          1HB       PRO  20  24.829   1.181 -11.067
  674   2HB   PRO  20          2HB       PRO  20  26.158   0.882  -9.941
  675   1HG   PRO  20          1HG       PRO  20  23.902  -0.822 -10.481
  676   2HG   PRO  20          2HG       PRO  20  25.207  -1.100  -9.324
  677   1HD   PRO  20          1HD       PRO  20  22.459  -0.371  -8.779
  678   2HD   PRO  20          2HD       PRO  20  23.752  -0.715  -7.616
  679    H    ARG  21           H        ARG  21  24.931   4.543  -9.226
  680    HA   ARG  21           HA       ARG  21  22.413   5.405 -10.257
  681   1HB   ARG  21          1HB       ARG  21  24.385   6.756  -9.163
  682   2HB   ARG  21          2HB       ARG  21  24.949   6.914 -10.826
  683   1HG   ARG  21          2HG       ARG  21  23.431   8.532 -11.196
  684   2HG   ARG  21          1HG       ARG  21  22.138   7.437 -10.774
  685   1HD   ARG  21          1HD       ARG  21  21.949   9.236  -9.230
  686   2HD   ARG  21          2HD       ARG  21  22.706   7.944  -8.330
  687    HE   ARG  21           HE       ARG  21  24.287  10.177  -9.529
  688   1HH1  ARG  21          1HH2      ARG  21  26.179   8.092  -7.735
  689   2HH1  ARG  21          2HH2      ARG  21  26.629   9.764  -7.778
  690   1HH2  ARG  21          2HH1      ARG  21  23.077   9.829  -6.598
  691   2HH2  ARG  21          1HH1      ARG  21  24.565   9.570  -5.750
  692    H    ALA  22           H        ALA  22  25.111   3.924 -11.828
  693    HA   ALA  22           HA       ALA  22  24.330   4.954 -14.481
  694   1HB   ALA  22          2HB       ALA  22  26.672   3.664 -13.324
  695   2HB   ALA  22          3HB       ALA  22  26.195   2.903 -14.841
  696   3HB   ALA  22          1HB       ALA  22  26.543   4.631 -14.793
  697    H    HIS  23           H        HIS  23  23.761   2.186 -12.468
  698    HA   HIS  23           HA       HIS  23  22.818   0.576 -14.764
  699   1HB   HIS  23          2HB       HIS  23  22.710  -0.112 -11.823
  700   2HB   HIS  23          1HB       HIS  23  22.516  -1.210 -13.165
  701    HD2  HIS  23           HD2      HIS  23  25.397   1.043 -14.081
  702    HE1  HIS  23           HE1      HIS  23  27.152  -2.259 -12.111
  703    HE2  HIS  23           HE2      HIS  23  27.620  -0.210 -13.544
  704    H    ILE  24           H        ILE  24  21.544   2.788 -12.438
  705    HA   ILE  24           HA       ILE  24  18.839   1.655 -12.594
  706    HB   ILE  24           HB       ILE  24  19.764   4.259 -11.389
  707   1HG1  ILE  24          2HG1      ILE  24  19.097   1.611 -10.082
  708   2HG1  ILE  24          1HG1      ILE  24  20.720   2.275 -10.263
  709   1HG2  ILE  24          1HG2      ILE  24  17.124   2.814 -11.435
  710   2HG2  ILE  24          2HG2      ILE  24  17.518   3.946 -10.143
  711   3HG2  ILE  24          3HG2      ILE  24  17.457   4.503 -11.814
  712   1HD1  ILE  24          1HD1      ILE  24  19.103   4.314  -9.107
  713   2HD1  ILE  24          2HD1      ILE  24  18.783   2.828  -8.212
  714   3HD1  ILE  24          3HD1      ILE  24  20.433   3.435  -8.353
  715    H    LYS  25           H        LYS  25  17.012   3.034 -13.401
  716    HA   LYS  25           HA       LYS  25  17.933   4.703 -15.706
  717   1HB   LYS  25          2HB       LYS  25  16.640   2.641 -16.287
  718   2HB   LYS  25          1HB       LYS  25  15.280   3.280 -15.408
  719   1HG   LYS  25          1HG       LYS  25  15.091   5.162 -16.898
  720   2HG   LYS  25          2HG       LYS  25  16.631   4.769 -17.664
  721   1HD   LYS  25          1HD       LYS  25  15.371   2.437 -18.080
  722   2HD   LYS  25          2HD       LYS  25  13.958   3.490 -18.008
  723   1HE   LYS  25          1HE       LYS  25  16.241   4.469 -19.640
  724   2HE   LYS  25          2HE       LYS  25  15.364   3.079 -20.282
  725   1HZ   LYS  25          2HZ       LYS  25  13.815   5.338 -19.249
  726   2HZ   LYS  25          3HZ       LYS  25  14.578   5.518 -20.756
  727   3HZ   LYS  25          1HZ       LYS  25  13.454   4.267 -20.516
  728    H    GLU  26           H        GLU  26  14.861   4.486 -13.830
  729    HA   GLU  26           HA       GLU  26  15.073   7.405 -13.381
  730   1HB   GLU  26          1HB       GLU  26  13.293   6.279 -15.012
  731   2HB   GLU  26          2HB       GLU  26  12.453   5.991 -13.519
  732   1HG   GLU  26          1HG       GLU  26  11.874   8.108 -13.333
  733   2HG   GLU  26          2HG       GLU  26  13.526   8.649 -13.563
  734    H    TYR  27           H        TYR  27  12.529   7.152 -11.765
  735    HA   TYR  27           HA       TYR  27  13.130   5.290  -9.667
  736   1HB   TYR  27          1HB       TYR  27  13.615   6.877  -7.906
  737   2HB   TYR  27          2HB       TYR  27  14.747   7.171  -9.202
  738    HD1  TYR  27           HD2      TYR  27  14.386   9.104 -10.787
  739    HD2  TYR  27           HD1      TYR  27  11.972   8.512  -7.256
  740    HE1  TYR  27           HE2      TYR  27  13.580  11.459 -10.942
  741    HE2  TYR  27           HE1      TYR  27  11.165  10.864  -7.413
  742    HH   TYR  27           HH       TYR  27  10.969  12.646  -8.938
  743    H    PHE  28           H        PHE  28  11.451   5.989  -7.707
  744    HA   PHE  28           HA       PHE  28   9.146   7.398  -8.796
  745   1HB   PHE  28          1HB       PHE  28   8.823   5.249  -9.885
  746   2HB   PHE  28          2HB       PHE  28   9.029   4.402  -8.355
  747    HD1  PHE  28           HD2      PHE  28   6.782   6.569 -10.349
  748    HD2  PHE  28           HD1      PHE  28   7.267   4.372  -6.664
  749    HE1  PHE  28           HE2      PHE  28   4.349   6.831  -9.873
  750    HE2  PHE  28           HE1      PHE  28   4.840   4.643  -6.181
  751    HZ   PHE  28           HZ       PHE  28   3.376   5.865  -7.789
  752    H    TYR  29           H        TYR  29   9.317   8.658  -6.867
  753    HA   TYR  29           HA       TYR  29   9.547   7.616  -4.243
  754   1HB   TYR  29          1HB       TYR  29   9.797   9.998  -4.696
  755   2HB   TYR  29          2HB       TYR  29   8.129  10.109  -5.191
  756    HD1  TYR  29           HD2      TYR  29  10.098   8.789  -2.265
  757    HD2  TYR  29           HD1      TYR  29   6.614  10.947  -3.623
  758    HE1  TYR  29           HE2      TYR  29   9.412   9.168   0.099
  759    HE2  TYR  29           HE1      TYR  29   5.927  11.324  -1.258
  760    HH   TYR  29           HH       TYR  29   7.498  11.376   1.134
  761    H    THR  30           H        THR  30   8.147   6.573  -2.976
  762    HA   THR  30           HA       THR  30   5.716   5.468  -3.905
  763    HB   THR  30           HB       THR  30   6.122   6.064  -0.984
  764    HG1  THR  30           HG1      THR  30   7.494   4.182  -1.003
  765   1HG2  THR  30          2HG2      THR  30   4.746   4.055  -2.691
  766   2HG2  THR  30          3HG2      THR  30   5.465   3.453  -1.198
  767   3HG2  THR  30          1HG2      THR  30   4.257   4.737  -1.141
  768    H    SER  31           H        SER  31   3.515   5.937  -2.761
  769    HA   SER  31           HA       SER  31   2.953   8.804  -3.166
  770   1HB   SER  31          1HB       SER  31   1.531   6.723  -3.953
  771   2HB   SER  31          2HB       SER  31   0.875   6.813  -2.318
  772    HG   SER  31           HG       SER  31  -0.322   8.084  -3.787
  773    H    GLY  32           H        GLY  32   0.699   8.922  -1.346
  774   1HA   GLY  32          2HA       GLY  32   2.183   8.994   1.252
  775   2HA   GLY  32          1HA       GLY  32   0.976  10.196   0.794
  776    H    LYS  33           H        LYS  33   0.372   6.885  -0.051
  777    HA   LYS  33           HA       LYS  33  -1.490   6.636   2.275
  778   1HB   LYS  33          1HB       LYS  33  -2.169   5.565  -0.457
  779   2HB   LYS  33          2HB       LYS  33  -3.241   5.869   0.886
  780   1HG   LYS  33          1HG       LYS  33  -2.784   8.315   0.640
  781   2HG   LYS  33          2HG       LYS  33  -1.826   7.960  -0.776
  782   1HD   LYS  33          1HD       LYS  33  -4.671   6.995  -0.560
  783   2HD   LYS  33          2HD       LYS  33  -4.303   8.619  -1.142
  784   1HE   LYS  33          1HE       LYS  33  -2.532   7.133  -2.598
  785   2HE   LYS  33          2HE       LYS  33  -3.879   6.004  -2.455
  786   1HZ   LYS  33          3HZ       LYS  33  -5.255   8.112  -3.076
  787   2HZ   LYS  33          1HZ       LYS  33  -3.786   8.635  -3.746
  788   3HZ   LYS  33          2HZ       LYS  33  -4.498   7.192  -4.286
  789    H    CYS  34           H        CYS  34   0.627   5.426   2.911
  790    HA   CYS  34           HA       CYS  34   0.129   2.578   2.567
  791   1HB   CYS  34          1HB       CYS  34   2.222   3.964   0.983
  792   2HB   CYS  34          2HB       CYS  34   2.727   2.475   1.783
  793    H    SER  35           H        SER  35   2.018   1.329   3.705
  794    HA   SER  35           HA       SER  35   2.829   2.937   6.090
  795   1HB   SER  35          1HB       SER  35   1.354   0.616   6.013
  796   2HB   SER  35          2HB       SER  35   2.984   0.003   6.294
  797    HG   SER  35           HG       SER  35   2.547   0.533   8.280
  798    H    ASN  36           H        ASN  36   4.207   2.317   3.350
  799    HA   ASN  36           HA       ASN  36   6.851   1.688   4.570
  800   1HB   ASN  36          2HB       ASN  36   5.515  -0.226   3.160
  801   2HB   ASN  36          1HB       ASN  36   6.394   0.565   1.875
  802   1HD2  ASN  36          1HD2      ASN  36   7.925  -0.933   5.238
  803   2HD2  ASN  36          2HD2      ASN  36   7.230  -2.082   4.200
  804    HA   PRO  37           HA       PRO  37   6.531   5.412   1.675
  805   1HB   PRO  37          1HB       PRO  37   8.115   6.797   3.678
  806   2HB   PRO  37          2HB       PRO  37   6.490   7.189   3.103
  807   1HG   PRO  37          1HG       PRO  37   7.209   6.047   5.635
  808   2HG   PRO  37          2HG       PRO  37   5.596   6.376   5.039
  809   1HD   PRO  37          1HD       PRO  37   6.857   3.811   5.379
  810   2HD   PRO  37          2HD       PRO  37   5.226   4.145   4.767
  811    H    ALA  38           H        ALA  38   8.228   5.742   0.234
  812    HA   ALA  38           HA       ALA  38  11.001   5.600   0.945
  813   1HB   ALA  38          3HB       ALA  38   9.833   3.109   0.917
  814   2HB   ALA  38          1HB       ALA  38  10.459   3.236  -0.726
  815   3HB   ALA  38          2HB       ALA  38  11.550   3.412   0.648
  816    H    VAL  39           H        VAL  39  11.788   4.345  -1.613
  817    HA   VAL  39           HA       VAL  39  10.534   6.085  -3.626
  818    HB   VAL  39           HB       VAL  39  12.913   6.843  -2.377
  819   1HG1  VAL  39          1HG1      VAL  39  14.134   5.031  -3.562
  820   2HG1  VAL  39          2HG1      VAL  39  13.610   5.717  -5.099
  821   3HG1  VAL  39          3HG1      VAL  39  14.682   6.637  -4.042
  822   1HG2  VAL  39          2HG2      VAL  39  11.779   7.546  -5.084
  823   2HG2  VAL  39          3HG2      VAL  39  11.487   8.369  -3.550
  824   3HG2  VAL  39          1HG2      VAL  39  13.080   8.449  -4.305
  825    H    VAL  40           H        VAL  40  10.914   5.138  -5.758
  826    HA   VAL  40           HA       VAL  40  11.978   2.375  -5.491
  827    HB   VAL  40           HB       VAL  40   9.444   3.283  -6.846
  828   1HG1  VAL  40          3HG1      VAL  40  11.139   1.234  -7.746
  829   2HG1  VAL  40          1HG1      VAL  40   9.917   0.415  -6.783
  830   3HG1  VAL  40          2HG1      VAL  40   9.436   1.432  -8.137
  831   1HG2  VAL  40          3HG2      VAL  40   9.440   2.898  -4.399
  832   2HG2  VAL  40          1HG2      VAL  40   8.458   1.704  -5.247
  833   3HG2  VAL  40          2HG2      VAL  40  10.071   1.272  -4.671
  834    H    PHE  41           H        PHE  41  13.679   2.107  -6.723
  835    HA   PHE  41           HA       PHE  41  14.088   3.821  -9.033
  836   1HB   PHE  41          1HB       PHE  41  15.739   1.648  -7.748
  837   2HB   PHE  41          2HB       PHE  41  16.223   2.415  -9.239
  838    HD1  PHE  41           HD2      PHE  41  15.892   5.159  -9.108
  839    HD2  PHE  41           HD1      PHE  41  16.737   2.493  -5.818
  840    HE1  PHE  41           HE2      PHE  41  16.901   7.050  -7.834
  841    HE2  PHE  41           HE1      PHE  41  17.755   4.381  -4.548
  842    HZ   PHE  41           HZ       PHE  41  17.846   6.656  -5.561
  843    H    VAL  42           H        VAL  42  13.949   3.276 -11.086
  844    HA   VAL  42           HA       VAL  42  12.859   0.562 -11.715
  845    HB   VAL  42           HB       VAL  42  12.530   2.021 -13.989
  846   1HG1  VAL  42          3HG2      VAL  42  10.839   1.281 -11.669
  847   2HG1  VAL  42          1HG2      VAL  42  10.143   2.432 -12.808
  848   3HG1  VAL  42          2HG2      VAL  42  10.664   0.843 -13.368
  849   1HG2  VAL  42          1HG1      VAL  42  13.278   4.096 -12.764
  850   2HG2  VAL  42          2HG1      VAL  42  11.674   4.207 -13.487
  851   3HG2  VAL  42          3HG1      VAL  42  11.842   3.928 -11.754
  852    H    THR  43           H        THR  43  15.265   0.026 -11.467
  853    HA   THR  43           HA       THR  43  17.270   1.154 -13.125
  854    HB   THR  43           HB       THR  43  18.697  -0.576 -12.395
  855    HG1  THR  43           HG1      THR  43  17.697  -2.516 -11.491
  856   1HG2  THR  43          3HG2      THR  43  17.174   0.821 -10.612
  857   2HG2  THR  43          1HG2      THR  43  16.842  -0.835 -10.107
  858   3HG2  THR  43          2HG2      THR  43  18.502  -0.243 -10.150
  859    H    ARG  44           H        ARG  44  18.591  -0.979 -14.301
  860    HA   ARG  44           HA       ARG  44  17.718  -0.851 -16.915
  861   1HB   ARG  44          2HB       ARG  44  18.943  -3.146 -17.181
  862   2HB   ARG  44          1HB       ARG  44  19.875  -1.747 -16.656
  863   1HG   ARG  44          1HG       ARG  44  18.787  -2.924 -14.308
  864   2HG   ARG  44          2HG       ARG  44  19.445  -4.237 -15.279
  865   1HD   ARG  44          1HD       ARG  44  21.605  -3.218 -15.357
  866   2HD   ARG  44          2HD       ARG  44  20.983  -1.692 -14.728
  867    HE   ARG  44           HE       ARG  44  21.274  -2.584 -12.573
  868   1HH1  ARG  44          2HH1      ARG  44  19.253  -4.787 -12.707
  869   2HH1  ARG  44          1HH1      ARG  44  20.129  -6.189 -13.225
  870   1HH2  ARG  44          1HH2      ARG  44  23.209  -4.600 -13.035
  871   2HH2  ARG  44          2HH2      ARG  44  22.398  -6.012 -12.445
  872    H    LYS  45           H        LYS  45  17.141  -3.748 -14.830
  873    HA   LYS  45           HA       LYS  45  15.242  -4.973 -16.571
  874   1HB   LYS  45          2HB       LYS  45  15.826  -5.113 -13.650
  875   2HB   LYS  45          1HB       LYS  45  14.261  -5.693 -14.166
  876   1HG   LYS  45          1HG       LYS  45  15.403  -7.138 -15.862
  877   2HG   LYS  45          2HG       LYS  45  16.953  -6.619 -15.199
  878   1HD   LYS  45          1HD       LYS  45  16.107  -7.442 -12.934
  879   2HD   LYS  45          2HD       LYS  45  14.781  -8.206 -13.812
  880   1HE   LYS  45          1HE       LYS  45  16.879  -9.068 -15.297
  881   2HE   LYS  45          2HE       LYS  45  17.659  -8.930 -13.721
  882   1HZ   LYS  45          1HZ       LYS  45  15.654 -10.190 -12.851
  883   2HZ   LYS  45          2HZ       LYS  45  15.317 -10.568 -14.473
  884   3HZ   LYS  45          3HZ       LYS  45  16.778 -11.073 -13.770
  885    H    ASN  46           H        ASN  46  15.100  -2.376 -14.291
  886    HA   ASN  46           HA       ASN  46  13.643  -0.631 -14.028
  887   1HB   ASN  46          1HB       ASN  46  13.140  -1.578 -16.669
  888   2HB   ASN  46          2HB       ASN  46  11.570  -1.287 -15.927
  889   1HD2  ASN  46          2HD2      ASN  46  11.391   1.773 -15.629
  890   2HD2  ASN  46          1HD2      ASN  46  11.379   1.203 -17.228
  891    H    ARG  47           H        ARG  47  13.098  -3.572 -13.051
  892    HA   ARG  47           HA       ARG  47  10.263  -3.629 -12.528
  893   1HB   ARG  47          2HB       ARG  47  12.522  -5.158 -11.724
  894   2HB   ARG  47          1HB       ARG  47  11.778  -4.552 -10.246
  895   1HG   ARG  47          1HG       ARG  47   9.547  -5.352 -11.227
  896   2HG   ARG  47          2HG       ARG  47  10.504  -6.217 -12.429
  897   1HD   ARG  47          1HD       ARG  47  11.448  -6.627  -9.679
  898   2HD   ARG  47          2HD       ARG  47   9.804  -7.206  -9.946
  899    HE   ARG  47           HE       ARG  47  12.221  -8.179 -11.389
  900   1HH1  ARG  47          2HH1      ARG  47   9.209  -8.687 -12.914
  901   2HH1  ARG  47          1HH1      ARG  47  10.400  -9.887 -13.289
  902   1HH2  ARG  47          1HH2      ARG  47   9.969  -9.732  -9.593
  903   2HH2  ARG  47          2HH2      ARG  47  10.168 -10.995 -10.761
  904    H    GLN  48           H        GLN  48   9.405  -2.933 -10.224
  905    HA   GLN  48           HA       GLN  48  10.581  -0.287  -9.827
  906   1HB   GLN  48          2HB       GLN  48   7.961  -1.512  -9.237
  907   2HB   GLN  48          1HB       GLN  48   8.508  -0.275  -8.101
  908   1HG   GLN  48          1HG       GLN  48   8.978   1.240  -9.989
  909   2HG   GLN  48          2HG       GLN  48   8.481   0.017 -11.120
  910   1HE2  GLN  48          2HE2      GLN  48   6.163   1.723  -8.339
  911   2HE2  GLN  48          1HE2      GLN  48   6.022   0.033  -8.404
  912    H    VAL  49           H        VAL  49  12.471  -1.176  -9.070
  913    HA   VAL  49           HA       VAL  49  12.786  -2.740  -6.726
  914    HB   VAL  49           HB       VAL  49  14.883  -0.747  -7.373
  915   1HG1  VAL  49          1HG1      VAL  49  14.732  -3.712  -6.852
  916   2HG1  VAL  49          2HG1      VAL  49  16.239  -2.889  -7.258
  917   3HG1  VAL  49          3HG1      VAL  49  15.371  -2.462  -5.782
  918   1HG2  VAL  49          1HG2      VAL  49  13.736  -2.610  -9.413
  919   2HG2  VAL  49          2HG2      VAL  49  14.594  -1.093  -9.669
  920   3HG2  VAL  49          3HG2      VAL  49  15.492  -2.564  -9.296
  921    H    CYS  50           H        CYS  50  13.579  -1.966  -4.611
  922    HA   CYS  50           HA       CYS  50  12.462   0.722  -3.961
  923   1HB   CYS  50          1HB       CYS  50  11.578  -1.492  -2.880
  924   2HB   CYS  50          2HB       CYS  50  13.049  -1.432  -1.940
  925    H    ALA  51           H        ALA  51  13.665   1.767  -2.004
  926    HA   ALA  51           HA       ALA  51  16.369   0.918  -1.488
  927   1HB   ALA  51          2HB       ALA  51  15.848   2.916  -3.638
  928   2HB   ALA  51          3HB       ALA  51  17.211   3.212  -2.564
  929   3HB   ALA  51          1HB       ALA  51  17.141   1.724  -3.502
  930    H    ASN  52           H        ASN  52  13.903   2.033  -0.113
  931    HA   ASN  52           HA       ASN  52  13.583   3.303   1.837
  932   1HB   ASN  52          1HB       ASN  52  15.882   2.323   2.307
  933   2HB   ASN  52          2HB       ASN  52  16.555   3.830   1.687
  934   1HD2  ASN  52          1HD2      ASN  52  15.019   3.433   5.368
  935   2HD2  ASN  52          2HD2      ASN  52  13.918   2.980   4.158
  936    HA   PRO  53           HA       PRO  53  13.354   7.431   0.192
  937   1HB   PRO  53          1HB       PRO  53  12.238   8.602   2.464
  938   2HB   PRO  53          2HB       PRO  53  11.322   7.736   1.221
  939   1HG   PRO  53          2HG       PRO  53  11.962   6.894   3.972
  940   2HG   PRO  53          1HG       PRO  53  10.762   6.242   2.875
  941   1HD   PRO  53          1HD       PRO  53  13.313   5.112   3.530
  942   2HD   PRO  53          2HD       PRO  53  12.138   4.496   2.354
  943    H    GLU  54           H        GLU  54  14.011   7.593   3.713
  944    HA   GLU  54           HA       GLU  54  15.897   9.801   3.294
  945   1HB   GLU  54          1HB       GLU  54  14.185   9.434   5.253
  946   2HB   GLU  54          2HB       GLU  54  15.474   8.444   5.940
  947   1HG   GLU  54          1HG       GLU  54  16.342  11.066   4.880
  948   2HG   GLU  54          2HG       GLU  54  15.283  11.145   6.287
  949    H    LYS  55           H        LYS  55  16.902   7.467   2.088
  950    HA   LYS  55           HA       LYS  55  18.939   6.419   3.969
  951   1HB   LYS  55          2HB       LYS  55  17.637   5.401   1.622
  952   2HB   LYS  55          1HB       LYS  55  19.376   5.434   1.340
  953   1HG   LYS  55          1HG       LYS  55  19.656   4.308   3.599
  954   2HG   LYS  55          2HG       LYS  55  17.907   4.079   3.616
  955   1HD   LYS  55          1HD       LYS  55  17.958   2.515   1.917
  956   2HD   LYS  55          2HD       LYS  55  19.386   3.227   1.165
  957   1HE   LYS  55          1HE       LYS  55  20.505   1.490   2.110
  958   2HE   LYS  55          2HE       LYS  55  20.364   2.411   3.608
  959   1HZ   LYS  55          3HZ       LYS  55  18.294   0.508   2.670
  960   2HZ   LYS  55          1HZ       LYS  55  19.556   0.064   3.718
  961   3HZ   LYS  55          2HZ       LYS  55  18.421   1.232   4.201
  962    H    LYS  56           H        LYS  56  18.767   9.234   2.658
  963    HA   LYS  56           HA       LYS  56  20.317  10.826   1.956
  964   1HB   LYS  56          1HB       LYS  56  21.980   8.653   3.101
  965   2HB   LYS  56          2HB       LYS  56  22.813   9.789   2.040
  966   1HG   LYS  56          1HG       LYS  56  22.742  11.409   3.609
  967   2HG   LYS  56          2HG       LYS  56  21.011  11.174   3.851
  968   1HD   LYS  56          1HD       LYS  56  21.589   9.132   5.241
  969   2HD   LYS  56          2HD       LYS  56  23.276   9.638   5.149
  970   1HE   LYS  56          1HE       LYS  56  22.972  11.315   6.650
  971   2HE   LYS  56          2HE       LYS  56  21.433  11.794   5.934
  972   1HZ   LYS  56          2HZ       LYS  56  21.535   9.257   7.382
  973   2HZ   LYS  56          3HZ       LYS  56  21.568  10.686   8.298
  974   3HZ   LYS  56          1HZ       LYS  56  20.269  10.380   7.249
  975    H    TRP  57           H        TRP  57  22.333   8.165   0.809
  976    HA   TRP  57           HA       TRP  57  22.821   9.158  -1.731
  977   1HB   TRP  57          1HB       TRP  57  23.454   6.912  -2.372
  978   2HB   TRP  57          2HB       TRP  57  23.939   7.182  -0.696
  979    HD1  TRP  57           HD1      TRP  57  22.935   5.523   1.049
  980    HE1  TRP  57           HE1      TRP  57  21.284   3.546   0.862
  981    HE3  TRP  57           HE3      TRP  57  21.354   6.248  -3.694
  982    HZ2  TRP  57           HZ2      TRP  57  19.527   2.390  -1.135
  983    HZ3  TRP  57           HZ3      TRP  57  19.823   4.675  -4.790
  984    HH2  TRP  57           HH2      TRP  57  18.902   2.740  -3.524
  985    H    VAL  58           H        VAL  58  19.855   7.650  -0.674
  986    HA   VAL  58           HA       VAL  58  18.883   7.027  -3.332
  987    HB   VAL  58           HB       VAL  58  16.569   7.347  -2.099
  988   1HG1  VAL  58          3HG1      VAL  58  17.997   5.248  -2.819
  989   2HG1  VAL  58          1HG1      VAL  58  18.157   5.056  -1.074
  990   3HG1  VAL  58          2HG1      VAL  58  16.559   5.080  -1.823
  991   1HG2  VAL  58          3HG2      VAL  58  17.627   8.432  -0.125
  992   2HG2  VAL  58          1HG2      VAL  58  16.651   7.017   0.259
  993   3HG2  VAL  58          2HG2      VAL  58  18.406   6.893   0.230
  994    H    ARG  59           H        ARG  59  18.374   9.818  -1.176
  995    HA   ARG  59           HA       ARG  59  16.696  11.244  -3.027
  996   1HB   ARG  59          1HB       ARG  59  18.260  11.957  -0.571
  997   2HB   ARG  59          2HB       ARG  59  17.684  13.264  -1.605
  998   1HG   ARG  59          2HG       ARG  59  15.437  12.736  -1.242
  999   2HG   ARG  59          1HG       ARG  59  15.797  11.067  -0.801
 1000   1HD   ARG  59          1HD       ARG  59  16.722  11.758   1.324
 1001   2HD   ARG  59          2HD       ARG  59  16.618  13.459   0.869
 1002    HE   ARG  59           HE       ARG  59  14.047  12.051   0.845
 1003   1HH1  ARG  59          2HH2      ARG  59  14.442  15.189   1.830
 1004   2HH1  ARG  59          1HH2      ARG  59  15.600  14.777   3.050
 1005   1HH2  ARG  59          1HH1      ARG  59  13.294  11.905   3.212
 1006   2HH2  ARG  59          2HH1      ARG  59  13.919  13.127   4.268
 1007    H    GLU  60           H        GLU  60  20.165  10.993  -2.526
 1008    HA   GLU  60           HA       GLU  60  20.904  13.145  -4.317
 1009   1HB   GLU  60          2HB       GLU  60  22.315  10.852  -3.018
 1010   2HB   GLU  60          1HB       GLU  60  23.089  11.620  -4.382
 1011   1HG   GLU  60          2HG       GLU  60  22.151  13.736  -2.804
 1012   2HG   GLU  60          1HG       GLU  60  22.810  12.587  -1.666
 1013    H    TYR  61           H        TYR  61  19.662   9.998  -4.785
 1014    HA   TYR  61           HA       TYR  61  20.747   9.713  -7.517
 1015   1HB   TYR  61          1HB       TYR  61  19.318   7.989  -5.565
 1016   2HB   TYR  61          2HB       TYR  61  18.926   7.713  -7.243
 1017    HD1  TYR  61           HD1      TYR  61  22.058   8.520  -5.306
 1018    HD2  TYR  61           HD2      TYR  61  20.137   5.985  -8.225
 1019    HE1  TYR  61           HE1      TYR  61  24.155   7.199  -5.538
 1020    HE2  TYR  61           HE2      TYR  61  22.241   4.673  -8.469
 1021    HH   TYR  61           HH       TYR  61  25.246   5.721  -7.032
 1022    H    ILE  62           H        ILE  62  17.823  10.528  -5.767
 1023    HA   ILE  62           HA       ILE  62  15.965  10.425  -7.926
 1024    HB   ILE  62           HB       ILE  62  16.047  12.191  -5.459
 1025   1HG1  ILE  62          2HG1      ILE  62  14.446   9.682  -6.026
 1026   2HG1  ILE  62          1HG1      ILE  62  15.972   9.686  -5.143
 1027   1HG2  ILE  62          1HG2      ILE  62  14.174  12.023  -7.727
 1028   2HG2  ILE  62          2HG2      ILE  62  13.413  11.899  -6.142
 1029   3HG2  ILE  62          3HG2      ILE  62  14.394  13.308  -6.541
 1030   1HD1  ILE  62          2HD1      ILE  62  14.461  11.714  -3.942
 1031   2HD1  ILE  62          3HD1      ILE  62  13.309  10.407  -4.217
 1032   3HD1  ILE  62          1HD1      ILE  62  14.772  10.110  -3.279
 1033    H    ASN  63           H        ASN  63  18.052  13.071  -6.750
 1034    HA   ASN  63           HA       ASN  63  17.119  14.922  -8.795
 1035   1HB   ASN  63          1HB       ASN  63  19.557  15.007  -6.991
 1036   2HB   ASN  63          2HB       ASN  63  19.004  16.341  -8.002
 1037   1HD2  ASN  63          1HD2      ASN  63  15.757  15.571  -6.487
 1038   2HD2  ASN  63          2HD2      ASN  63  16.292  17.061  -7.100
 1039    H    SER  64           H        SER  64  19.963  12.831  -8.371
 1040    HA   SER  64           HA       SER  64  21.467  13.686 -10.604
 1041   1HB   SER  64          2HB       SER  64  21.181  11.025  -9.217
 1042   2HB   SER  64          1HB       SER  64  22.210  11.191 -10.640
 1043    HG   SER  64           HG       SER  64  23.637  12.073  -9.410
 1044    H    LEU  65           H        LEU  65  18.600  11.657 -10.436
 1045    HA   LEU  65           HA       LEU  65  18.809  10.816 -13.235
 1046   1HB   LEU  65          2HB       LEU  65  16.523  10.617 -11.256
 1047   2HB   LEU  65          1HB       LEU  65  16.542   9.871 -12.836
 1048    HG   LEU  65           HG       LEU  65  18.780   9.356 -10.894
 1049   1HD1  LEU  65          1HD1      LEU  65  16.548   8.889  -9.795
 1050   2HD1  LEU  65          2HD1      LEU  65  16.235   7.721 -11.078
 1051   3HD1  LEU  65          3HD1      LEU  65  17.586   7.474  -9.971
 1052   1HD2  LEU  65          1HD2      LEU  65  18.131   8.553 -13.532
 1053   2HD2  LEU  65          2HD2      LEU  65  19.449   7.954 -12.524
 1054   3HD2  LEU  65          3HD2      LEU  65  17.885   7.138 -12.507
 1055    H    GLU  66           H        GLU  66  16.602  12.960 -11.398
 1056    HA   GLU  66           HA       GLU  66  16.263  14.550 -13.897
 1057   1HB   GLU  66          1HB       GLU  66  14.316  12.848 -13.157
 1058   2HB   GLU  66          2HB       GLU  66  13.879  14.220 -12.139
 1059   1HG   GLU  66          1HG       GLU  66  13.538  15.638 -13.985
 1060   2HG   GLU  66          2HG       GLU  66  14.493  14.619 -15.061
 1061    H    MET  67           H        MET  67  17.480  16.281 -13.095
 1062    HA   MET  67           HA       MET  67  16.670  17.420 -10.465
 1063   1HB   MET  67          1HB       MET  67  19.119  16.982 -11.027
 1064   2HB   MET  67          2HB       MET  67  18.990  18.287 -12.205
 1065   1HG   MET  67          1HG       MET  67  18.732  19.917 -10.572
 1066   2HG   MET  67          2HG       MET  67  18.045  18.786  -9.405
 1067   1HE   MET  67          3HE       MET  67  20.309  21.023  -9.955
 1068   2HE   MET  67          2HE       MET  67  20.565  20.765  -8.229
 1069   3HE   MET  67          1HE       MET  67  21.909  20.583  -9.357
 1070    H    SER  68           H        SER  68  14.636  18.250 -11.408
 1071    HA   SER  68           HA       SER  68  14.907  20.382 -13.436
 1072   1HB   SER  68          1HB       SER  68  12.846  18.598 -12.664
 1073   2HB   SER  68          2HB       SER  68  12.276  20.219 -12.268
 1074    HG   SER  68           HG       SER  68  12.017  19.302 -14.528
   
  No H/Q in entry =        1074
  Start of MODEL   12
    1    H    SER   1           H        SER   1  15.249  -9.718   4.953
    2    HA   SER   1           HA       SER   1  17.681 -10.733   3.560
    3   1HB   SER   1          1HB       SER   1  15.414 -12.296   4.710
    4   2HB   SER   1          2HB       SER   1  16.038 -12.811   3.144
    5    HG   SER   1           HG       SER   1  17.766 -13.514   4.081
    6    HA   PRO   2           HA       PRO   2  14.513  -8.592   0.849
    7   1HB   PRO   2          1HB       PRO   2  16.742  -7.388  -0.533
    8   2HB   PRO   2          2HB       PRO   2  15.510  -6.586   0.448
    9   1HG   PRO   2          1HG       PRO   2  18.279  -7.049   1.120
   10   2HG   PRO   2          2HG       PRO   2  17.049  -6.244   2.100
   11   1HD   PRO   2          1HD       PRO   2  18.206  -8.856   2.504
   12   2HD   PRO   2          2HD       PRO   2  16.967  -8.050   3.486
   13    H    TYR   3           H        TYR   3  13.931  -9.534  -1.091
   14    HA   TYR   3           HA       TYR   3  15.987 -11.246  -2.434
   15   1HB   TYR   3          1HB       TYR   3  13.221 -11.773  -1.589
   16   2HB   TYR   3          2HB       TYR   3  13.540 -12.219  -3.264
   17    HD1  TYR   3           HD2      TYR   3  15.287 -13.887  -3.828
   18    HD2  TYR   3           HD1      TYR   3  14.324 -12.905   0.265
   19    HE1  TYR   3           HE2      TYR   3  16.498 -15.924  -3.053
   20    HE2  TYR   3           HE1      TYR   3  15.534 -14.942   1.039
   21    HH   TYR   3           HH       TYR   3  16.317 -17.033   0.250
   22    H    SER   4           H        SER   4  12.872  -9.613  -3.148
   23    HA   SER   4           HA       SER   4  13.862  -9.115  -5.905
   24   1HB   SER   4          1HB       SER   4  11.145  -8.229  -5.080
   25   2HB   SER   4          2HB       SER   4  11.667  -9.028  -6.563
   26    HG   SER   4           HG       SER   4  10.419 -10.173  -4.680
   27    H    SER   5           H        SER   5  12.494  -7.348  -3.120
   28    HA   SER   5           HA       SER   5  12.781  -5.110  -2.474
   29   1HB   SER   5          1HB       SER   5  14.946  -4.831  -4.547
   30   2HB   SER   5          2HB       SER   5  14.837  -4.085  -2.953
   31    HG   SER   5           HG       SER   5  15.642  -5.817  -2.067
   32    H    ASP   6           H        ASP   6  10.649  -5.151  -3.850
   33    HA   ASP   6           HA       ASP   6  10.828  -2.868  -5.721
   34   1HB   ASP   6          2HB       ASP   6   9.579  -4.036  -7.488
   35   2HB   ASP   6          1HB       ASP   6  11.081  -4.895  -7.153
   36    H    THR   7           H        THR   7   8.158  -3.055  -6.646
   37    HA   THR   7           HA       THR   7   6.817  -2.287  -4.156
   38    HB   THR   7           HB       THR   7   6.639  -0.858  -6.182
   39    HG1  THR   7           HG1      THR   7   4.459  -0.531  -5.961
   40   1HG2  THR   7          1HG2      THR   7   6.650  -2.753  -7.820
   41   2HG2  THR   7          2HG2      THR   7   5.015  -3.162  -7.303
   42   3HG2  THR   7          3HG2      THR   7   5.329  -1.618  -8.094
   43    H    THR   8           H        THR   8   4.383  -2.947  -4.046
   44    HA   THR   8           HA       THR   8   3.934  -5.725  -4.991
   45    HB   THR   8           HB       THR   8   3.426  -4.983  -2.105
   46    HG1  THR   8           HG1      THR   8   5.659  -4.817  -2.560
   47   1HG2  THR   8          2HG2      THR   8   2.287  -6.959  -3.242
   48   2HG2  THR   8          3HG2      THR   8   3.888  -7.678  -3.405
   49   3HG2  THR   8          1HG2      THR   8   3.226  -7.354  -1.803
   50    HA   PRO   9           HA       PRO   9   0.153  -3.483  -5.911
   51   1HB   PRO   9          1HB       PRO   9  -1.015  -6.043  -6.640
   52   2HB   PRO   9          2HB       PRO   9  -0.555  -4.703  -7.699
   53   1HG   PRO   9          2HG       PRO   9   0.800  -7.220  -7.380
   54   2HG   PRO   9          1HG       PRO   9   1.304  -5.853  -8.375
   55   1HD   PRO   9          1HD       PRO   9   2.482  -6.781  -5.939
   56   2HD   PRO   9          2HD       PRO   9   2.983  -5.423  -6.933
   57    H    CYS  10           H        CYS  10  -0.615  -2.989  -3.836
   58    HA   CYS  10           HA       CYS  10  -2.530  -4.927  -2.679
   59   1HB   CYS  10          2HB       CYS  10  -1.606  -4.595  -0.401
   60   2HB   CYS  10          1HB       CYS  10  -0.426  -5.361  -1.462
   61    H    CYS  11           H        CYS  11  -4.231  -3.891  -1.558
   62    HA   CYS  11           HA       CYS  11  -4.149  -0.949  -1.882
   63   1HB   CYS  11          2HB       CYS  11  -6.650  -1.060  -1.627
   64   2HB   CYS  11          1HB       CYS  11  -5.992  -1.768  -3.067
   65    H    PHE  12           H        PHE  12  -4.251   0.378  -0.134
   66    HA   PHE  12           HA       PHE  12  -4.116  -0.887   2.518
   67   1HB   PHE  12          1HB       PHE  12  -3.377   1.299   3.295
   68   2HB   PHE  12          2HB       PHE  12  -2.497   0.889   1.844
   69    HD1  PHE  12           HD1      PHE  12  -2.974   2.023  -0.311
   70    HD2  PHE  12           HD2      PHE  12  -5.058   3.078   3.323
   71    HE1  PHE  12           HE1      PHE  12  -3.843   4.087  -1.405
   72    HE2  PHE  12           HE2      PHE  12  -5.919   5.145   2.229
   73    HZ   PHE  12           HZ       PHE  12  -5.315   5.646  -0.136
   74    H    ALA  13           H        ALA  13  -6.124   1.571   0.876
   75    HA   ALA  13           HA       ALA  13  -8.014   1.426   3.162
   76   1HB   ALA  13          3HB       ALA  13  -7.561   3.402   0.943
   77   2HB   ALA  13          1HB       ALA  13  -9.119   3.351   1.768
   78   3HB   ALA  13          2HB       ALA  13  -7.648   3.691   2.681
   79    H    TYR  14           H        TYR  14  -9.956   0.443   2.973
   80    HA   TYR  14           HA       TYR  14 -10.643  -0.499   0.255
   81   1HB   TYR  14          1HB       TYR  14 -12.009  -2.267   1.705
   82   2HB   TYR  14          2HB       TYR  14 -10.338  -2.527   1.276
   83    HD1  TYR  14           HD2      TYR  14  -8.514  -1.703   2.928
   84    HD2  TYR  14           HD1      TYR  14 -12.678  -2.174   3.970
   85    HE1  TYR  14           HE2      TYR  14  -7.911  -1.694   5.334
   86    HE2  TYR  14           HE1      TYR  14 -12.069  -2.180   6.386
   87    HH   TYR  14           HH       TYR  14  -8.904  -1.309   7.495
   88    H    ILE  15           H        ILE  15 -12.653  -0.036  -0.540
   89    HA   ILE  15           HA       ILE  15 -14.246   1.962   0.767
   90    HB   ILE  15           HB       ILE  15 -14.213   1.703  -1.680
   91   1HG1  ILE  15          1HG1      ILE  15 -16.979   1.033  -0.644
   92   2HG1  ILE  15          2HG1      ILE  15 -16.242   2.625  -0.458
   93   1HG2  ILE  15          1HG2      ILE  15 -15.429  -0.983  -1.010
   94   2HG2  ILE  15          2HG2      ILE  15 -15.574  -0.258  -2.611
   95   3HG2  ILE  15          3HG2      ILE  15 -13.982  -0.654  -1.963
   96   1HD1  ILE  15          3HD1      ILE  15 -15.816   2.174  -3.115
   97   2HD1  ILE  15          1HD1      ILE  15 -17.342   1.322  -2.879
   98   3HD1  ILE  15          2HD1      ILE  15 -17.217   3.036  -2.481
   99    H    ALA  16           H        ALA  16 -16.533   1.672   1.426
  100    HA   ALA  16           HA       ALA  16 -16.904  -0.967   2.773
  101   1HB   ALA  16          1HB       ALA  16 -17.029   1.613   3.794
  102   2HB   ALA  16          2HB       ALA  16 -18.724   1.184   3.567
  103   3HB   ALA  16          3HB       ALA  16 -17.686   0.170   4.567
  104    H    ARG  17           H        ARG  17 -17.691  -1.782   0.634
  105    HA   ARG  17           HA       ARG  17 -20.570  -1.746   0.524
  106   1HB   ARG  17          1HB       ARG  17 -20.099   0.458  -0.524
  107   2HB   ARG  17          2HB       ARG  17 -19.131  -0.343  -1.737
  108   1HG   ARG  17          1HG       ARG  17 -21.693  -1.650  -1.527
  109   2HG   ARG  17          2HG       ARG  17 -21.922   0.079  -1.789
  110   1HD   ARG  17          1HD       ARG  17 -19.897  -0.458  -3.548
  111   2HD   ARG  17          2HD       ARG  17 -20.804  -1.970  -3.599
  112    HE   ARG  17           HE       ARG  17 -22.836  -0.506  -4.111
  113   1HH1  ARG  17          2HH2      ARG  17 -21.936   2.233  -3.995
  114   2HH1  ARG  17          1HH2      ARG  17 -20.798   2.470  -5.279
  115   1HH2  ARG  17          1HH1      ARG  17 -22.071   0.142  -6.978
  116   2HH2  ARG  17          2HH1      ARG  17 -20.373   0.077  -6.644
  117    HA   PRO  18           HA       PRO  18 -19.027  -5.627  -1.145
  118   1HB   PRO  18          2HB       PRO  18 -21.713  -6.464  -1.700
  119   2HB   PRO  18          1HB       PRO  18 -20.669  -6.994  -0.388
  120   1HG   PRO  18          2HG       PRO  18 -22.960  -5.226  -0.239
  121   2HG   PRO  18          1HG       PRO  18 -21.966  -5.839   1.086
  122   1HD   PRO  18          1HD       PRO  18 -22.016  -3.172   0.048
  123   2HD   PRO  18          2HD       PRO  18 -20.934  -3.819   1.294
  124    H    LEU  19           H        LEU  19 -18.109  -5.049  -3.091
  125    HA   LEU  19           HA       LEU  19 -19.382  -3.812  -5.292
  126   1HB   LEU  19          1HB       LEU  19 -17.158  -5.854  -5.419
  127   2HB   LEU  19          2HB       LEU  19 -17.521  -4.654  -6.630
  128    HG   LEU  19           HG       LEU  19 -16.580  -4.125  -3.807
  129   1HD1  LEU  19          3HD1      LEU  19 -14.985  -4.954  -5.714
  130   2HD1  LEU  19          1HD1      LEU  19 -15.175  -3.313  -6.335
  131   3HD1  LEU  19          2HD1      LEU  19 -14.502  -3.575  -4.726
  132   1HD2  LEU  19          2HD2      LEU  19 -17.963  -2.454  -5.756
  133   2HD2  LEU  19          3HD2      LEU  19 -17.580  -2.113  -4.069
  134   3HD2  LEU  19          1HD2      LEU  19 -16.386  -1.790  -5.327
  135    HA   PRO  20           HA       PRO  20 -22.178  -7.165  -6.361
  136   1HB   PRO  20          1HB       PRO  20 -22.462  -5.988  -9.005
  137   2HB   PRO  20          2HB       PRO  20 -23.653  -6.057  -7.701
  138   1HG   PRO  20          1HG       PRO  20 -22.173  -3.762  -8.590
  139   2HG   PRO  20          2HG       PRO  20 -23.300  -3.851  -7.230
  140   1HD   PRO  20          1HD       PRO  20 -20.427  -3.603  -7.134
  141   2HD   PRO  20          2HD       PRO  20 -21.558  -3.696  -5.771
  142    H    ARG  21           H        ARG  21 -21.263  -9.095  -6.920
  143    HA   ARG  21           HA       ARG  21 -18.847  -9.499  -8.246
  144   1HB   ARG  21          1HB       ARG  21 -19.526 -11.802  -8.560
  145   2HB   ARG  21          2HB       ARG  21 -20.139 -11.253  -7.021
  146   1HG   ARG  21          1HG       ARG  21 -22.058 -12.227  -7.867
  147   2HG   ARG  21          2HG       ARG  21 -22.256 -10.592  -8.499
  148   1HD   ARG  21          2HD       ARG  21 -21.666 -11.207 -10.655
  149   2HD   ARG  21          1HD       ARG  21 -20.681 -12.563 -10.110
  150    HE   ARG  21           HE       ARG  21 -23.308 -13.229  -9.409
  151   1HH1  ARG  21          2HH2      ARG  21 -21.423 -14.564 -11.581
  152   2HH1  ARG  21          1HH2      ARG  21 -22.111 -13.963 -13.052
  153   1HH2  ARG  21          1HH1      ARG  21 -25.030 -13.376 -11.345
  154   2HH2  ARG  21          2HH1      ARG  21 -24.296 -12.841 -12.820
  155    H    ALA  22           H        ALA  22 -21.949  -8.756  -9.657
  156    HA   ALA  22           HA       ALA  22 -21.379  -9.659 -12.323
  157   1HB   ALA  22          3HB       ALA  22 -23.646  -8.930 -11.327
  158   2HB   ALA  22          1HB       ALA  22 -23.118  -7.281 -11.660
  159   3HB   ALA  22          2HB       ALA  22 -23.300  -8.431 -12.983
  160    H    HIS  23           H        HIS  23 -21.087  -6.428 -10.812
  161    HA   HIS  23           HA       HIS  23 -19.886  -5.220 -13.138
  162   1HB   HIS  23          1HB       HIS  23 -19.554  -4.364 -10.249
  163   2HB   HIS  23          2HB       HIS  23 -19.366  -3.357 -11.683
  164    HD2  HIS  23           HD2      HIS  23 -22.450  -5.443 -12.284
  165    HE1  HIS  23           HE1      HIS  23 -23.848  -1.944 -10.366
  166    HE2  HIS  23           HE2      HIS  23 -24.544  -4.018 -11.667
  167    H    ILE  24           H        ILE  24 -18.644  -7.185 -10.534
  168    HA   ILE  24           HA       ILE  24 -15.855  -6.416 -11.047
  169    HB   ILE  24           HB       ILE  24 -16.804  -8.806  -9.486
  170   1HG1  ILE  24          2HG1      ILE  24 -16.423  -5.963  -8.524
  171   2HG1  ILE  24          1HG1      ILE  24 -17.949  -6.807  -8.623
  172   1HG2  ILE  24          3HG2      ILE  24 -14.264  -7.217  -9.690
  173   2HG2  ILE  24          1HG2      ILE  24 -14.623  -8.120  -8.219
  174   3HG2  ILE  24          2HG2      ILE  24 -14.486  -8.963  -9.761
  175   1HD1  ILE  24          3HD1      ILE  24 -16.230  -8.509  -7.172
  176   2HD1  ILE  24          1HD1      ILE  24 -15.970  -6.889  -6.521
  177   3HD1  ILE  24          2HD1      ILE  24 -17.592  -7.584  -6.539
  178    H    LYS  25           H        LYS  25 -14.259  -8.068 -11.628
  179    HA   LYS  25           HA       LYS  25 -15.391 -10.012 -13.590
  180   1HB   LYS  25          2HB       LYS  25 -13.409  -7.844 -13.861
  181   2HB   LYS  25          1HB       LYS  25 -12.962  -9.338 -14.607
  182   1HG   LYS  25          1HG       LYS  25 -15.683  -8.134 -15.035
  183   2HG   LYS  25          2HG       LYS  25 -14.309  -7.695 -16.049
  184   1HD   LYS  25          1HD       LYS  25 -14.087  -9.891 -16.898
  185   2HD   LYS  25          2HD       LYS  25 -15.061 -10.583 -15.599
  186   1HE   LYS  25          1HE       LYS  25 -16.161  -8.633 -17.640
  187   2HE   LYS  25          2HE       LYS  25 -16.253 -10.383 -17.831
  188   1HZ   LYS  25          1HZ       LYS  25 -17.367 -10.445 -15.625
  189   2HZ   LYS  25          2HZ       LYS  25 -17.432  -8.748 -15.657
  190   3HZ   LYS  25          3HZ       LYS  25 -18.262  -9.651 -16.831
  191    H    GLU  26           H        GLU  26 -12.947  -9.320 -11.157
  192    HA   GLU  26           HA       GLU  26 -12.441 -12.143 -10.741
  193   1HB   GLU  26          1HB       GLU  26  -9.832 -11.534 -11.105
  194   2HB   GLU  26          2HB       GLU  26 -10.818 -12.218 -12.375
  195   1HG   GLU  26          2HG       GLU  26 -10.982  -9.291 -12.224
  196   2HG   GLU  26          1HG       GLU  26  -9.377  -9.879 -12.556
  197    H    TYR  27           H        TYR  27  -9.914 -11.716  -9.335
  198    HA   TYR  27           HA       TYR  27 -10.308  -9.451  -7.567
  199   1HB   TYR  27          1HB       TYR  27 -10.404 -10.985  -5.520
  200   2HB   TYR  27          2HB       TYR  27 -11.881 -10.914  -6.482
  201    HD1  TYR  27           HD1      TYR  27  -8.780 -12.908  -5.870
  202    HD2  TYR  27           HD2      TYR  27 -12.739 -12.854  -7.591
  203    HE1  TYR  27           HE1      TYR  27  -8.640 -15.365  -6.265
  204    HE2  TYR  27           HE2      TYR  27 -12.600 -15.312  -7.986
  205    HH   TYR  27           HH       TYR  27  -9.620 -17.079  -7.577
  206    H    PHE  28           H        PHE  28  -8.557  -9.909  -5.590
  207    HA   PHE  28           HA       PHE  28  -6.321 -11.493  -6.532
  208   1HB   PHE  28          2HB       PHE  28  -5.989  -9.632  -8.024
  209   2HB   PHE  28          1HB       PHE  28  -6.216  -8.474  -6.716
  210    HD1  PHE  28           HD1      PHE  28  -3.939 -11.120  -8.045
  211    HD2  PHE  28           HD2      PHE  28  -4.426  -7.873  -5.243
  212    HE1  PHE  28           HE1      PHE  28  -1.501 -11.204  -7.521
  213    HE2  PHE  28           HE2      PHE  28  -2.001  -7.972  -4.700
  214    HZ   PHE  28           HZ       PHE  28  -0.531  -9.626  -5.852
  215    H    TYR  29           H        TYR  29  -6.539 -12.350  -4.351
  216    HA   TYR  29           HA       TYR  29  -6.469 -10.750  -1.992
  217   1HB   TYR  29          1HB       TYR  29  -7.037 -13.122  -1.897
  218   2HB   TYR  29          2HB       TYR  29  -5.428 -13.557  -2.465
  219    HD1  TYR  29           HD2      TYR  29  -7.376 -12.185   0.376
  220    HD2  TYR  29           HD1      TYR  29  -3.490 -13.466  -1.002
  221    HE1  TYR  29           HE2      TYR  29  -6.536 -12.166   2.722
  222    HE2  TYR  29           HE1      TYR  29  -2.651 -13.447   1.344
  223    HH   TYR  29           HH       TYR  29  -3.996 -13.713   3.782
  224    H    THR  30           H        THR  30  -4.827  -9.719  -1.003
  225    HA   THR  30           HA       THR  30  -2.174  -9.750  -2.329
  226    HB   THR  30           HB       THR  30  -3.039  -7.542  -1.932
  227    HG1  THR  30           HG1      THR  30  -0.945  -7.436  -1.474
  228   1HG2  THR  30          2HG2      THR  30  -3.590  -8.634   0.826
  229   2HG2  THR  30          3HG2      THR  30  -3.483  -6.897   0.537
  230   3HG2  THR  30          1HG2      THR  30  -4.710  -7.855  -0.290
  231    H    SER  31           H        SER  31  -0.291 -10.399  -1.261
  232    HA   SER  31           HA       SER  31  -0.591 -12.305   0.885
  233   1HB   SER  31          1HB       SER  31   2.046 -11.027   0.222
  234   2HB   SER  31          2HB       SER  31   1.694 -12.706   0.630
  235    HG   SER  31           HG       SER  31   1.983 -11.735  -1.747
  236    H    GLY  32           H        GLY  32   1.713 -11.583   2.479
  237   1HA   GLY  32          1HA       GLY  32   0.448  -9.435   4.108
  238   2HA   GLY  32          2HA       GLY  32   1.596 -10.631   4.715
  239    H    LYS  33           H        LYS  33   2.231  -9.096   1.662
  240    HA   LYS  33           HA       LYS  33   4.797  -8.146   2.470
  241   1HB   LYS  33          1HB       LYS  33   3.104  -7.124   0.172
  242   2HB   LYS  33          2HB       LYS  33   4.856  -7.016   0.318
  243   1HG   LYS  33          2HG       LYS  33   4.459  -9.703   0.652
  244   2HG   LYS  33          1HG       LYS  33   3.169  -9.302  -0.481
  245   1HD   LYS  33          1HD       LYS  33   4.782  -9.499  -2.070
  246   2HD   LYS  33          2HD       LYS  33   5.283  -7.896  -1.527
  247   1HE   LYS  33          1HE       LYS  33   7.276  -9.131  -1.380
  248   2HE   LYS  33          2HE       LYS  33   6.656  -9.207   0.269
  249   1HZ   LYS  33          3HZ       LYS  33   5.762 -11.275  -1.582
  250   2HZ   LYS  33          1HZ       LYS  33   7.380 -11.354  -1.071
  251   3HZ   LYS  33          2HZ       LYS  33   6.125 -11.382   0.074
  252    H    CYS  34           H        CYS  34   2.045  -6.106   1.456
  253    HA   CYS  34           HA       CYS  34   3.110  -3.775   2.793
  254   1HB   CYS  34          2HB       CYS  34   0.226  -4.164   1.965
  255   2HB   CYS  34          1HB       CYS  34   1.137  -2.657   2.059
  256    H    SER  35           H        SER  35   1.718  -2.587   4.478
  257    HA   SER  35           HA       SER  35   1.049  -4.524   6.622
  258   1HB   SER  35          1HB       SER  35   2.494  -2.249   6.750
  259   2HB   SER  35          2HB       SER  35   0.898  -1.591   7.107
  260    HG   SER  35           HG       SER  35   1.294  -2.297   9.038
  261    H    ASN  36           H        ASN  36  -0.775  -4.360   4.451
  262    HA   ASN  36           HA       ASN  36  -3.205  -3.553   5.918
  263   1HB   ASN  36          2HB       ASN  36  -2.137  -2.131   3.548
  264   2HB   ASN  36          1HB       ASN  36  -3.839  -2.518   3.497
  265   1HD2  ASN  36          1HD2      ASN  36  -4.384  -1.308   6.751
  266   2HD2  ASN  36          2HD2      ASN  36  -5.260  -1.085   5.313
  267    HA   PRO  37           HA       PRO  37  -3.397  -7.546   3.549
  268   1HB   PRO  37          1HB       PRO  37  -5.302  -8.359   5.585
  269   2HB   PRO  37          2HB       PRO  37  -3.709  -9.044   5.240
  270   1HG   PRO  37          1HG       PRO  37  -4.461  -7.400   7.479
  271   2HG   PRO  37          2HG       PRO  37  -2.854  -8.036   7.102
  272   1HD   PRO  37          2HD       PRO  37  -3.767  -5.307   6.902
  273   2HD   PRO  37          1HD       PRO  37  -2.159  -5.947   6.514
  274    H    ALA  38           H        ALA  38  -5.072  -8.009   2.086
  275    HA   ALA  38           HA       ALA  38  -7.814  -7.217   2.548
  276   1HB   ALA  38          3HB       ALA  38  -6.390  -5.034   1.954
  277   2HB   ALA  38          1HB       ALA  38  -6.581  -5.634   0.305
  278   3HB   ALA  38          2HB       ALA  38  -8.003  -5.269   1.283
  279    H    VAL  39           H        VAL  39  -8.627  -6.865  -0.037
  280    HA   VAL  39           HA       VAL  39  -7.567  -9.104  -1.630
  281    HB   VAL  39           HB       VAL  39  -9.720  -9.494   0.068
  282   1HG1  VAL  39          1HG1      VAL  39 -11.017  -7.989  -1.596
  283   2HG1  VAL  39          2HG1      VAL  39 -10.972  -9.402  -2.652
  284   3HG1  VAL  39          3HG1      VAL  39 -11.749  -9.505  -1.071
  285   1HG2  VAL  39          3HG2      VAL  39  -8.472 -10.874  -2.185
  286   2HG2  VAL  39          1HG2      VAL  39  -8.912 -11.478  -0.584
  287   3HG2  VAL  39          2HG2      VAL  39 -10.131 -11.384  -1.860
  288    H    VAL  40           H        VAL  40  -7.642  -8.465  -3.746
  289    HA   VAL  40           HA       VAL  40  -8.936  -5.829  -4.135
  290    HB   VAL  40           HB       VAL  40  -6.490  -7.051  -5.390
  291   1HG1  VAL  40          1HG1      VAL  40  -8.292  -5.239  -6.642
  292   2HG1  VAL  40          2HG1      VAL  40  -6.913  -4.294  -6.104
  293   3HG1  VAL  40          3HG1      VAL  40  -6.670  -5.678  -7.165
  294   1HG2  VAL  40          1HG2      VAL  40  -6.653  -5.850  -3.075
  295   2HG2  VAL  40          2HG2      VAL  40  -5.357  -5.390  -4.184
  296   3HG2  VAL  40          3HG2      VAL  40  -6.806  -4.385  -4.049
  297    H    PHE  41           H        PHE  41 -10.652  -5.708  -5.331
  298    HA   PHE  41           HA       PHE  41 -11.289  -7.901  -7.137
  299   1HB   PHE  41          2HB       PHE  41 -12.770  -5.465  -6.175
  300   2HB   PHE  41          1HB       PHE  41 -13.371  -6.388  -7.551
  301    HD1  PHE  41           HD1      PHE  41 -13.018  -9.141  -6.999
  302    HD2  PHE  41           HD2      PHE  41 -13.885  -5.973  -4.198
  303    HE1  PHE  41           HE1      PHE  41 -14.035 -10.800  -5.438
  304    HE2  PHE  41           HE2      PHE  41 -14.900  -7.628  -2.641
  305    HZ   PHE  41           HZ       PHE  41 -14.985 -10.040  -3.260
  306    H    VAL  42           H        VAL  42 -11.081  -7.886  -9.223
  307    HA   VAL  42           HA       VAL  42 -10.058  -5.384 -10.494
  308    HB   VAL  42           HB       VAL  42  -9.723  -7.522 -12.283
  309   1HG1  VAL  42          3HG2      VAL  42  -7.898  -6.091 -10.355
  310   2HG1  VAL  42          1HG2      VAL  42  -7.290  -7.175 -11.608
  311   3HG1  VAL  42          2HG2      VAL  42  -8.163  -5.710 -12.061
  312   1HG2  VAL  42          2HG1      VAL  42 -10.079  -9.110 -10.429
  313   2HG2  VAL  42          3HG1      VAL  42  -8.423  -9.168 -11.012
  314   3HG2  VAL  42          1HG1      VAL  42  -8.804  -8.323  -9.512
  315    H    THR  43           H        THR  43 -12.262  -4.600 -10.699
  316    HA   THR  43           HA       THR  43 -14.334  -6.187 -11.971
  317    HB   THR  43           HB       THR  43 -15.756  -4.315 -11.628
  318    HG1  THR  43           HG1      THR  43 -14.919  -2.252 -11.304
  319   1HG2  THR  43          1HG2      THR  43 -14.859  -5.393  -9.542
  320   2HG2  THR  43          2HG2      THR  43 -13.650  -4.113  -9.458
  321   3HG2  THR  43          3HG2      THR  43 -15.363  -3.720  -9.315
  322    H    ARG  44           H        ARG  44 -15.640  -4.356 -13.569
  323    HA   ARG  44           HA       ARG  44 -14.672  -4.938 -16.096
  324   1HB   ARG  44          1HB       ARG  44 -15.977  -2.815 -16.822
  325   2HB   ARG  44          2HB       ARG  44 -16.868  -4.092 -16.041
  326   1HG   ARG  44          1HG       ARG  44 -15.916  -2.473 -13.942
  327   2HG   ARG  44          2HG       ARG  44 -16.482  -1.358 -15.181
  328   1HD   ARG  44          1HD       ARG  44 -18.553  -2.977 -15.287
  329   2HD   ARG  44          2HD       ARG  44 -18.016  -3.455 -13.675
  330    HE   ARG  44           HE       ARG  44 -18.054  -0.686 -13.566
  331   1HH1  ARG  44          1HH1      ARG  44 -20.298  -2.140 -15.516
  332   2HH1  ARG  44          2HH1      ARG  44 -21.683  -1.616 -14.617
  333   1HH2  ARG  44          2HH2      ARG  44 -19.934  -1.009 -11.741
  334   2HH2  ARG  44          1HH2      ARG  44 -21.331  -0.471 -12.612
  335    H    LYS  45           H        LYS  45 -14.261  -1.698 -14.544
  336    HA   LYS  45           HA       LYS  45 -12.306  -0.766 -16.412
  337   1HB   LYS  45          2HB       LYS  45 -12.845  -0.116 -13.513
  338   2HB   LYS  45          1HB       LYS  45 -11.506   0.615 -14.365
  339   1HG   LYS  45          1HG       LYS  45 -13.298   1.182 -16.185
  340   2HG   LYS  45          2HG       LYS  45 -14.451   0.912 -14.878
  341   1HD   LYS  45          1HD       LYS  45 -14.057   3.145 -14.505
  342   2HD   LYS  45          2HD       LYS  45 -12.702   2.498 -13.581
  343   1HE   LYS  45          1HE       LYS  45 -11.148   3.130 -15.157
  344   2HE   LYS  45          2HE       LYS  45 -12.271   2.916 -16.501
  345   1HZ   LYS  45          1HZ       LYS  45 -12.466   5.106 -14.507
  346   2HZ   LYS  45          2HZ       LYS  45 -11.708   5.264 -16.019
  347   3HZ   LYS  45          3HZ       LYS  45 -13.372   4.935 -15.934
  348    H    ASN  46           H        ASN  46 -12.241  -2.869 -13.662
  349    HA   ASN  46           HA       ASN  46 -10.732  -4.427 -12.930
  350   1HB   ASN  46          1HB       ASN  46 -10.039  -3.950 -15.727
  351   2HB   ASN  46          2HB       ASN  46  -8.615  -4.330 -14.794
  352   1HD2  ASN  46          1HD2      ASN  46 -10.433  -7.137 -16.336
  353   2HD2  ASN  46          2HD2      ASN  46  -8.804  -6.711 -16.114
  354    H    ARG  47           H        ARG  47 -10.252  -1.299 -12.681
  355    HA   ARG  47           HA       ARG  47  -7.425  -1.070 -12.142
  356   1HB   ARG  47          1HB       ARG  47  -9.697   0.227 -10.589
  357   2HB   ARG  47          2HB       ARG  47  -8.022   0.777 -10.651
  358   1HG   ARG  47          1HG       ARG  47  -9.512   0.486 -13.232
  359   2HG   ARG  47          2HG       ARG  47  -9.879   1.874 -12.208
  360   1HD   ARG  47          1HD       ARG  47  -7.070   1.677 -12.222
  361   2HD   ARG  47          2HD       ARG  47  -7.567   1.415 -13.894
  362    HE   ARG  47           HE       ARG  47  -8.911   3.692 -12.674
  363   1HH1  ARG  47          2HH1      ARG  47  -6.483   2.864 -15.190
  364   2HH1  ARG  47          1HH1      ARG  47  -7.277   4.292 -15.766
  365   1HH2  ARG  47          1HH2      ARG  47  -5.946   5.022 -12.687
  366   2HH2  ARG  47          2HH2      ARG  47  -7.200   5.991 -13.388
  367    H    GLN  48           H        GLN  48  -6.366  -1.680 -10.063
  368    HA   GLN  48           HA       GLN  48  -7.725  -3.984  -8.980
  369   1HB   GLN  48          1HB       GLN  48  -5.021  -2.818  -8.705
  370   2HB   GLN  48          2HB       GLN  48  -5.586  -3.845  -7.385
  371   1HG   GLN  48          1HG       GLN  48  -6.110  -5.631  -8.958
  372   2HG   GLN  48          2HG       GLN  48  -5.750  -4.605 -10.314
  373   1HE2  GLN  48          1HE2      GLN  48  -2.686  -5.587  -7.787
  374   2HE2  GLN  48          2HE2      GLN  48  -4.110  -6.505  -7.685
  375    H    VAL  49           H        VAL  49  -9.504  -3.205  -8.120
  376    HA   VAL  49           HA       VAL  49  -9.591  -1.047  -6.209
  377    HB   VAL  49           HB       VAL  49 -11.860  -2.920  -6.292
  378   1HG1  VAL  49          3HG1      VAL  49 -11.462   0.051  -6.635
  379   2HG1  VAL  49          1HG1      VAL  49 -13.044  -0.731  -6.671
  380   3HG1  VAL  49          2HG1      VAL  49 -12.067  -0.787  -5.202
  381   1HG2  VAL  49          3HG2      VAL  49 -10.692  -1.802  -8.803
  382   2HG2  VAL  49          1HG2      VAL  49 -11.730  -3.207  -8.605
  383   3HG2  VAL  49          2HG2      VAL  49 -12.425  -1.591  -8.604
  384    H    CYS  50           H        CYS  50 -10.718  -1.532  -4.017
  385    HA   CYS  50           HA       CYS  50  -9.361  -3.886  -2.790
  386   1HB   CYS  50          1HB       CYS  50  -9.225  -1.207  -2.137
  387   2HB   CYS  50          2HB       CYS  50 -10.483  -1.760  -1.074
  388    H    ALA  51           H        ALA  51 -10.798  -3.853  -0.403
  389    HA   ALA  51           HA       ALA  51 -13.525  -3.647  -0.284
  390   1HB   ALA  51          2HB       ALA  51 -12.751  -6.070  -1.899
  391   2HB   ALA  51          3HB       ALA  51 -14.229  -6.059  -0.943
  392   3HB   ALA  51          1HB       ALA  51 -14.011  -4.881  -2.231
  393    H    ASN  52           H        ASN  52 -10.896  -4.387   1.226
  394    HA   ASN  52           HA       ASN  52 -10.464  -5.313   3.315
  395   1HB   ASN  52          1HB       ASN  52 -12.789  -4.353   3.735
  396   2HB   ASN  52          2HB       ASN  52 -13.407  -5.967   3.388
  397   1HD2  ASN  52          1HD2      ASN  52 -11.689  -4.764   6.761
  398   2HD2  ASN  52          2HD2      ASN  52 -10.499  -4.945   5.564
  399    HA   PRO  53           HA       PRO  53 -10.201  -9.544   2.087
  400   1HB   PRO  53          2HB       PRO  53  -8.687 -10.450   4.171
  401   2HB   PRO  53          1HB       PRO  53  -8.033  -9.524   2.844
  402   1HG   PRO  53          1HG       PRO  53  -8.502  -8.648   5.634
  403   2HG   PRO  53          2HG       PRO  53  -7.418  -7.971   4.435
  404   1HD   PRO  53          2HD       PRO  53  -9.984  -6.959   5.194
  405   2HD   PRO  53          1HD       PRO  53  -8.954  -6.362   3.898
  406    H    GLU  54           H        GLU  54 -11.366  -8.629   5.312
  407    HA   GLU  54           HA       GLU  54 -12.708 -11.301   5.507
  408   1HB   GLU  54          1HB       GLU  54 -11.490  -9.523   7.607
  409   2HB   GLU  54          2HB       GLU  54 -12.734 -10.697   8.037
  410   1HG   GLU  54          1HG       GLU  54 -11.324 -12.457   7.770
  411   2HG   GLU  54          2HG       GLU  54 -10.621 -11.785   6.298
  412    H    LYS  55           H        LYS  55 -13.928  -9.024   4.176
  413    HA   LYS  55           HA       LYS  55 -15.939  -8.010   6.089
  414   1HB   LYS  55          1HB       LYS  55 -14.875  -7.055   3.668
  415   2HB   LYS  55          2HB       LYS  55 -16.543  -7.421   3.328
  416   1HG   LYS  55          1HG       LYS  55 -16.375  -5.123   4.140
  417   2HG   LYS  55          2HG       LYS  55 -17.218  -6.107   5.335
  418   1HD   LYS  55          1HD       LYS  55 -14.752  -6.466   6.263
  419   2HD   LYS  55          2HD       LYS  55 -14.469  -4.932   5.440
  420   1HE   LYS  55          1HE       LYS  55 -15.453  -3.837   7.142
  421   2HE   LYS  55          2HE       LYS  55 -16.944  -4.735   6.858
  422   1HZ   LYS  55          3HZ       LYS  55 -14.762  -6.083   8.268
  423   2HZ   LYS  55          1HZ       LYS  55 -15.658  -4.917   9.117
  424   3HZ   LYS  55          2HZ       LYS  55 -16.441  -6.266   8.443
  425    H    LYS  56           H        LYS  56 -15.771 -10.938   5.250
  426    HA   LYS  56           HA       LYS  56 -17.287 -12.658   4.823
  427   1HB   LYS  56          1HB       LYS  56 -19.266 -10.405   5.257
  428   2HB   LYS  56          2HB       LYS  56 -19.718 -12.099   5.087
  429   1HG   LYS  56          1HG       LYS  56 -18.523 -12.707   7.070
  430   2HG   LYS  56          2HG       LYS  56 -17.721 -11.138   7.147
  431   1HD   LYS  56          1HD       LYS  56 -19.508 -10.141   8.137
  432   2HD   LYS  56          2HD       LYS  56 -20.664 -10.986   7.106
  433   1HE   LYS  56          1HE       LYS  56 -21.161 -12.122   9.021
  434   2HE   LYS  56          2HE       LYS  56 -19.721 -13.055   8.612
  435   1HZ   LYS  56          3HZ       LYS  56 -18.422 -11.434   9.931
  436   2HZ   LYS  56          1HZ       LYS  56 -19.877 -10.711  10.426
  437   3HZ   LYS  56          2HZ       LYS  56 -19.537 -12.318  10.858
  438    H    TRP  57           H        TRP  57 -19.417 -10.259   3.340
  439    HA   TRP  57           HA       TRP  57 -19.968 -11.598   0.998
  440   1HB   TRP  57          1HB       TRP  57 -20.579  -9.467   0.018
  441   2HB   TRP  57          2HB       TRP  57 -21.029  -9.463   1.727
  442    HD1  TRP  57           HD1      TRP  57 -20.019  -7.532   3.136
  443    HE1  TRP  57           HE1      TRP  57 -18.355  -5.629   2.608
  444    HE3  TRP  57           HE3      TRP  57 -18.451  -9.076  -1.416
  445    HZ2  TRP  57           HZ2      TRP  57 -16.571  -4.863   0.458
  446    HZ3  TRP  57           HZ3      TRP  57 -16.877  -7.746  -2.747
  447    HH2  TRP  57           HH2      TRP  57 -15.932  -5.634  -1.826
  448    H    VAL  58           H        VAL  58 -16.969  -9.935   1.699
  449    HA   VAL  58           HA       VAL  58 -16.040  -9.750  -1.014
  450    HB   VAL  58           HB       VAL  58 -13.702 -10.043   0.210
  451   1HG1  VAL  58          3HG1      VAL  58 -15.056  -7.987  -0.756
  452   2HG1  VAL  58          1HG1      VAL  58 -15.136  -7.555   0.950
  453   3HG1  VAL  58          2HG1      VAL  58 -13.572  -7.773   0.159
  454   1HG2  VAL  58          2HG2      VAL  58 -15.278 -10.587   2.334
  455   2HG2  VAL  58          3HG2      VAL  58 -13.656  -9.907   2.454
  456   3HG2  VAL  58          1HG2      VAL  58 -15.062  -8.847   2.515
  457    H    ARG  59           H        ARG  59 -15.367 -12.257   1.469
  458    HA   ARG  59           HA       ARG  59 -13.930 -13.958  -0.339
  459   1HB   ARG  59          2HB       ARG  59 -15.415 -14.574   2.228
  460   2HB   ARG  59          1HB       ARG  59 -14.422 -15.735   1.382
  461   1HG   ARG  59          2HG       ARG  59 -12.673 -13.696   1.507
  462   2HG   ARG  59          1HG       ARG  59 -13.610 -13.339   2.936
  463   1HD   ARG  59          1HD       ARG  59 -13.028 -15.337   3.989
  464   2HD   ARG  59          2HD       ARG  59 -12.679 -16.150   2.463
  465    HE   ARG  59           HE       ARG  59 -10.644 -14.562   2.362
  466   1HH1  ARG  59          2HH2      ARG  59 -11.721 -15.786   5.711
  467   2HH1  ARG  59          1HH2      ARG  59 -10.349 -16.719   5.214
  468   1HH2  ARG  59          1HH1      ARG  59  -9.300 -13.435   3.959
  469   2HH2  ARG  59          2HH1      ARG  59  -9.265 -14.087   5.564
  470    H    GLU  60           H        GLU  60 -17.334 -13.728   0.590
  471    HA   GLU  60           HA       GLU  60 -18.193 -16.064  -0.878
  472   1HB   GLU  60          1HB       GLU  60 -19.578 -13.648   0.261
  473   2HB   GLU  60          2HB       GLU  60 -20.458 -14.750  -0.799
  474   1HG   GLU  60          1HG       GLU  60 -19.366 -16.573   0.811
  475   2HG   GLU  60          2HG       GLU  60 -19.345 -15.231   1.930
  476    H    TYR  61           H        TYR  61 -17.142 -12.961  -1.830
  477    HA   TYR  61           HA       TYR  61 -18.566 -13.068  -4.425
  478   1HB   TYR  61          1HB       TYR  61 -16.927 -10.989  -2.984
  479   2HB   TYR  61          2HB       TYR  61 -17.214 -10.847  -4.698
  480    HD1  TYR  61           HD1      TYR  61 -19.747 -12.440  -2.524
  481    HD2  TYR  61           HD2      TYR  61 -18.502  -8.759  -4.415
  482    HE1  TYR  61           HE1      TYR  61 -21.965 -11.430  -2.020
  483    HE2  TYR  61           HE2      TYR  61 -20.725  -7.753  -3.900
  484    HH   TYR  61           HH       TYR  61 -23.060  -8.580  -3.479
  485    H    ILE  62           H        ILE  62 -15.470 -13.642  -2.935
  486    HA   ILE  62           HA       ILE  62 -13.800 -13.486  -5.248
  487    HB   ILE  62           HB       ILE  62 -13.625 -15.106  -2.691
  488   1HG1  ILE  62          1HG1      ILE  62 -13.410 -12.614  -2.579
  489   2HG1  ILE  62          2HG1      ILE  62 -11.972 -13.452  -2.059
  490   1HG2  ILE  62          1HG2      ILE  62 -11.873 -15.108  -5.109
  491   2HG2  ILE  62          2HG2      ILE  62 -11.094 -15.153  -3.528
  492   3HG2  ILE  62          3HG2      ILE  62 -12.237 -16.416  -3.984
  493   1HD1  ILE  62          2HD1      ILE  62 -10.991 -13.126  -4.321
  494   2HD1  ILE  62          3HD1      ILE  62 -12.425 -12.210  -4.784
  495   3HD1  ILE  62          1HD1      ILE  62 -11.355 -11.595  -3.525
  496    H    ASN  63           H        ASN  63 -15.588 -16.229  -3.811
  497    HA   ASN  63           HA       ASN  63 -14.820 -18.044  -5.953
  498   1HB   ASN  63          2HB       ASN  63 -16.482 -18.160  -3.514
  499   2HB   ASN  63          1HB       ASN  63 -17.012 -19.202  -4.813
  500   1HD2  ASN  63          2HD2      ASN  63 -15.247 -21.625  -4.034
  501   2HD2  ASN  63          1HD2      ASN  63 -15.652 -20.822  -2.594
  502    H    SER  64           H        SER  64 -17.662 -16.054  -5.207
  503    HA   SER  64           HA       SER  64 -19.427 -17.030  -7.180
  504   1HB   SER  64          2HB       SER  64 -19.975 -15.315  -5.420
  505   2HB   SER  64          1HB       SER  64 -19.104 -14.123  -6.384
  506    HG   SER  64           HG       SER  64 -21.558 -15.320  -6.816
  507    H    LEU  65           H        LEU  65 -16.674 -14.844  -7.473
  508    HA   LEU  65           HA       LEU  65 -17.229 -13.966 -10.154
  509   1HB   LEU  65          1HB       LEU  65 -14.716 -14.114  -8.495
  510   2HB   LEU  65          2HB       LEU  65 -14.676 -13.568 -10.154
  511    HG   LEU  65           HG       LEU  65 -16.470 -12.383  -8.021
  512   1HD1  LEU  65          2HD1      LEU  65 -13.706 -11.699  -8.972
  513   2HD1  LEU  65          3HD1      LEU  65 -14.793 -10.399  -8.484
  514   3HD1  LEU  65          1HD1      LEU  65 -14.362 -11.665  -7.335
  515   1HD2  LEU  65          2HD2      LEU  65 -16.248 -12.115 -10.923
  516   2HD2  LEU  65          3HD2      LEU  65 -17.518 -11.544  -9.840
  517   3HD2  LEU  65          1HD2      LEU  65 -16.073 -10.566 -10.096
  518    H    GLU  66           H        GLU  66 -15.145 -14.573 -11.763
  519    HA   GLU  66           HA       GLU  66 -15.140 -17.562 -11.898
  520   1HB   GLU  66          1HB       GLU  66 -15.479 -15.562 -14.150
  521   2HB   GLU  66          2HB       GLU  66 -15.170 -17.279 -14.403
  522   1HG   GLU  66          1HG       GLU  66 -17.243 -17.390 -12.634
  523   2HG   GLU  66          2HG       GLU  66 -17.642 -15.916 -13.515
  524    H    MET  67           H        MET  67 -13.199 -18.499 -12.688
  525    HA   MET  67           HA       MET  67 -10.883 -16.610 -12.757
  526   1HB   MET  67          1HB       MET  67 -11.063 -18.476 -10.960
  527   2HB   MET  67          2HB       MET  67 -10.672 -19.580 -12.279
  528   1HG   MET  67          1HG       MET  67  -8.764 -17.716 -12.690
  529   2HG   MET  67          2HG       MET  67  -8.968 -17.536 -10.947
  530   1HE   MET  67          2HE       MET  67  -9.308 -19.260  -9.477
  531   2HE   MET  67          1HE       MET  67  -9.512 -20.936  -9.988
  532   3HE   MET  67          3HE       MET  67  -8.003 -20.422  -9.233
  533    H    SER  68           H        SER  68 -12.137 -16.694 -15.128
  534    HA   SER  68           HA       SER  68 -10.164 -17.781 -16.909
  535   1HB   SER  68          1HB       SER  68 -12.324 -19.554 -16.137
  536   2HB   SER  68          2HB       SER  68 -12.393 -19.211 -17.866
  537    HG   SER  68           HG       SER  68 -10.265 -19.874 -18.055
  538    H    SER   1           H        SER   1 -11.877   7.775   4.715
  539    HA   SER   1           HA       SER   1 -14.358   8.613   3.282
  540   1HB   SER   1          1HB       SER   1 -12.011  10.279   4.081
  541   2HB   SER   1          2HB       SER   1 -12.732  10.587   2.501
  542    HG   SER   1           HG       SER   1 -14.405  11.421   3.436
  543    HA   PRO   2           HA       PRO   2 -11.356   6.086   0.719
  544   1HB   PRO   2          1HB       PRO   2 -13.660   4.706  -0.334
  545   2HB   PRO   2          2HB       PRO   2 -12.367   4.045   0.674
  546   1HG   PRO   2          1HG       PRO   2 -15.092   4.609   1.441
  547   2HG   PRO   2          2HG       PRO   2 -13.798   3.947   2.448
  548   1HD   PRO   2          1HD       PRO   2 -14.942   6.595   2.545
  549   2HD   PRO   2          2HD       PRO   2 -13.645   5.931   3.558
  550    H    TYR   3           H        TYR   3 -10.915   6.742  -1.376
  551    HA   TYR   3           HA       TYR   3 -13.069   8.256  -2.800
  552   1HB   TYR   3          1HB       TYR   3 -10.255   8.887  -2.230
  553   2HB   TYR   3          2HB       TYR   3 -10.690   9.092  -3.927
  554    HD1  TYR   3           HD2      TYR   3 -12.480  10.672  -4.602
  555    HD2  TYR   3           HD1      TYR   3 -11.237  10.275  -0.486
  556    HE1  TYR   3           HE2      TYR   3 -13.647  12.803  -4.044
  557    HE2  TYR   3           HE1      TYR   3 -12.403  12.407   0.072
  558    HH   TYR   3           HH       TYR   3 -13.250  14.367  -0.951
  559    H    SER   4           H        SER   4 -10.001   6.529  -3.495
  560    HA   SER   4           HA       SER   4 -11.175   5.652  -6.080
  561   1HB   SER   4          1HB       SER   4  -8.404   4.879  -5.326
  562   2HB   SER   4          2HB       SER   4  -9.029   5.465  -6.868
  563    HG   SER   4           HG       SER   4  -7.662   6.857  -5.252
  564    H    SER   5           H        SER   5  -9.612   4.288  -3.174
  565    HA   SER   5           HA       SER   5  -9.840   2.163  -2.205
  566   1HB   SER   5          1HB       SER   5 -12.142   1.603  -4.063
  567   2HB   SER   5          2HB       SER   5 -11.919   1.089  -2.392
  568    HG   SER   5           HG       SER   5 -12.674   2.930  -1.706
  569    H    ASP   6           H        ASP   6  -7.809   2.002  -3.714
  570    HA   ASP   6           HA       ASP   6  -8.100  -0.518  -5.236
  571   1HB   ASP   6          2HB       ASP   6  -6.979   0.389  -7.226
  572   2HB   ASP   6          1HB       ASP   6  -8.461   1.291  -6.914
  573    H    THR   7           H        THR   7  -5.502  -0.481  -6.349
  574    HA   THR   7           HA       THR   7  -3.990  -0.893  -3.874
  575    HB   THR   7           HB       THR   7  -3.940  -2.592  -5.685
  576    HG1  THR   7           HG1      THR   7  -1.743  -2.884  -5.579
  577   1HG2  THR   7          1HG2      THR   7  -4.076  -0.946  -7.568
  578   2HG2  THR   7          2HG2      THR   7  -2.411  -0.474  -7.228
  579   3HG2  THR   7          3HG2      THR   7  -2.770  -2.114  -7.771
  580    H    THR   8           H        THR   8  -1.558  -0.232  -4.023
  581    HA   THR   8           HA       THR   8  -1.189   2.384  -5.377
  582    HB   THR   8           HB       THR   8  -0.482   2.053  -2.457
  583    HG1  THR   8           HG1      THR   8  -2.741   1.833  -2.730
  584   1HG2  THR   8          2HG2      THR   8   0.565   3.844  -3.936
  585   2HG2  THR   8          3HG2      THR   8  -1.047   4.540  -4.088
  586   3HG2  THR   8          1HG2      THR   8  -0.275   4.443  -2.506
  587    HA   PRO   9           HA       PRO   9   2.532   0.018  -6.226
  588   1HB   PRO   9          1HB       PRO   9   3.634   2.444  -7.386
  589   2HB   PRO   9          2HB       PRO   9   3.111   0.972  -8.212
  590   1HG   PRO   9          2HG       PRO   9   1.767   3.513  -8.162
  591   2HG   PRO   9          1HG       PRO   9   1.204   2.020  -8.916
  592   1HD   PRO   9          2HD       PRO   9   0.190   3.289  -6.561
  593   2HD   PRO   9          1HD       PRO   9  -0.371   1.806  -7.317
  594    H    CYS  10           H        CYS  10   3.452  -0.185  -4.167
  595    HA   CYS  10           HA       CYS  10   5.425   1.890  -3.423
  596   1HB   CYS  10          2HB       CYS  10   4.658   1.890  -1.065
  597   2HB   CYS  10          1HB       CYS  10   3.404   2.501  -2.142
  598    H    CYS  11           H        CYS  11   7.204   1.015  -2.290
  599    HA   CYS  11           HA       CYS  11   7.114  -1.943  -2.185
  600   1HB   CYS  11          1HB       CYS  11   9.627  -1.810  -2.122
  601   2HB   CYS  11          2HB       CYS  11   8.868  -1.306  -3.597
  602    H    PHE  12           H        PHE  12   7.339  -3.008  -0.275
  603    HA   PHE  12           HA       PHE  12   7.382  -1.376   2.172
  604   1HB   PHE  12          2HB       PHE  12   6.714  -3.423   3.304
  605   2HB   PHE  12          1HB       PHE  12   5.730  -3.222   1.876
  606    HD1  PHE  12           HD1      PHE  12   6.060  -4.656  -0.125
  607    HD2  PHE  12           HD2      PHE  12   8.399  -5.192   3.467
  608    HE1  PHE  12           HE1      PHE  12   6.862  -6.856  -0.975
  609    HE2  PHE  12           HE2      PHE  12   9.189  -7.400   2.622
  610    HZ   PHE  12           HZ       PHE  12   8.426  -8.228   0.398
  611    H    ALA  13           H        ALA  13   9.284  -4.052   0.762
  612    HA   ALA  13           HA       ALA  13  11.326  -3.595   2.869
  613   1HB   ALA  13          3HB       ALA  13  10.732  -5.860   0.987
  614   2HB   ALA  13          1HB       ALA  13  12.343  -5.702   1.688
  615   3HB   ALA  13          2HB       ALA  13  10.939  -5.901   2.738
  616    H    TYR  14           H        TYR  14  13.243  -2.653   2.411
  617    HA   TYR  14           HA       TYR  14  13.739  -2.109  -0.452
  618   1HB   TYR  14          2HB       TYR  14  15.195  -0.160   0.638
  619   2HB   TYR  14          1HB       TYR  14  13.497   0.045   0.290
  620    HD1  TYR  14           HD2      TYR  14  11.792  -0.530   2.163
  621    HD2  TYR  14           HD1      TYR  14  16.015   0.067   2.841
  622    HE1  TYR  14           HE2      TYR  14  11.355  -0.200   4.583
  623    HE2  TYR  14           HE1      TYR  14  15.572   0.414   5.268
  624    HH   TYR  14           HH       TYR  14  12.494  -0.281   6.702
  625    H    ILE  15           H        ILE  15  15.695  -2.687  -1.309
  626    HA   ILE  15           HA       ILE  15  17.382  -4.488   0.156
  627    HB   ILE  15           HB       ILE  15  17.182  -4.578  -2.296
  628   1HG1  ILE  15          1HG1      ILE  15  20.008  -3.781  -1.556
  629   2HG1  ILE  15          2HG1      ILE  15  19.294  -5.327  -1.099
  630   1HG2  ILE  15          1HG2      ILE  15  18.426  -1.829  -2.096
  631   2HG2  ILE  15          2HG2      ILE  15  18.465  -2.773  -3.585
  632   3HG2  ILE  15          3HG2      ILE  15  16.919  -2.282  -2.892
  633   1HD1  ILE  15          3HD1      ILE  15  18.686  -5.254  -3.756
  634   2HD1  ILE  15          1HD1      ILE  15  20.219  -4.382  -3.748
  635   3HD1  ILE  15          2HD1      ILE  15  20.133  -6.022  -3.104
  636    H    ALA  16           H        ALA  16  19.708  -4.117   0.610
  637    HA   ALA  16           HA       ALA  16  20.155  -1.318   1.542
  638   1HB   ALA  16          1HB       ALA  16  20.364  -3.728   2.906
  639   2HB   ALA  16          2HB       ALA  16  22.037  -3.342   2.505
  640   3HB   ALA  16          3HB       ALA  16  21.062  -2.192   3.421
  641    H    ARG  17           H        ARG  17  20.792  -0.814  -0.739
  642    HA   ARG  17           HA       ARG  17  23.655  -0.879  -1.039
  643   1HB   ARG  17          2HB       ARG  17  23.126  -3.206  -1.732
  644   2HB   ARG  17          1HB       ARG  17  22.073  -2.579  -2.978
  645   1HG   ARG  17          1HG       ARG  17  24.637  -1.267  -3.128
  646   2HG   ARG  17          2HG       ARG  17  24.857  -3.017  -3.158
  647   1HD   ARG  17          1HD       ARG  17  22.714  -2.724  -4.834
  648   2HD   ARG  17          2HD       ARG  17  23.607  -1.238  -5.161
  649    HE   ARG  17           HE       ARG  17  25.606  -2.768  -5.596
  650   1HH1  ARG  17          2HH2      ARG  17  24.734  -5.460  -5.035
  651   2HH1  ARG  17          1HH2      ARG  17  23.512  -5.872  -6.190
  652   1HH2  ARG  17          1HH1      ARG  17  24.653  -3.812  -8.285
  653   2HH2  ARG  17          2HH1      ARG  17  22.981  -3.693  -7.849
  654    HA   PRO  18           HA       PRO  18  21.981   2.735  -3.130
  655   1HB   PRO  18          2HB       PRO  18  24.619   3.474  -3.979
  656   2HB   PRO  18          1HB       PRO  18  23.663   4.188  -2.686
  657   1HG   PRO  18          2HG       PRO  18  25.970   2.450  -2.446
  658   2HG   PRO  18          1HG       PRO  18  25.062   3.247  -1.156
  659   1HD   PRO  18          1HD       PRO  18  25.058   0.461  -1.810
  660   2HD   PRO  18          2HD       PRO  18  24.060   1.280  -0.597
  661    H    LEU  19           H        LEU  19  20.935   1.895  -4.907
  662    HA   LEU  19           HA       LEU  19  22.056   0.354  -6.995
  663   1HB   LEU  19          2HB       LEU  19  19.821   2.374  -7.247
  664   2HB   LEU  19          1HB       LEU  19  20.104   1.018  -8.307
  665    HG   LEU  19           HG       LEU  19  19.362   0.886  -5.379
  666   1HD1  LEU  19          3HD1      LEU  19  17.637   1.445  -7.272
  667   2HD1  LEU  19          1HD1      LEU  19  17.794  -0.267  -7.667
  668   3HD1  LEU  19          2HD1      LEU  19  17.231   0.221  -6.068
  669   1HD2  LEU  19          2HD2      LEU  19  20.622  -1.043  -7.167
  670   2HD2  LEU  19          3HD2      LEU  19  20.357  -1.145  -5.427
  671   3HD2  LEU  19          1HD2      LEU  19  19.082  -1.638  -6.543
  672    HA   PRO  20           HA       PRO  20  24.761   3.510  -8.710
  673   1HB   PRO  20          1HB       PRO  20  24.870   1.970 -11.175
  674   2HB   PRO  20          2HB       PRO  20  26.146   2.217  -9.977
  675   1HG   PRO  20          1HG       PRO  20  24.621  -0.174 -10.429
  676   2HG   PRO  20          2HG       PRO  20  25.839   0.100  -9.179
  677   1HD   PRO  20          1HD       PRO  20  22.981  -0.118  -8.847
  678   2HD   PRO  20          2HD       PRO  20  24.203   0.165  -7.592
  679    H    ARG  21           H        ARG  21  23.797   5.345  -9.469
  680    HA   ARG  21           HA       ARG  21  21.295   5.570 -10.672
  681   1HB   ARG  21          2HB       ARG  21  21.939   7.802 -11.352
  682   2HB   ARG  21          1HB       ARG  21  22.658   7.472  -9.797
  683   1HG   ARG  21          1HG       ARG  21  24.509   8.311 -10.900
  684   2HG   ARG  21          2HG       ARG  21  24.674   6.602 -11.308
  685   1HD   ARG  21          2HD       ARG  21  23.931   6.912 -13.483
  686   2HD   ARG  21          1HD       ARG  21  22.982   8.336 -13.068
  687    HE   ARG  21           HE       ARG  21  25.648   9.079 -12.652
  688   1HH1  ARG  21          2HH2      ARG  21  23.611  10.101 -14.856
  689   2HH1  ARG  21          1HH2      ARG  21  24.200   9.296 -16.272
  690   1HH2  ARG  21          1HH1      ARG  21  27.232   8.944 -14.702
  691   2HH2  ARG  21          2HH1      ARG  21  26.401   8.208 -16.032
  692    H    ALA  22           H        ALA  22  24.300   4.627 -12.171
  693    HA   ALA  22           HA       ALA  22  23.545   5.147 -14.892
  694   1HB   ALA  22          3HB       ALA  22  25.882   4.562 -13.963
  695   2HB   ALA  22          1HB       ALA  22  25.345   2.883 -14.022
  696   3HB   ALA  22          2HB       ALA  22  25.427   3.835 -15.504
  697    H    HIS  23           H        HIS  23  23.375   2.169 -12.916
  698    HA   HIS  23           HA       HIS  23  22.037   0.648 -14.966
  699   1HB   HIS  23          1HB       HIS  23  21.905   0.201 -11.972
  700   2HB   HIS  23          2HB       HIS  23  21.625  -0.994 -13.238
  701    HD2  HIS  23           HD2      HIS  23  24.646   0.975 -14.332
  702    HE1  HIS  23           HE1      HIS  23  26.193  -2.231 -12.051
  703    HE2  HIS  23           HE2      HIS  23  26.786  -0.362 -13.672
  704    H    ILE  24           H        ILE  24  20.949   2.956 -12.577
  705    HA   ILE  24           HA       ILE  24  18.156   2.095 -12.760
  706    HB   ILE  24           HB       ILE  24  19.175   4.707 -11.664
  707   1HG1  ILE  24          1HG1      ILE  24  18.869   2.048 -10.257
  708   2HG1  ILE  24          2HG1      ILE  24  20.379   2.857 -10.584
  709   1HG2  ILE  24          3HG2      ILE  24  16.633   3.124 -11.467
  710   2HG2  ILE  24          1HG2      ILE  24  17.084   4.226 -10.167
  711   3HG2  ILE  24          2HG2      ILE  24  16.847   4.841 -11.801
  712   1HD1  ILE  24          3HD1      ILE  24  18.752   4.765  -9.294
  713   2HD1  ILE  24          1HD1      ILE  24  18.553   3.261  -8.391
  714   3HD1  ILE  24          2HD1      ILE  24  20.163   3.943  -8.626
  715    H    LYS  25           H        LYS  25  16.467   3.688 -13.502
  716    HA   LYS  25           HA       LYS  25  17.477   5.343 -15.781
  717   1HB   LYS  25          1HB       LYS  25  15.391   3.234 -15.689
  718   2HB   LYS  25          2HB       LYS  25  15.001   4.658 -16.622
  719   1HG   LYS  25          1HG       LYS  25  17.664   3.300 -16.962
  720   2HG   LYS  25          2HG       LYS  25  16.239   2.715 -17.824
  721   1HD   LYS  25          1HD       LYS  25  15.972   4.753 -18.997
  722   2HD   LYS  25          2HD       LYS  25  17.019   5.630 -17.882
  723   1HE   LYS  25          1HE       LYS  25  17.999   3.373 -19.648
  724   2HE   LYS  25          2HE       LYS  25  18.078   5.072 -20.117
  725   1HZ   LYS  25          1HZ       LYS  25  19.310   5.462 -18.003
  726   2HZ   LYS  25          2HZ       LYS  25  19.392   3.780 -17.794
  727   3HZ   LYS  25          3HZ       LYS  25  20.141   4.507 -19.133
  728    H    GLU  26           H        GLU  26  15.188   5.003 -13.139
  729    HA   GLU  26           HA       GLU  26  14.725   7.866 -13.071
  730   1HB   GLU  26          1HB       GLU  26  12.096   7.242 -13.168
  731   2HB   GLU  26          2HB       GLU  26  12.993   7.723 -14.588
  732   1HG   GLU  26          1HG       GLU  26  13.159   4.847 -14.025
  733   2HG   GLU  26          2HG       GLU  26  11.538   5.403 -14.340
  734    H    TYR  27           H        TYR  27  12.295   7.645 -11.452
  735    HA   TYR  27           HA       TYR  27  12.822   5.647  -9.420
  736   1HB   TYR  27          1HB       TYR  27  13.066   7.446  -7.617
  737   2HB   TYR  27          2HB       TYR  27  14.469   7.235  -8.669
  738    HD1  TYR  27           HD1      TYR  27  11.402   9.308  -8.119
  739    HD2  TYR  27           HD2      TYR  27  15.235   9.006 -10.085
  740    HE1  TYR  27           HE1      TYR  27  11.217  11.686  -8.849
  741    HE2  TYR  27           HE2      TYR  27  15.050  11.383 -10.811
  742    HH   TYR  27           HH       TYR  27  12.093  13.196 -10.453
  743    H    PHE  28           H        PHE  28  11.209   6.380  -7.410
  744    HA   PHE  28           HA       PHE  28   8.909   7.835  -8.411
  745   1HB   PHE  28          2HB       PHE  28   8.486   5.785  -9.601
  746   2HB   PHE  28          1HB       PHE  28   8.809   4.820  -8.164
  747    HD1  PHE  28           HD1      PHE  28   6.430   7.263  -9.687
  748    HD2  PHE  28           HD2      PHE  28   7.130   4.432  -6.504
  749    HE1  PHE  28           HE1      PHE  28   4.032   7.417  -9.019
  750    HE2  PHE  28           HE2      PHE  28   4.745   4.599  -5.825
  751    HZ   PHE  28           HZ       PHE  28   3.186   6.085  -7.087
  752    H    TYR  29           H        TYR  29   9.266   8.989  -6.393
  753    HA   TYR  29           HA       TYR  29   9.367   7.738  -3.833
  754   1HB   TYR  29          1HB       TYR  29   9.928  10.096  -4.113
  755   2HB   TYR  29          2HB       TYR  29   8.281  10.454  -4.624
  756    HD1  TYR  29           HD2      TYR  29  10.427   9.486  -1.759
  757    HD2  TYR  29           HD1      TYR  29   6.449  10.579  -3.033
  758    HE1  TYR  29           HE2      TYR  29   9.752   9.801   0.619
  759    HE2  TYR  29           HE1      TYR  29   5.774  10.896  -0.656
  760    HH   TYR  29           HH       TYR  29   7.277  11.494   1.621
  761    H    THR  30           H        THR  30   7.804   6.862  -2.600
  762    HA   THR  30           HA       THR  30   5.064   6.717  -3.732
  763    HB   THR  30           HB       THR  30   5.969   4.585  -3.085
  764    HG1  THR  30           HG1      THR  30   3.913   4.552  -2.475
  765   1HG2  THR  30          2HG2      THR  30   6.698   6.057  -0.554
  766   2HG2  THR  30          3HG2      THR  30   6.583   4.297  -0.584
  767   3HG2  THR  30          1HG2      THR  30   7.746   5.122  -1.621
  768    H    SER  31           H        SER  31   3.255   7.518  -2.639
  769    HA   SER  31           HA       SER  31   3.690   9.706  -0.809
  770   1HB   SER  31          1HB       SER  31   1.021   8.359  -1.104
  771   2HB   SER  31          2HB       SER  31   1.391  10.078  -0.962
  772    HG   SER  31           HG       SER  31   0.944   8.784  -3.153
  773    H    GLY  32           H        GLY  32   1.507   9.230   1.024
  774   1HA   GLY  32          1HA       GLY  32   2.887   7.327   2.852
  775   2HA   GLY  32          2HA       GLY  32   1.778   8.601   3.360
  776    H    LYS  33           H        LYS  33   0.948   6.652   0.603
  777    HA   LYS  33           HA       LYS  33  -1.554   5.837   1.708
  778   1HB   LYS  33          1HB       LYS  33  -0.013   4.493  -0.532
  779   2HB   LYS  33          2HB       LYS  33  -1.751   4.416  -0.255
  780   1HG   LYS  33          2HG       LYS  33  -1.343   7.122  -0.331
  781   2HG   LYS  33          1HG       LYS  33  -0.132   6.556  -1.482
  782   1HD   LYS  33          1HD       LYS  33  -1.860   6.543  -2.963
  783   2HD   LYS  33          2HD       LYS  33  -2.303   5.028  -2.176
  784   1HE   LYS  33          1HE       LYS  33  -4.293   6.264  -2.047
  785   2HE   LYS  33          2HE       LYS  33  -3.553   6.574  -0.475
  786   1HZ   LYS  33          3HZ       LYS  33  -2.822   8.362  -2.658
  787   2HZ   LYS  33          1HZ       LYS  33  -4.401   8.507  -2.053
  788   3HZ   LYS  33          2HZ       LYS  33  -3.073   8.701  -1.013
  789    H    CYS  34           H        CYS  34   1.135   3.663   0.809
  790    HA   CYS  34           HA       CYS  34   0.173   1.548   2.530
  791   1HB   CYS  34          2HB       CYS  34   2.992   1.802   1.462
  792   2HB   CYS  34          1HB       CYS  34   2.099   0.328   1.829
  793    H    SER  35           H        SER  35   1.682   0.601   4.268
  794    HA   SER  35           HA       SER  35   2.484   2.819   6.067
  795   1HB   SER  35          1HB       SER  35   1.065   0.591   6.613
  796   2HB   SER  35          2HB       SER  35   2.686  -0.016   6.949
  797    HG   SER  35           HG       SER  35   2.418   0.957   8.783
  798    H    ASN  36           H        ASN  36   4.158   2.340   3.820
  799    HA   ASN  36           HA       ASN  36   6.688   1.742   5.216
  800   1HB   ASN  36          1HB       ASN  36   5.467   0.001   3.151
  801   2HB   ASN  36          2HB       ASN  36   7.160   0.370   2.930
  802   1HD2  ASN  36          1HD2      ASN  36   7.934  -0.366   6.277
  803   2HD2  ASN  36          2HD2      ASN  36   8.709  -0.796   4.830
  804    HA   PRO  37           HA       PRO  37   6.689   5.355   2.294
  805   1HB   PRO  37          1HB       PRO  37   8.726   6.443   4.055
  806   2HB   PRO  37          2HB       PRO  37   7.109   7.078   3.729
  807   1HG   PRO  37          1HG       PRO  37   8.024   5.766   6.121
  808   2HG   PRO  37          2HG       PRO  37   6.392   6.349   5.771
  809   1HD   PRO  37          2HD       PRO  37   7.305   3.617   5.898
  810   2HD   PRO  37          1HD       PRO  37   5.670   4.200   5.535
  811    H    ALA  38           H        ALA  38   8.271   5.625   0.675
  812    HA   ALA  38           HA       ALA  38  11.039   4.894   1.051
  813   1HB   ALA  38          3HB       ALA  38   9.600   2.648   0.879
  814   2HB   ALA  38          1HB       ALA  38   9.673   3.000  -0.848
  815   3HB   ALA  38          2HB       ALA  38  11.162   2.781   0.072
  816    H    VAL  39           H        VAL  39  11.697   4.181  -1.503
  817    HA   VAL  39           HA       VAL  39  10.496   6.158  -3.330
  818    HB   VAL  39           HB       VAL  39  12.785   6.808  -1.911
  819   1HG1  VAL  39          1HG1      VAL  39  13.941   5.017  -3.411
  820   2HG1  VAL  39          2HG1      VAL  39  13.808   6.241  -4.674
  821   3HG1  VAL  39          3HG1      VAL  39  14.718   6.587  -3.205
  822   1HG2  VAL  39          3HG2      VAL  39  11.384   7.777  -4.304
  823   2HG2  VAL  39          1HG2      VAL  39  11.877   8.649  -2.852
  824   3HG2  VAL  39          2HG2      VAL  39  13.045   8.347  -4.139
  825    H    VAL  40           H        VAL  40  10.444   5.232  -5.347
  826    HA   VAL  40           HA       VAL  40  11.702   2.551  -5.428
  827    HB   VAL  40           HB       VAL  40   9.171   3.592  -6.674
  828   1HG1  VAL  40          1HG1      VAL  40  10.893   1.612  -7.771
  829   2HG1  VAL  40          2HG1      VAL  40   9.559   0.759  -7.009
  830   3HG1  VAL  40          3HG1      VAL  40   9.237   1.976  -8.239
  831   1HG2  VAL  40          1HG2      VAL  40   9.500   2.738  -4.226
  832   2HG2  VAL  40          2HG2      VAL  40   8.133   2.128  -5.163
  833   3HG2  VAL  40          3HG2      VAL  40   9.593   1.148  -4.986
  834    H    PHE  41           H        PHE  41  13.342   2.262  -6.703
  835    HA   PHE  41           HA       PHE  41  13.840   4.170  -8.842
  836   1HB   PHE  41          2HB       PHE  41  15.396   1.888  -7.649
  837   2HB   PHE  41          1HB       PHE  41  15.897   2.605  -9.179
  838    HD1  PHE  41           HD1      PHE  41  15.568   5.410  -8.998
  839    HD2  PHE  41           HD2      PHE  41  16.641   2.662  -5.846
  840    HE1  PHE  41           HE1      PHE  41  16.683   7.266  -7.760
  841    HE2  PHE  41           HE2      PHE  41  17.753   4.515  -4.612
  842    HZ   PHE  41           HZ       PHE  41  17.786   6.814  -5.569
  843    H    VAL  42           H        VAL  42  13.495   3.862 -10.887
  844    HA   VAL  42           HA       VAL  42  12.398   1.210 -11.721
  845    HB   VAL  42           HB       VAL  42  11.934   3.081 -13.764
  846   1HG1  VAL  42          3HG2      VAL  42  10.249   1.940 -11.539
  847   2HG1  VAL  42          1HG2      VAL  42   9.552   2.840 -12.887
  848   3HG1  VAL  42          2HG2      VAL  42  10.402   1.324 -13.188
  849   1HG2  VAL  42          2HG1      VAL  42  12.405   4.910 -12.178
  850   2HG2  VAL  42          3HG1      VAL  42  10.712   4.893 -12.650
  851   3HG2  VAL  42          1HG1      VAL  42  11.199   4.262 -11.075
  852    H    THR  43           H        THR  43  14.591   0.396 -11.965
  853    HA   THR  43           HA       THR  43  16.566   1.778 -13.589
  854    HB   THR  43           HB       THR  43  18.016  -0.030 -13.078
  855    HG1  THR  43           HG1      THR  43  17.213  -2.023 -12.404
  856   1HG2  THR  43          1HG2      THR  43  17.257   1.336 -11.110
  857   2HG2  THR  43          2HG2      THR  43  16.061   0.089 -10.765
  858   3HG2  THR  43          3HG2      THR  43  17.779  -0.291 -10.682
  859    H    ARG  44           H        ARG  44  17.766  -0.275 -14.995
  860    HA   ARG  44           HA       ARG  44  16.630  -0.064 -17.512
  861   1HB   ARG  44          2HB       ARG  44  17.867  -2.291 -18.001
  862   2HB   ARG  44          1HB       ARG  44  18.816  -0.917 -17.497
  863   1HG   ARG  44          1HG       ARG  44  18.021  -2.193 -15.109
  864   2HG   ARG  44          2HG       ARG  44  18.514  -3.480 -16.204
  865   1HD   ARG  44          1HD       ARG  44  20.555  -1.889 -16.690
  866   2HD   ARG  44          2HD       ARG  44  20.124  -1.185 -15.130
  867    HE   ARG  44           HE       ARG  44  20.198  -3.909 -14.628
  868   1HH1  ARG  44          1HH1      ARG  44  22.289  -2.747 -16.916
  869   2HH1  ARG  44          2HH1      ARG  44  23.736  -3.144 -16.051
  870   1HH2  ARG  44          2HH2      ARG  44  22.196  -3.333 -13.003
  871   2HH2  ARG  44          1HH2      ARG  44  23.532  -3.995 -13.885
  872    H    LYS  45           H        LYS  45  16.332  -3.038 -15.488
  873    HA   LYS  45           HA       LYS  45  14.253  -4.211 -17.061
  874   1HB   LYS  45          1HB       LYS  45  14.991  -4.444 -14.143
  875   2HB   LYS  45          2HB       LYS  45  13.607  -5.287 -14.792
  876   1HG   LYS  45          1HG       LYS  45  15.280  -6.104 -16.630
  877   2HG   LYS  45          2HG       LYS  45  16.514  -5.655 -15.451
  878   1HD   LYS  45          1HD       LYS  45  16.161  -7.814 -14.748
  879   2HD   LYS  45          2HD       LYS  45  14.869  -7.040 -13.833
  880   1HE   LYS  45          1HE       LYS  45  13.215  -7.881 -15.196
  881   2HE   LYS  45          2HE       LYS  45  14.243  -7.863 -16.629
  882   1HZ   LYS  45          1HZ       LYS  45  14.585  -9.751 -14.366
  883   2HZ   LYS  45          2HZ       LYS  45  13.728 -10.117 -15.787
  884   3HZ   LYS  45          3HZ       LYS  45  15.393  -9.785 -15.860
  885    H    ASN  46           H        ASN  46  14.373  -1.737 -14.642
  886    HA   ASN  46           HA       ASN  46  12.911  -0.082 -14.034
  887   1HB   ASN  46          2HB       ASN  46  12.029  -0.948 -16.681
  888   2HB   ASN  46          1HB       ASN  46  10.671  -0.432 -15.716
  889   1HD2  ASN  46          1HD2      ASN  46  12.363   2.121 -17.761
  890   2HD2  ASN  46          2HD2      ASN  46  10.757   1.737 -17.370
  891    H    ARG  47           H        ARG  47  12.463  -3.141 -13.315
  892    HA   ARG  47           HA       ARG  47   9.682  -3.279 -12.558
  893   1HB   ARG  47          1HB       ARG  47  12.061  -4.354 -10.995
  894   2HB   ARG  47          2HB       ARG  47  10.389  -4.899 -10.864
  895   1HG   ARG  47          1HG       ARG  47  11.699  -4.982 -13.555
  896   2HG   ARG  47          2HG       ARG  47  12.144  -6.213 -12.373
  897   1HD   ARG  47          1HD       ARG  47   9.338  -6.009 -12.224
  898   2HD   ARG  47          2HD       ARG  47   9.719  -5.988 -13.946
  899    HE   ARG  47           HE       ARG  47  11.156  -8.074 -12.511
  900   1HH1  ARG  47          2HH1      ARG  47   8.557  -7.601 -14.947
  901   2HH1  ARG  47          1HH1      ARG  47   9.319  -9.098 -15.369
  902   1HH2  ARG  47          1HH2      ARG  47   8.206  -9.382 -12.135
  903   2HH2  ARG  47          2HH2      ARG  47   9.414 -10.444 -12.776
  904    H    GLN  48           H        GLN  48   8.761  -2.375 -10.522
  905    HA   GLN  48           HA       GLN  48  10.178   0.052  -9.868
  906   1HB   GLN  48          1HB       GLN  48   7.505  -1.054  -9.250
  907   2HB   GLN  48          2HB       GLN  48   8.151   0.142  -8.124
  908   1HG   GLN  48          2HG       GLN  48   8.558   1.695  -9.958
  909   2HG   GLN  48          1HG       GLN  48   8.109   0.497 -11.133
  910   1HE2  GLN  48          1HE2      GLN  48   5.224   1.831  -8.560
  911   2HE2  GLN  48          2HE2      GLN  48   6.647   2.747  -8.686
  912    H    VAL  49           H        VAL  49  12.016  -0.607  -9.029
  913    HA   VAL  49           HA       VAL  49  12.246  -2.475  -6.844
  914    HB   VAL  49           HB       VAL  49  14.494  -0.642  -7.344
  915   1HG1  VAL  49          3HG1      VAL  49  14.090  -3.629  -7.238
  916   2HG1  VAL  49          1HG1      VAL  49  15.662  -2.867  -7.491
  917   3HG1  VAL  49          2HG1      VAL  49  14.786  -2.601  -5.982
  918   1HG2  VAL  49          3HG2      VAL  49  13.163  -2.098  -9.586
  919   2HG2  VAL  49          1HG2      VAL  49  14.206  -0.684  -9.659
  920   3HG2  VAL  49          2HG2      VAL  49  14.908  -2.286  -9.478
  921    H    CYS  50           H        CYS  50  13.519  -1.690  -4.822
  922    HA   CYS  50           HA       CYS  50  12.233   0.817  -3.848
  923   1HB   CYS  50          2HB       CYS  50  12.165  -1.743  -2.817
  924   2HB   CYS  50          1HB       CYS  50  13.487  -1.047  -1.931
  925    H    ALA  51           H        ALA  51  13.826   1.129  -1.590
  926    HA   ALA  51           HA       ALA  51  16.557   0.929  -1.628
  927   1HB   ALA  51          2HB       ALA  51  15.663   3.102  -3.514
  928   2HB   ALA  51          3HB       ALA  51  17.205   3.215  -2.673
  929   3HB   ALA  51          1HB       ALA  51  16.899   1.868  -3.760
  930    H    ASN  52           H        ASN  52  14.035   1.885  -0.064
  931    HA   ASN  52           HA       ASN  52  13.744   3.089   1.900
  932   1HB   ASN  52          1HB       ASN  52  16.092   2.192   2.288
  933   2HB   ASN  52          2HB       ASN  52  16.678   3.740   1.678
  934   1HD2  ASN  52          1HD2      ASN  52  15.204   3.024   5.296
  935   2HD2  ASN  52          2HD2      ASN  52  13.933   3.039   4.171
  936    HA   PRO  53           HA       PRO  53  13.310   7.147   0.183
  937   1HB   PRO  53          1HB       PRO  53  12.071   8.289   2.398
  938   2HB   PRO  53          2HB       PRO  53  11.244   7.345   1.174
  939   1HG   PRO  53          2HG       PRO  53  11.872   6.610   3.948
  940   2HG   PRO  53          1HG       PRO  53  10.755   5.846   2.839
  941   1HD   PRO  53          1HD       PRO  53  13.373   4.932   3.573
  942   2HD   PRO  53          2HD       PRO  53  12.266   4.193   2.424
  943    H    GLU  54           H        GLU  54  14.739   6.680   3.409
  944    HA   GLU  54           HA       GLU  54  16.121   9.315   3.084
  945   1HB   GLU  54          1HB       GLU  54  15.078   7.882   5.517
  946   2HB   GLU  54          2HB       GLU  54  16.331   9.114   5.660
  947   1HG   GLU  54          1HG       GLU  54  14.870  10.802   5.251
  948   2HG   GLU  54          2HG       GLU  54  14.090   9.919   3.939
  949    H    LYS  55           H        LYS  55  17.252   6.897   1.991
  950    HA   LYS  55           HA       LYS  55  19.386   6.124   3.888
  951   1HB   LYS  55          2HB       LYS  55  18.156   4.850   1.705
  952   2HB   LYS  55          1HB       LYS  55  19.795   5.153   1.200
  953   1HG   LYS  55          1HG       LYS  55  19.690   2.992   2.336
  954   2HG   LYS  55          2HG       LYS  55  20.613   4.129   3.319
  955   1HD   LYS  55          1HD       LYS  55  18.216   4.631   4.359
  956   2HD   LYS  55          2HD       LYS  55  17.883   2.998   3.783
  957   1HE   LYS  55          1HE       LYS  55  18.992   2.146   5.546
  958   2HE   LYS  55          2HE       LYS  55  20.454   2.992   5.038
  959   1HZ   LYS  55          3HZ       LYS  55  18.364   4.532   6.393
  960   2HZ   LYS  55          1HZ       LYS  55  19.323   3.492   7.333
  961   3HZ   LYS  55          2HZ       LYS  55  20.051   4.730   6.426
  962    H    LYS  56           H        LYS  56  19.140   8.905   2.658
  963    HA   LYS  56           HA       LYS  56  20.612  10.543   1.890
  964   1HB   LYS  56          1HB       LYS  56  22.632   8.368   2.500
  965   2HB   LYS  56          2HB       LYS  56  23.059  10.021   2.064
  966   1HG   LYS  56          1HG       LYS  56  21.998  10.904   4.019
  967   2HG   LYS  56          2HG       LYS  56  21.211   9.364   4.370
  968   1HD   LYS  56          1HD       LYS  56  23.067   8.511   5.368
  969   2HD   LYS  56          2HD       LYS  56  24.146   9.196   4.153
  970   1HE   LYS  56          1HE       LYS  56  24.765  10.590   5.851
  971   2HE   LYS  56          2HE       LYS  56  23.296  11.461   5.413
  972   1HZ   LYS  56          3HZ       LYS  56  22.098  10.048   7.032
  973   2HZ   LYS  56          1HZ       LYS  56  23.587   9.397   7.523
  974   3HZ   LYS  56          2HZ       LYS  56  23.268  11.050   7.746
  975    H    TRP  57           H        TRP  57  22.649   7.953   0.616
  976    HA   TRP  57           HA       TRP  57  23.032   8.946  -1.922
  977   1HB   TRP  57          1HB       TRP  57  23.583   6.695  -2.633
  978   2HB   TRP  57          2HB       TRP  57  24.150   6.931  -0.976
  979    HD1  TRP  57           HD1      TRP  57  23.252   5.223   0.759
  980    HE1  TRP  57           HE1      TRP  57  21.569   3.270   0.621
  981    HE3  TRP  57           HE3      TRP  57  21.367   6.113  -3.846
  982    HZ2  TRP  57           HZ2      TRP  57  19.649   2.211  -1.273
  983    HZ3  TRP  57           HZ3      TRP  57  19.715   4.614  -4.865
  984    HH2  TRP  57           HH2      TRP  57  18.848   2.656  -3.593
  985    H    VAL  58           H        VAL  58  20.100   7.396  -0.802
  986    HA   VAL  58           HA       VAL  58  18.984   6.849  -3.393
  987    HB   VAL  58           HB       VAL  58  16.731   7.320  -2.058
  988   1HG1  VAL  58          3HG1      VAL  58  18.031   5.140  -2.818
  989   2HG1  VAL  58          1HG1      VAL  58  18.226   4.955  -1.076
  990   3HG1  VAL  58          2HG1      VAL  58  16.612   5.065  -1.784
  991   1HG2  VAL  58          2HG2      VAL  58  18.460   8.148  -0.166
  992   2HG2  VAL  58          3HG2      VAL  58  16.855   7.503   0.173
  993   3HG2  VAL  58          1HG2      VAL  58  18.267   6.454   0.278
  994    H    ARG  59           H        ARG  59  18.470   9.681  -1.240
  995    HA   ARG  59           HA       ARG  59  16.901  11.120  -3.161
  996   1HB   ARG  59          1HB       ARG  59  18.557  12.080  -0.814
  997   2HB   ARG  59          2HB       ARG  59  17.501  13.117  -1.743
  998   1HG   ARG  59          1HG       ARG  59  15.775  11.123  -1.215
  999   2HG   ARG  59          2HG       ARG  59  16.810  10.967   0.184
 1000   1HD   ARG  59          1HD       ARG  59  16.291  13.096   0.982
 1001   2HD   ARG  59          2HD       ARG  59  15.834  13.687  -0.616
 1002    HE   ARG  59           HE       ARG  59  13.805  12.110  -0.353
 1003   1HH1  ARG  59          2HH2      ARG  59  15.101  13.790   2.708
 1004   2HH1  ARG  59          1HH2      ARG  59  13.693  14.649   2.181
 1005   1HH2  ARG  59          1HH1      ARG  59  12.581  11.225   1.475
 1006   2HH2  ARG  59          2HH1      ARG  59  12.650  12.097   2.971
 1007    H    GLU  60           H        GLU  60  20.363  11.022  -2.437
 1008    HA   GLU  60           HA       GLU  60  21.106  13.116  -4.288
 1009   1HB   GLU  60          1HB       GLU  60  22.581  10.881  -2.911
 1010   2HB   GLU  60          2HB       GLU  60  23.379  11.821  -4.171
 1011   1HG   GLU  60          2HG       GLU  60  22.390  13.856  -2.763
 1012   2HG   GLU  60          1HG       GLU  60  22.448  12.684  -1.468
 1013    H    TYR  61           H        TYR  61  20.008   9.921  -4.686
 1014    HA   TYR  61           HA       TYR  61  21.245   9.598  -7.352
 1015   1HB   TYR  61          2HB       TYR  61  19.772   7.822  -5.430
 1016   2HB   TYR  61          1HB       TYR  61  19.831   7.375  -7.106
 1017    HD1  TYR  61           HD1      TYR  61  22.571   9.275  -5.486
 1018    HD2  TYR  61           HD2      TYR  61  21.210   5.372  -6.740
 1019    HE1  TYR  61           HE1      TYR  61  24.833   8.341  -5.032
 1020    HE2  TYR  61           HE2      TYR  61  23.477   4.441  -6.275
 1021    HH   TYR  61           HH       TYR  61  25.828   5.302  -6.149
 1022    H    ILE  62           H        ILE  62  18.268  10.461  -5.775
 1023    HA   ILE  62           HA       ILE  62  16.446   9.954  -7.927
 1024    HB   ILE  62           HB       ILE  62  16.427  11.922  -5.621
 1025   1HG1  ILE  62          2HG1      ILE  62  16.233   9.470  -5.146
 1026   2HG1  ILE  62          1HG1      ILE  62  14.831  10.381  -4.653
 1027   1HG2  ILE  62          1HG2      ILE  62  14.522  11.589  -7.895
 1028   2HG2  ILE  62          2HG2      ILE  62  13.849  11.862  -6.288
 1029   3HG2  ILE  62          3HG2      ILE  62  14.953  13.042  -6.995
 1030   1HD1  ILE  62          2HD1      ILE  62  13.698   9.743  -6.773
 1031   2HD1  ILE  62          3HD1      ILE  62  15.103   8.769  -7.204
 1032   3HD1  ILE  62          1HD1      ILE  62  14.128   8.337  -5.800
 1033    H    ASN  63           H        ASN  63  18.307  12.869  -7.018
 1034    HA   ASN  63           HA       ASN  63  17.387  14.363  -9.340
 1035   1HB   ASN  63          1HB       ASN  63  19.210  14.818  -7.062
 1036   2HB   ASN  63          2HB       ASN  63  19.645  15.664  -8.527
 1037   1HD2  ASN  63          2HD2      ASN  63  17.921  18.179  -7.980
 1038   2HD2  ASN  63          1HD2      ASN  63  18.432  17.587  -6.474
 1039    H    SER  64           H        SER  64  20.284  12.489  -8.516
 1040    HA   SER  64           HA       SER  64  21.906  13.171 -10.724
 1041   1HB   SER  64          2HB       SER  64  22.581  11.718  -8.780
 1042   2HB   SER  64          1HB       SER  64  21.653  10.406  -9.506
 1043    HG   SER  64           HG       SER  64  24.066  11.521 -10.268
 1044    H    LEU  65           H        LEU  65  19.150  10.976 -10.518
 1045    HA   LEU  65           HA       LEU  65  19.527   9.727 -13.080
 1046   1HB   LEU  65          2HB       LEU  65  17.133  10.117 -11.290
 1047   2HB   LEU  65          1HB       LEU  65  16.982   9.343 -12.850
 1048    HG   LEU  65           HG       LEU  65  18.924   8.464 -10.700
 1049   1HD1  LEU  65          2HD1      LEU  65  16.107   7.661 -11.354
 1050   2HD1  LEU  65          3HD1      LEU  65  17.233   6.441 -10.761
 1051   3HD1  LEU  65          1HD1      LEU  65  16.872   7.857  -9.777
 1052   1HD2  LEU  65          2HD2      LEU  65  18.506   7.789 -13.511
 1053   2HD2  LEU  65          3HD2      LEU  65  19.852   7.373 -12.450
 1054   3HD2  LEU  65          1HD2      LEU  65  18.399   6.374 -12.464
 1055    H    GLU  66           H        GLU  66  17.336  10.110 -14.612
 1056    HA   GLU  66           HA       GLU  66  17.304  13.051 -15.166
 1057   1HB   GLU  66          1HB       GLU  66  17.500  10.751 -17.132
 1058   2HB   GLU  66          2HB       GLU  66  17.165  12.417 -17.603
 1059   1HG   GLU  66          1HG       GLU  66  19.354  12.769 -16.012
 1060   2HG   GLU  66          2HG       GLU  66  19.699  11.184 -16.703
 1061    H    MET  67           H        MET  67  15.308  13.875 -15.948
 1062    HA   MET  67           HA       MET  67  13.004  12.003 -15.591
 1063   1HB   MET  67          1HB       MET  67  13.295  14.103 -14.091
 1064   2HB   MET  67          2HB       MET  67  12.810  15.012 -15.523
 1065   1HG   MET  67          1HG       MET  67  10.888  13.117 -15.536
 1066   2HG   MET  67          2HG       MET  67  11.211  13.184 -13.803
 1067   1HE   MET  67          2HE       MET  67  11.640  15.098 -12.617
 1068   2HE   MET  67          1HE       MET  67  11.800  16.683 -13.372
 1069   3HE   MET  67          3HE       MET  67  10.349  16.287 -12.451
 1070    H    SER  68           H        SER  68  14.093  11.749 -18.030
 1071    HA   SER  68           HA       SER  68  11.997  12.582 -19.808
 1072   1HB   SER  68          1HB       SER  68  14.195  14.435 -19.443
 1073   2HB   SER  68          2HB       SER  68  14.148  13.852 -21.106
 1074    HG   SER  68           HG       SER  68  12.009  14.491 -21.241
   
  No H/Q in entry =        1074
  Start of MODEL   13
    1    H    SER   1           H        SER   1  18.765 -16.860   1.816
    2    HA   SER   1           HA       SER   1  20.417 -15.685  -0.280
    3   1HB   SER   1          1HB       SER   1  17.641 -16.784  -0.091
    4   2HB   SER   1          2HB       SER   1  18.022 -15.714  -1.440
    5    HG   SER   1           HG       SER   1  18.851 -18.277  -0.930
    6    HA   PRO   2           HA       PRO   2  19.419 -11.442   0.103
    7   1HB   PRO   2          1HB       PRO   2  18.616 -11.022  -2.636
    8   2HB   PRO   2          2HB       PRO   2  20.172 -10.636  -1.891
    9   1HG   PRO   2          1HG       PRO   2  19.585 -12.758  -3.757
   10   2HG   PRO   2          2HG       PRO   2  21.140 -12.370  -3.014
   11   1HD   PRO   2          1HD       PRO   2  19.410 -14.605  -2.436
   12   2HD   PRO   2          2HD       PRO   2  20.972 -14.216  -1.690
   13    H    TYR   3           H        TYR   3  17.539  -9.818  -0.861
   14    HA   TYR   3           HA       TYR   3  14.953 -11.300  -0.611
   15   1HB   TYR   3          1HB       TYR   3  15.658  -8.612   0.608
   16   2HB   TYR   3          2HB       TYR   3  14.076  -9.387   0.688
   17    HD1  TYR   3           HD2      TYR   3  14.198 -11.972   1.503
   18    HD2  TYR   3           HD1      TYR   3  17.078  -8.895   2.443
   19    HE1  TYR   3           HE2      TYR   3  14.934 -13.272   3.499
   20    HE2  TYR   3           HE1      TYR   3  17.813 -10.195   4.440
   21    HH   TYR   3           HH       TYR   3  17.768 -12.380   5.336
   22    H    SER   4           H        SER   4  13.147 -10.261  -1.712
   23    HA   SER   4           HA       SER   4  14.040  -8.798  -4.119
   24   1HB   SER   4          1HB       SER   4  12.144 -10.753  -3.724
   25   2HB   SER   4          2HB       SER   4  11.156  -9.293  -3.781
   26    HG   SER   4           HG       SER   4  12.225  -8.765  -5.745
   27    H    SER   5           H        SER   5  14.260  -6.625  -3.781
   28    HA   SER   5           HA       SER   5  12.163  -5.245  -2.162
   29   1HB   SER   5          1HB       SER   5  14.860  -4.159  -3.016
   30   2HB   SER   5          2HB       SER   5  13.764  -3.473  -1.818
   31    HG   SER   5           HG       SER   5  15.214  -5.897  -1.677
   32    H    ASP   6           H        ASP   6  10.580  -4.483  -3.497
   33    HA   ASP   6           HA       ASP   6  11.232  -2.580  -5.590
   34   1HB   ASP   6          1HB       ASP   6  10.388  -3.847  -7.489
   35   2HB   ASP   6          2HB       ASP   6  11.687  -4.765  -6.736
   36    H    THR   7           H        THR   7   8.675  -3.135  -7.018
   37    HA   THR   7           HA       THR   7   7.006  -1.646  -5.187
   38    HB   THR   7           HB       THR   7   6.966  -1.261  -7.642
   39    HG1  THR   7           HG1      THR   7   5.136  -0.680  -6.537
   40   1HG2  THR   7          1HG2      THR   7   7.176  -3.830  -8.054
   41   2HG2  THR   7          2HG2      THR   7   5.418  -3.830  -7.914
   42   3HG2  THR   7          3HG2      THR   7   6.202  -2.872  -9.170
   43    H    THR   8           H        THR   8   4.581  -2.461  -5.037
   44    HA   THR   8           HA       THR   8   4.318  -5.373  -4.807
   45    HB   THR   8           HB       THR   8   3.598  -4.114  -2.258
   46    HG1  THR   8           HG1      THR   8   5.557  -3.534  -1.631
   47   1HG2  THR   8          2HG2      THR   8   5.122  -6.540  -3.207
   48   2HG2  THR   8          3HG2      THR   8   5.051  -6.112  -1.496
   49   3HG2  THR   8          1HG2      THR   8   3.568  -6.477  -2.377
   50    HA   PRO   9           HA       PRO   9   0.413  -3.492  -6.114
   51   1HB   PRO   9          1HB       PRO   9  -0.544  -6.212  -6.438
   52   2HB   PRO   9          2HB       PRO   9  -0.187  -5.023  -7.696
   53   1HG   PRO   9          2HG       PRO   9   1.358  -7.354  -6.995
   54   2HG   PRO   9          1HG       PRO   9   1.740  -6.142  -8.219
   55   1HD   PRO   9          2HD       PRO   9   3.028  -6.547  -5.705
   56   2HD   PRO   9          1HD       PRO   9   3.386  -5.326  -6.915
   57    H    CYS  10           H        CYS  10  -0.040  -2.834  -3.900
   58    HA   CYS  10           HA       CYS  10  -1.764  -4.793  -2.460
   59   1HB   CYS  10          1HB       CYS  10   0.469  -3.106  -1.340
   60   2HB   CYS  10          2HB       CYS  10  -0.813  -3.715  -0.324
   61    H    CYS  11           H        CYS  11  -3.406  -3.851  -1.176
   62    HA   CYS  11           HA       CYS  11  -4.175  -1.176  -2.160
   63   1HB   CYS  11          1HB       CYS  11  -6.112  -2.290  -2.435
   64   2HB   CYS  11          2HB       CYS  11  -5.591  -3.619  -1.447
   65    H    PHE  12           H        PHE  12  -4.553   0.561  -0.690
   66    HA   PHE  12           HA       PHE  12  -3.308   0.156   1.976
   67   1HB   PHE  12          1HB       PHE  12  -3.064   2.561   2.062
   68   2HB   PHE  12          2HB       PHE  12  -2.505   2.020   0.501
   69    HD1  PHE  12           HD2      PHE  12  -3.807   2.457  -1.554
   70    HD2  PHE  12           HD1      PHE  12  -5.147   3.838   2.311
   71    HE1  PHE  12           HE2      PHE  12  -5.428   3.989  -2.665
   72    HE2  PHE  12           HE1      PHE  12  -6.770   5.370   1.201
   73    HZ   PHE  12           HZ       PHE  12  -6.912   5.444  -1.286
   74    H    ALA  13           H        ALA  13  -6.266   1.538   0.527
   75    HA   ALA  13           HA       ALA  13  -7.611   1.062   3.151
   76   1HB   ALA  13          2HB       ALA  13  -7.178   3.502   2.762
   77   2HB   ALA  13          3HB       ALA  13  -8.144   3.395   1.291
   78   3HB   ALA  13          1HB       ALA  13  -8.895   3.109   2.861
   79    H    TYR  14           H        TYR  14  -9.638   0.145   3.023
   80    HA   TYR  14           HA       TYR  14 -10.480  -0.544   0.268
   81   1HB   TYR  14          1HB       TYR  14 -11.870  -2.337   1.747
   82   2HB   TYR  14          2HB       TYR  14 -10.271  -2.658   1.091
   83    HD1  TYR  14           HD1      TYR  14  -8.212  -2.081   2.557
   84    HD2  TYR  14           HD2      TYR  14 -12.248  -2.359   4.064
   85    HE1  TYR  14           HE1      TYR  14  -7.332  -2.232   4.876
   86    HE2  TYR  14           HE2      TYR  14 -11.364  -2.521   6.392
   87    HH   TYR  14           HH       TYR  14  -7.907  -2.842   7.032
   88    H    ILE  15           H        ILE  15 -12.583  -0.152  -0.380
   89    HA   ILE  15           HA       ILE  15 -14.080   1.833   1.099
   90    HB   ILE  15           HB       ILE  15 -14.142   1.767  -1.353
   91   1HG1  ILE  15          2HG1      ILE  15 -16.873   0.937  -0.353
   92   2HG1  ILE  15          1HG1      ILE  15 -16.171   2.510   0.023
   93   1HG2  ILE  15          1HG2      ILE  15 -15.118  -1.025  -0.819
   94   2HG2  ILE  15          2HG2      ILE  15 -15.610  -0.197  -2.297
   95   3HG2  ILE  15          3HG2      ILE  15 -13.900  -0.475  -1.969
   96   1HD1  ILE  15          1HD1      ILE  15 -15.824   2.799  -2.494
   97   2HD1  ILE  15          2HD1      ILE  15 -16.860   1.386  -2.701
   98   3HD1  ILE  15          3HD1      ILE  15 -17.498   2.842  -1.938
   99    H    ALA  16           H        ALA  16 -16.406   1.471   1.723
  100    HA   ALA  16           HA       ALA  16 -16.716  -1.238   2.939
  101   1HB   ALA  16          3HB       ALA  16 -16.789   1.213   4.170
  102   2HB   ALA  16          1HB       ALA  16 -18.500   0.927   3.854
  103   3HB   ALA  16          2HB       ALA  16 -17.571  -0.239   4.797
  104    H    ARG  17           H        ARG  17 -17.766  -2.286   1.206
  105    HA   ARG  17           HA       ARG  17 -20.552  -2.107   0.979
  106   1HB   ARG  17          1HB       ARG  17 -19.213  -0.024  -0.485
  107   2HB   ARG  17          2HB       ARG  17 -20.014  -1.099  -1.607
  108   1HG   ARG  17          1HG       ARG  17 -21.955  -0.879   0.263
  109   2HG   ARG  17          2HG       ARG  17 -21.178   0.693   0.451
  110   1HD   ARG  17          1HD       ARG  17 -21.308   0.822  -2.141
  111   2HD   ARG  17          2HD       ARG  17 -22.492  -0.477  -1.997
  112    HE   ARG  17           HE       ARG  17 -23.371   1.436  -0.191
  113   1HH1  ARG  17          1HH1      ARG  17 -22.831   3.890  -1.560
  114   2HH1  ARG  17          2HH1      ARG  17 -22.943   3.557  -3.255
  115   1HH2  ARG  17          2HH2      ARG  17 -25.551   1.667  -2.245
  116   2HH2  ARG  17          1HH2      ARG  17 -24.577   1.426  -3.656
  117    HA   PRO  18           HA       PRO  18 -18.905  -5.897  -0.834
  118   1HB   PRO  18          2HB       PRO  18 -21.578  -6.872  -1.181
  119   2HB   PRO  18          1HB       PRO  18 -20.406  -7.355   0.041
  120   1HG   PRO  18          1HG       PRO  18 -22.759  -5.700   0.389
  121   2HG   PRO  18          2HG       PRO  18 -21.664  -6.291   1.618
  122   1HD   PRO  18          2HD       PRO  18 -21.897  -3.620   0.663
  123   2HD   PRO  18          1HD       PRO  18 -20.697  -4.235   1.789
  124    H    LEU  19           H        LEU  19 -18.202  -5.168  -2.835
  125    HA   LEU  19           HA       LEU  19 -19.666  -3.931  -4.871
  126   1HB   LEU  19          2HB       LEU  19 -17.469  -5.977  -5.232
  127   2HB   LEU  19          1HB       LEU  19 -17.961  -4.794  -6.416
  128    HG   LEU  19           HG       LEU  19 -16.756  -4.221  -3.700
  129   1HD1  LEU  19          1HD1      LEU  19 -15.217  -5.034  -5.525
  130   2HD1  LEU  19          2HD1      LEU  19 -15.696  -3.628  -6.475
  131   3HD1  LEU  19          3HD1      LEU  19 -14.849  -3.411  -4.943
  132   1HD2  LEU  19          2HD2      LEU  19 -18.242  -2.555  -5.641
  133   2HD2  LEU  19          3HD2      LEU  19 -17.976  -2.305  -3.915
  134   3HD2  LEU  19          1HD2      LEU  19 -16.721  -1.864  -5.074
  135    HA   PRO  20           HA       PRO  20 -22.588  -7.207  -5.819
  136   1HB   PRO  20          1HB       PRO  20 -23.150  -5.897  -8.351
  137   2HB   PRO  20          2HB       PRO  20 -24.185  -6.015  -6.923
  138   1HG   PRO  20          1HG       PRO  20 -22.806  -3.691  -7.869
  139   2HG   PRO  20          2HG       PRO  20 -23.732  -3.845  -6.373
  140   1HD   PRO  20          1HD       PRO  20 -20.856  -3.659  -6.691
  141   2HD   PRO  20          2HD       PRO  20 -21.792  -3.728  -5.185
  142    H    ARG  21           H        ARG  21 -22.522  -9.031  -7.214
  143    HA   ARG  21           HA       ARG  21 -20.000  -9.568  -8.495
  144   1HB   ARG  21          2HB       ARG  21 -21.654 -11.259  -7.489
  145   2HB   ARG  21          1HB       ARG  21 -22.565 -11.093  -8.989
  146   1HG   ARG  21          1HG       ARG  21 -19.624 -11.632  -9.146
  147   2HG   ARG  21          2HG       ARG  21 -20.694 -12.954  -8.750
  148   1HD   ARG  21          1HD       ARG  21 -22.019 -11.797 -10.849
  149   2HD   ARG  21          2HD       ARG  21 -20.353 -11.530 -11.300
  150    HE   ARG  21           HE       ARG  21 -20.487 -14.214 -10.518
  151   1HH1  ARG  21          1HH1      ARG  21 -20.625 -12.310 -13.247
  152   2HH1  ARG  21          2HH1      ARG  21 -21.188 -13.591 -14.267
  153   1HH2  ARG  21          1HH2      ARG  21 -21.778 -15.846 -11.945
  154   2HH2  ARG  21          2HH2      ARG  21 -22.868 -14.994 -12.987
  155    H    ALA  22           H        ALA  22 -22.995  -8.195  -9.634
  156    HA   ALA  22           HA       ALA  22 -22.400  -8.711 -12.442
  157   1HB   ALA  22          2HB       ALA  22 -24.467  -7.049 -11.002
  158   2HB   ALA  22          3HB       ALA  22 -24.287  -6.968 -12.755
  159   3HB   ALA  22          1HB       ALA  22 -24.713  -8.495 -11.982
  160    H    HIS  23           H        HIS  23 -21.279  -6.448 -10.160
  161    HA   HIS  23           HA       HIS  23 -20.623  -4.486 -12.304
  162   1HB   HIS  23          2HB       HIS  23 -20.247  -4.252  -9.303
  163   2HB   HIS  23          1HB       HIS  23 -20.020  -2.969 -10.487
  164    HD2  HIS  23           HD2      HIS  23 -23.200  -5.366 -10.299
  165    HE1  HIS  23           HE1      HIS  23 -24.441  -1.354  -9.814
  166    HE2  HIS  23           HE2      HIS  23 -25.237  -3.760 -10.041
  167    H    ILE  24           H        ILE  24 -19.220  -6.930 -10.238
  168    HA   ILE  24           HA       ILE  24 -16.494  -5.932 -10.775
  169    HB   ILE  24           HB       ILE  24 -17.244  -8.510  -9.420
  170   1HG1  ILE  24          1HG1      ILE  24 -16.644  -5.833  -8.156
  171   2HG1  ILE  24          2HG1      ILE  24 -18.213  -6.581  -8.213
  172   1HG2  ILE  24          3HG2      ILE  24 -14.730  -6.898  -9.734
  173   2HG2  ILE  24          1HG2      ILE  24 -14.923  -7.999  -8.370
  174   3HG2  ILE  24          2HG2      ILE  24 -14.980  -8.621 -10.020
  175   1HD1  ILE  24          1HD1      ILE  24 -16.375  -8.504  -7.195
  176   2HD1  ILE  24          2HD1      ILE  24 -16.152  -6.998  -6.302
  177   3HD1  ILE  24          3HD1      ILE  24 -17.742  -7.759  -6.367
  178    H    LYS  25           H        LYS  25 -14.881  -7.357 -11.793
  179    HA   LYS  25           HA       LYS  25 -16.138  -9.219 -13.777
  180   1HB   LYS  25          1HB       LYS  25 -13.806  -7.317 -14.060
  181   2HB   LYS  25          2HB       LYS  25 -14.074  -8.647 -15.187
  182   1HG   LYS  25          1HG       LYS  25 -16.430  -6.934 -14.586
  183   2HG   LYS  25          2HG       LYS  25 -15.148  -6.192 -15.544
  184   1HD   LYS  25          1HD       LYS  25 -15.249  -8.444 -16.901
  185   2HD   LYS  25          2HD       LYS  25 -16.857  -8.579 -16.191
  186   1HE   LYS  25          1HE       LYS  25 -17.261  -7.419 -18.198
  187   2HE   LYS  25          2HE       LYS  25 -17.169  -6.124 -17.005
  188   1HZ   LYS  25          3HZ       LYS  25 -14.792  -7.037 -18.510
  189   2HZ   LYS  25          1HZ       LYS  25 -15.832  -5.839 -19.119
  190   3HZ   LYS  25          2HZ       LYS  25 -15.007  -5.584 -17.657
  191    H    GLU  26           H        GLU  26 -13.594  -8.703 -11.435
  192    HA   GLU  26           HA       GLU  26 -13.083 -11.543 -11.203
  193   1HB   GLU  26          1HB       GLU  26 -10.498 -10.987 -11.662
  194   2HB   GLU  26          2HB       GLU  26 -11.563 -11.501 -12.952
  195   1HG   GLU  26          1HG       GLU  26 -11.602  -8.603 -12.493
  196   2HG   GLU  26          2HG       GLU  26 -10.043  -9.211 -12.983
  197    H    TYR  27           H        TYR  27 -10.511 -11.219  -9.866
  198    HA   TYR  27           HA       TYR  27 -10.727  -9.004  -8.046
  199   1HB   TYR  27          2HB       TYR  27 -11.476 -10.078  -6.097
  200   2HB   TYR  27          1HB       TYR  27 -12.482 -10.816  -7.333
  201    HD1  TYR  27           HD1      TYR  27 -11.770 -13.050  -8.359
  202    HD2  TYR  27           HD2      TYR  27  -9.987 -11.431  -4.774
  203    HE1  TYR  27           HE1      TYR  27 -10.860 -15.301  -7.795
  204    HE2  TYR  27           HE2      TYR  27  -9.082 -13.685  -4.208
  205    HH   TYR  27           HH       TYR  27 -10.019 -16.550  -5.988
  206    H    PHE  28           H        PHE  28  -9.008  -9.677  -6.054
  207    HA   PHE  28           HA       PHE  28  -6.910 -11.400  -7.058
  208   1HB   PHE  28          2HB       PHE  28  -6.507  -9.556  -8.562
  209   2HB   PHE  28          1HB       PHE  28  -6.584  -8.394  -7.239
  210    HD1  PHE  28           HD1      PHE  28  -4.602 -11.239  -8.638
  211    HD2  PHE  28           HD2      PHE  28  -4.674  -7.909  -5.892
  212    HE1  PHE  28           HE1      PHE  28  -2.148 -11.484  -8.277
  213    HE2  PHE  28           HE2      PHE  28  -2.224  -8.160  -5.520
  214    HZ   PHE  28           HZ       PHE  28  -0.957  -9.942  -6.720
  215    H    TYR  29           H        TYR  29  -6.695 -12.308  -4.990
  216    HA   TYR  29           HA       TYR  29  -6.747 -10.868  -2.537
  217   1HB   TYR  29          2HB       TYR  29  -6.923 -13.307  -2.615
  218   2HB   TYR  29          1HB       TYR  29  -5.291 -13.427  -3.217
  219    HD1  TYR  29           HD2      TYR  29  -7.270 -12.093  -0.327
  220    HD2  TYR  29           HD1      TYR  29  -3.473 -13.603  -1.721
  221    HE1  TYR  29           HE2      TYR  29  -6.409 -12.083   2.009
  222    HE2  TYR  29           HE1      TYR  29  -2.612 -13.594   0.618
  223    HH   TYR  29           HH       TYR  29  -4.399 -12.113   3.236
  224    H    THR  30           H        THR  30  -5.289  -9.581  -1.615
  225    HA   THR  30           HA       THR  30  -2.842  -8.870  -3.018
  226    HB   THR  30           HB       THR  30  -3.721  -8.099  -0.219
  227    HG1  THR  30           HG1      THR  30  -4.060  -6.660  -2.630
  228   1HG2  THR  30          3HG2      THR  30  -1.720  -6.951  -2.183
  229   2HG2  THR  30          1HG2      THR  30  -2.285  -6.083  -0.755
  230   3HG2  THR  30          2HG2      THR  30  -1.391  -7.593  -0.573
  231    H    SER  31           H        SER  31  -0.705  -9.348  -2.395
  232    HA   SER  31           HA       SER  31  -0.250 -11.868  -1.124
  233   1HB   SER  31          1HB       SER  31   1.527  -9.570  -1.917
  234   2HB   SER  31          2HB       SER  31   2.184 -10.928  -1.003
  235    HG   SER  31           HG       SER  31   2.148 -10.989  -3.438
  236    H    GLY  32           H        GLY  32   1.422 -11.932   0.820
  237   1HA   GLY  32          2HA       GLY  32   0.350 -10.113   2.933
  238   2HA   GLY  32          1HA       GLY  32   0.806 -11.771   3.236
  239    H    LYS  33           H        LYS  33   2.353  -8.927   1.701
  240    HA   LYS  33           HA       LYS  33   4.573  -9.125   3.637
  241   1HB   LYS  33          2HB       LYS  33   6.250  -9.149   1.747
  242   2HB   LYS  33          1HB       LYS  33   5.368 -10.644   1.944
  243   1HG   LYS  33          1HG       LYS  33   4.540 -10.476  -0.141
  244   2HG   LYS  33          2HG       LYS  33   3.890  -8.894   0.209
  245   1HD   LYS  33          1HD       LYS  33   5.746  -7.797  -0.635
  246   2HD   LYS  33          2HD       LYS  33   6.824  -9.123  -0.271
  247   1HE   LYS  33          1HE       LYS  33   5.340 -10.393  -2.066
  248   2HE   LYS  33          2HE       LYS  33   5.010  -8.752  -2.619
  249   1HZ   LYS  33          3HZ       LYS  33   7.788  -9.365  -2.048
  250   2HZ   LYS  33          1HZ       LYS  33   7.123 -10.164  -3.390
  251   3HZ   LYS  33          2HZ       LYS  33   7.111  -8.467  -3.320
  252    H    CYS  34           H        CYS  34   2.445  -7.170   2.818
  253    HA   CYS  34           HA       CYS  34   4.285  -4.872   2.381
  254   1HB   CYS  34          1HB       CYS  34   2.601  -3.862   0.828
  255   2HB   CYS  34          2HB       CYS  34   3.327  -5.336   0.188
  256    H    SER  35           H        SER  35   2.593  -6.113   4.639
  257    HA   SER  35           HA       SER  35   1.255  -5.326   6.399
  258   1HB   SER  35          1HB       SER  35   2.843  -3.016   5.435
  259   2HB   SER  35          2HB       SER  35   1.439  -2.613   6.423
  260    HG   SER  35           HG       SER  35   2.673  -3.126   8.028
  261    H    ASN  36           H        ASN  36   0.091  -5.536   3.631
  262    HA   ASN  36           HA       ASN  36  -2.317  -3.871   4.180
  263   1HB   ASN  36          2HB       ASN  36  -0.618  -3.833   1.714
  264   2HB   ASN  36          1HB       ASN  36  -2.343  -3.619   1.549
  265   1HD2  ASN  36          1HD2      ASN  36  -0.793  -0.330   1.896
  266   2HD2  ASN  36          2HD2      ASN  36   0.277  -1.624   1.650
  267    HA   PRO  37           HA       PRO  37  -2.942  -8.401   2.870
  268   1HB   PRO  37          1HB       PRO  37  -4.456  -8.805   5.285
  269   2HB   PRO  37          2HB       PRO  37  -2.925  -9.565   4.835
  270   1HG   PRO  37          1HG       PRO  37  -3.383  -7.504   6.824
  271   2HG   PRO  37          2HG       PRO  37  -1.867  -8.322   6.431
  272   1HD   PRO  37          2HD       PRO  37  -2.598  -5.616   5.815
  273   2HD   PRO  37          1HD       PRO  37  -1.117  -6.472   5.345
  274    H    ALA  38           H        ALA  38  -4.813  -8.683   1.644
  275    HA   ALA  38           HA       ALA  38  -7.438  -8.008   2.497
  276   1HB   ALA  38          3HB       ALA  38  -6.002  -5.714   1.985
  277   2HB   ALA  38          1HB       ALA  38  -6.805  -5.999   0.441
  278   3HB   ALA  38          2HB       ALA  38  -7.760  -5.834   1.914
  279    H    VAL  39           H        VAL  39  -8.358  -7.053  -0.132
  280    HA   VAL  39           HA       VAL  39  -7.501  -9.181  -1.980
  281    HB   VAL  39           HB       VAL  39  -9.774  -9.502  -0.359
  282   1HG1  VAL  39          1HG1      VAL  39 -10.608  -8.663  -3.143
  283   2HG1  VAL  39          2HG1      VAL  39 -11.643  -9.553  -2.027
  284   3HG1  VAL  39          3HG1      VAL  39 -11.101  -7.925  -1.619
  285   1HG2  VAL  39          2HG2      VAL  39  -8.666 -10.791  -2.805
  286   2HG2  VAL  39          3HG2      VAL  39  -8.877 -11.447  -1.181
  287   3HG2  VAL  39          1HG2      VAL  39 -10.266 -11.290  -2.255
  288    H    VAL  40           H        VAL  40  -8.360  -8.588  -4.210
  289    HA   VAL  40           HA       VAL  40  -9.150  -5.734  -4.245
  290    HB   VAL  40           HB       VAL  40  -6.774  -6.936  -5.657
  291   1HG1  VAL  40          2HG1      VAL  40  -8.474  -5.015  -6.769
  292   2HG1  VAL  40          3HG1      VAL  40  -7.199  -4.070  -6.011
  293   3HG1  VAL  40          1HG1      VAL  40  -6.793  -5.295  -7.210
  294   1HG2  VAL  40          3HG2      VAL  40  -6.534  -6.167  -3.316
  295   2HG2  VAL  40          1HG2      VAL  40  -5.613  -5.151  -4.427
  296   3HG2  VAL  40          2HG2      VAL  40  -7.159  -4.584  -3.787
  297    H    PHE  41           H        PHE  41 -10.951  -5.565  -5.367
  298    HA   PHE  41           HA       PHE  41 -11.583  -7.572  -7.376
  299   1HB   PHE  41          1HB       PHE  41 -13.107  -5.254  -6.198
  300   2HB   PHE  41          2HB       PHE  41 -13.726  -6.161  -7.577
  301    HD1  PHE  41           HD1      PHE  41 -13.499  -8.856  -7.252
  302    HD2  PHE  41           HD2      PHE  41 -13.813  -5.942  -4.081
  303    HE1  PHE  41           HE1      PHE  41 -14.341 -10.625  -5.709
  304    HE2  PHE  41           HE2      PHE  41 -14.653  -7.711  -2.538
  305    HZ   PHE  41           HZ       PHE  41 -14.921 -10.051  -3.353
  306    H    VAL  42           H        VAL  42 -11.722  -7.299  -9.474
  307    HA   VAL  42           HA       VAL  42 -10.638  -4.744 -10.579
  308    HB   VAL  42           HB       VAL  42 -10.537  -6.780 -12.539
  309   1HG1  VAL  42          2HG2      VAL  42  -8.690  -5.155 -10.877
  310   2HG1  VAL  42          3HG2      VAL  42  -7.985  -6.519 -11.743
  311   3HG1  VAL  42          1HG2      VAL  42  -8.818  -5.246 -12.637
  312   1HG2  VAL  42          1HG1      VAL  42  -9.402  -7.703  -9.887
  313   2HG2  VAL  42          2HG1      VAL  42 -10.705  -8.473 -10.780
  314   3HG2  VAL  42          3HG1      VAL  42  -9.080  -8.459 -11.448
  315    H    THR  43           H        THR  43 -12.947  -4.079 -10.320
  316    HA   THR  43           HA       THR  43 -15.089  -5.412 -11.707
  317    HB   THR  43           HB       THR  43 -16.483  -3.715 -10.853
  318    HG1  THR  43           HG1      THR  43 -15.475  -1.689 -10.174
  319   1HG2  THR  43          2HG2      THR  43 -14.622  -4.899  -9.191
  320   2HG2  THR  43          3HG2      THR  43 -14.466  -3.189  -8.789
  321   3HG2  THR  43          1HG2      THR  43 -16.032  -3.988  -8.651
  322    H    ARG  44           H        ARG  44 -16.526  -3.250 -12.780
  323    HA   ARG  44           HA       ARG  44 -16.000  -3.440 -15.466
  324   1HB   ARG  44          1HB       ARG  44 -17.133  -1.094 -15.610
  325   2HB   ARG  44          2HB       ARG  44 -18.046  -2.431 -14.968
  326   1HG   ARG  44          1HG       ARG  44 -16.605  -1.260 -12.798
  327   2HG   ARG  44          2HG       ARG  44 -17.401   0.037 -13.686
  328   1HD   ARG  44          1HD       ARG  44 -19.538  -0.864 -13.333
  329   2HD   ARG  44          2HD       ARG  44 -18.908  -2.479 -13.009
  330    HE   ARG  44           HE       ARG  44 -18.120  -1.621 -10.810
  331   1HH1  ARG  44          2HH1      ARG  44 -18.599   1.593 -11.176
  332   2HH1  ARG  44          1HH1      ARG  44 -20.144   1.408 -11.938
  333   1HH2  ARG  44          1HH2      ARG  44 -20.043  -1.024  -9.189
  334   2HH2  ARG  44          2HH2      ARG  44 -21.269  -0.118 -10.012
  335    H    LYS  45           H        LYS  45 -15.054  -0.481 -13.622
  336    HA   LYS  45           HA       LYS  45 -13.330   0.542 -15.652
  337   1HB   LYS  45          2HB       LYS  45 -13.784   1.047 -12.808
  338   2HB   LYS  45          1HB       LYS  45 -12.083   1.213 -13.241
  339   1HG   LYS  45          1HG       LYS  45 -12.558   3.242 -14.099
  340   2HG   LYS  45          2HG       LYS  45 -13.537   2.443 -15.329
  341   1HD   LYS  45          1HD       LYS  45 -14.719   2.878 -12.609
  342   2HD   LYS  45          2HD       LYS  45 -14.618   4.246 -13.718
  343   1HE   LYS  45          1HE       LYS  45 -15.674   1.669 -14.795
  344   2HE   LYS  45          2HE       LYS  45 -16.723   2.595 -13.722
  345   1HZ   LYS  45          1HZ       LYS  45 -15.972   4.553 -15.241
  346   2HZ   LYS  45          2HZ       LYS  45 -15.657   3.314 -16.360
  347   3HZ   LYS  45          3HZ       LYS  45 -17.224   3.518 -15.736
  348    H    ASN  46           H        ASN  46 -13.010  -1.925 -13.260
  349    HA   ASN  46           HA       ASN  46 -11.570  -3.687 -13.035
  350   1HB   ASN  46          2HB       ASN  46 -11.239  -2.832 -15.787
  351   2HB   ASN  46          1HB       ASN  46  -9.709  -3.374 -15.147
  352   1HD2  ASN  46          1HD2      ASN  46 -11.689  -6.313 -16.458
  353   2HD2  ASN  46          2HD2      ASN  46 -11.553  -4.756 -17.118
  354    H    ARG  47           H        ARG  47 -10.789  -0.629 -12.454
  355    HA   ARG  47           HA       ARG  47  -7.914  -0.727 -12.214
  356   1HB   ARG  47          1HB       ARG  47  -9.884   0.624 -10.331
  357   2HB   ARG  47          2HB       ARG  47  -8.168   1.000 -10.495
  358   1HG   ARG  47          1HG       ARG  47  -9.248   1.156 -13.100
  359   2HG   ARG  47          2HG       ARG  47 -10.397   1.987 -12.051
  360   1HD   ARG  47          1HD       ARG  47  -7.873   2.808 -11.143
  361   2HD   ARG  47          2HD       ARG  47  -7.748   2.831 -12.902
  362    HE   ARG  47           HE       ARG  47 -10.081   4.136 -12.587
  363   1HH1  ARG  47          2HH2      ARG  47  -8.533   4.441  -9.652
  364   2HH1  ARG  47          1HH2      ARG  47  -9.094   6.077  -9.732
  365   1HH2  ARG  47          1HH1      ARG  47  -8.871   6.546 -12.955
  366   2HH2  ARG  47          2HH1      ARG  47  -7.460   6.602 -11.952
  367    H    GLN  48           H        GLN  48  -6.857  -1.235  -9.941
  368    HA   GLN  48           HA       GLN  48  -8.136  -3.723  -9.128
  369   1HB   GLN  48          2HB       GLN  48  -5.433  -2.577  -8.904
  370   2HB   GLN  48          1HB       GLN  48  -5.929  -3.602  -7.554
  371   1HG   GLN  48          1HG       GLN  48  -6.593  -5.364  -9.121
  372   2HG   GLN  48          2HG       GLN  48  -6.220  -4.346 -10.479
  373   1HE2  GLN  48          2HE2      GLN  48  -3.335  -6.541  -8.767
  374   2HE2  GLN  48          1HE2      GLN  48  -4.921  -6.986  -9.170
  375    H    VAL  49           H        VAL  49  -9.933  -2.687  -8.318
  376    HA   VAL  49           HA       VAL  49  -9.993  -0.844  -6.169
  377    HB   VAL  49           HB       VAL  49 -12.219  -2.773  -6.289
  378   1HG1  VAL  49          3HG1      VAL  49 -11.932   0.228  -6.452
  379   2HG1  VAL  49          1HG1      VAL  49 -13.480  -0.616  -6.391
  380   3HG1  VAL  49          2HG1      VAL  49 -12.367  -0.714  -5.026
  381   1HG2  VAL  49          1HG2      VAL  49 -11.250  -1.354  -8.755
  382   2HG2  VAL  49          2HG2      VAL  49 -12.111  -2.883  -8.633
  383   3HG2  VAL  49          3HG2      VAL  49 -12.983  -1.365  -8.451
  384    H    CYS  50           H        CYS  50 -10.677  -1.337  -3.931
  385    HA   CYS  50           HA       CYS  50  -9.494  -3.911  -3.000
  386   1HB   CYS  50          2HB       CYS  50  -8.589  -1.543  -2.321
  387   2HB   CYS  50          1HB       CYS  50  -9.969  -1.514  -1.257
  388    H    ALA  51           H        ALA  51 -10.545  -4.626  -0.804
  389    HA   ALA  51           HA       ALA  51 -13.258  -3.757  -0.290
  390   1HB   ALA  51          2HB       ALA  51 -12.757  -6.153  -2.010
  391   2HB   ALA  51          3HB       ALA  51 -14.087  -6.216  -0.857
  392   3HB   ALA  51          1HB       ALA  51 -14.059  -4.966  -2.098
  393    H    ASN  52           H        ASN  52 -10.649  -4.569   1.093
  394    HA   ASN  52           HA       ASN  52 -10.175  -5.421   3.218
  395   1HB   ASN  52          1HB       ASN  52 -12.478  -4.427   3.667
  396   2HB   ASN  52          2HB       ASN  52 -13.128  -6.047   3.392
  397   1HD2  ASN  52          2HD2      ASN  52 -11.289  -4.777   6.690
  398   2HD2  ASN  52          1HD2      ASN  52 -10.153  -5.000   5.448
  399    HA   PRO  53           HA       PRO  53  -9.964  -9.786   2.373
  400   1HB   PRO  53          1HB       PRO  53  -8.529 -10.466   4.652
  401   2HB   PRO  53          2HB       PRO  53  -7.807  -9.798   3.179
  402   1HG   PRO  53          1HG       PRO  53  -8.212  -8.502   5.809
  403   2HG   PRO  53          2HG       PRO  53  -7.146  -8.020   4.482
  404   1HD   PRO  53          2HD       PRO  53  -9.683  -6.873   5.181
  405   2HD   PRO  53          1HD       PRO  53  -8.659  -6.447   3.817
  406    H    GLU  54           H        GLU  54 -10.608  -8.804   5.762
  407    HA   GLU  54           HA       GLU  54 -12.241 -11.251   6.154
  408   1HB   GLU  54          1HB       GLU  54 -10.426 -10.320   7.796
  409   2HB   GLU  54          2HB       GLU  54 -11.698  -9.200   8.286
  410   1HG   GLU  54          1HG       GLU  54 -12.532 -10.822   9.608
  411   2HG   GLU  54          2HG       GLU  54 -12.915 -11.746   8.155
  412    H    LYS  55           H        LYS  55 -13.439  -9.306   4.459
  413    HA   LYS  55           HA       LYS  55 -15.418  -7.929   6.187
  414   1HB   LYS  55          2HB       LYS  55 -14.400  -7.535   3.478
  415   2HB   LYS  55          1HB       LYS  55 -16.143  -7.461   3.547
  416   1HG   LYS  55          1HG       LYS  55 -14.489  -5.986   5.580
  417   2HG   LYS  55          2HG       LYS  55 -14.788  -5.277   3.993
  418   1HD   LYS  55          1HD       LYS  55 -17.008  -4.927   4.418
  419   2HD   LYS  55          2HD       LYS  55 -17.162  -6.398   5.378
  420   1HE   LYS  55          1HE       LYS  55 -15.739  -5.190   7.148
  421   2HE   LYS  55          2HE       LYS  55 -16.057  -3.717   6.231
  422   1HZ   LYS  55          3HZ       LYS  55 -18.507  -4.686   6.398
  423   2HZ   LYS  55          1HZ       LYS  55 -17.870  -5.340   7.829
  424   3HZ   LYS  55          2HZ       LYS  55 -17.847  -3.661   7.580
  425    H    LYS  56           H        LYS  56 -15.204 -10.945   5.615
  426    HA   LYS  56           HA       LYS  56 -16.700 -12.714   5.370
  427   1HB   LYS  56          1HB       LYS  56 -18.071 -11.478   6.960
  428   2HB   LYS  56          2HB       LYS  56 -18.725 -10.476   5.667
  429   1HG   LYS  56          1HG       LYS  56 -20.334 -12.014   5.319
  430   2HG   LYS  56          2HG       LYS  56 -19.094 -13.196   4.900
  431   1HD   LYS  56          1HD       LYS  56 -18.846 -13.262   7.578
  432   2HD   LYS  56          2HD       LYS  56 -20.542 -12.796   7.472
  433   1HE   LYS  56          1HE       LYS  56 -19.295 -15.176   6.062
  434   2HE   LYS  56          2HE       LYS  56 -20.268 -15.263   7.530
  435   1HZ   LYS  56          1HZ       LYS  56 -22.090 -14.197   6.284
  436   2HZ   LYS  56          2HZ       LYS  56 -21.151 -14.284   4.870
  437   3HZ   LYS  56          3HZ       LYS  56 -21.651 -15.709   5.646
  438    H    TRP  57           H        TRP  57 -18.915 -10.478   3.765
  439    HA   TRP  57           HA       TRP  57 -19.482 -12.040   1.559
  440   1HB   TRP  57          1HB       TRP  57 -20.189 -10.004   0.428
  441   2HB   TRP  57          2HB       TRP  57 -20.634  -9.922   2.136
  442    HD1  TRP  57           HD1      TRP  57 -19.624  -7.929   3.482
  443    HE1  TRP  57           HE1      TRP  57 -18.038  -5.993   2.844
  444    HE3  TRP  57           HE3      TRP  57 -18.196  -9.535  -1.093
  445    HZ2  TRP  57           HZ2      TRP  57 -16.398  -5.206   0.588
  446    HZ3  TRP  57           HZ3      TRP  57 -16.756  -8.169  -2.535
  447    HH2  TRP  57           HH2      TRP  57 -15.835  -6.009  -1.705
  448    H    VAL  58           H        VAL  58 -16.598 -10.014   1.920
  449    HA   VAL  58           HA       VAL  58 -15.755 -10.014  -0.778
  450    HB   VAL  58           HB       VAL  58 -13.360 -10.225   0.338
  451   1HG1  VAL  58          1HG1      VAL  58 -14.761  -8.225  -0.638
  452   2HG1  VAL  58          2HG1      VAL  58 -14.862  -7.758   1.060
  453   3HG1  VAL  58          3HG1      VAL  58 -13.289  -7.934   0.280
  454   1HG2  VAL  58          2HG2      VAL  58 -14.422 -10.942   2.506
  455   2HG2  VAL  58          3HG2      VAL  58 -13.262  -9.619   2.602
  456   3HG2  VAL  58          1HG2      VAL  58 -14.991  -9.283   2.665
  457    H    ARG  59           H        ARG  59 -15.081 -12.525   1.702
  458    HA   ARG  59           HA       ARG  59 -13.583 -14.168  -0.131
  459   1HB   ARG  59          2HB       ARG  59 -14.119 -16.015   1.547
  460   2HB   ARG  59          1HB       ARG  59 -13.265 -14.632   2.186
  461   1HG   ARG  59          1HG       ARG  59 -15.170 -13.802   3.273
  462   2HG   ARG  59          2HG       ARG  59 -16.263 -14.714   2.260
  463   1HD   ARG  59          1HD       ARG  59 -14.368 -16.370   3.793
  464   2HD   ARG  59          2HD       ARG  59 -15.509 -15.463   4.786
  465    HE   ARG  59           HE       ARG  59 -16.761 -16.883   2.553
  466   1HH1  ARG  59          2HH2      ARG  59 -17.011 -16.250   5.787
  467   2HH1  ARG  59          1HH2      ARG  59 -17.282 -17.876   6.321
  468   1HH2  ARG  59          2HH1      ARG  59 -16.360 -19.485   3.708
  469   2HH2  ARG  59          1HH1      ARG  59 -18.003 -19.294   4.225
  470    H    GLU  60           H        GLU  60 -16.995 -13.844   0.644
  471    HA   GLU  60           HA       GLU  60 -17.878 -16.216  -0.755
  472   1HB   GLU  60          1HB       GLU  60 -19.160 -13.740   0.299
  473   2HB   GLU  60          2HB       GLU  60 -20.029 -14.618  -0.936
  474   1HG   GLU  60          1HG       GLU  60 -19.376 -16.698   0.596
  475   2HG   GLU  60          2HG       GLU  60 -19.321 -15.464   1.832
  476    H    TYR  61           H        TYR  61 -16.657 -13.187  -1.755
  477    HA   TYR  61           HA       TYR  61 -17.874 -13.323  -4.442
  478   1HB   TYR  61          2HB       TYR  61 -16.489 -11.290  -2.799
  479   2HB   TYR  61          1HB       TYR  61 -16.091 -11.238  -4.490
  480    HD1  TYR  61           HD2      TYR  61 -18.860 -11.116  -2.029
  481    HD2  TYR  61           HD1      TYR  61 -17.723 -10.522  -6.147
  482    HE1  TYR  61           HE2      TYR  61 -21.042 -10.010  -2.463
  483    HE2  TYR  61           HE1      TYR  61 -19.907  -9.405  -6.581
  484    HH   TYR  61           HH       TYR  61 -22.523  -9.693  -4.757
  485    H    ILE  62           H        ILE  62 -14.884 -13.887  -2.721
  486    HA   ILE  62           HA       ILE  62 -13.107 -14.022  -4.954
  487    HB   ILE  62           HB       ILE  62 -13.066 -15.417  -2.260
  488   1HG1  ILE  62          1HG1      ILE  62 -11.493 -13.039  -3.269
  489   2HG1  ILE  62          2HG1      ILE  62 -12.968 -12.894  -2.347
  490   1HG2  ILE  62          1HG2      ILE  62 -11.474 -15.902  -4.581
  491   2HG2  ILE  62          2HG2      ILE  62 -10.465 -15.084  -3.388
  492   3HG2  ILE  62          3HG2      ILE  62 -11.286 -16.588  -2.968
  493   1HD1  ILE  62          3HD1      ILE  62 -11.721 -14.541  -0.689
  494   2HD1  ILE  62          1HD1      ILE  62 -10.284 -13.885  -1.474
  495   3HD1  ILE  62          2HD1      ILE  62 -11.401 -12.806  -0.636
  496    H    ASN  63           H        ASN  63 -15.126 -16.501  -3.371
  497    HA   ASN  63           HA       ASN  63 -14.273 -18.520  -5.343
  498   1HB   ASN  63          2HB       ASN  63 -15.291 -18.610  -2.720
  499   2HB   ASN  63          1HB       ASN  63 -16.543 -19.298  -3.725
  500   1HD2  ASN  63          1HD2      ASN  63 -15.116 -22.112  -4.629
  501   2HD2  ASN  63          2HD2      ASN  63 -15.974 -21.757  -3.208
  502    H    SER  64           H        SER  64 -17.067 -16.478  -4.651
  503    HA   SER  64           HA       SER  64 -18.944 -17.728  -6.386
  504   1HB   SER  64          1HB       SER  64 -19.664 -16.001  -4.842
  505   2HB   SER  64          2HB       SER  64 -18.613 -14.814  -5.614
  506    HG   SER  64           HG       SER  64 -21.056 -15.829  -6.420
  507    H    LEU  65           H        LEU  65 -16.171 -15.720  -7.054
  508    HA   LEU  65           HA       LEU  65 -16.985 -15.046  -9.772
  509   1HB   LEU  65          2HB       LEU  65 -14.429 -14.797  -8.203
  510   2HB   LEU  65          1HB       LEU  65 -14.446 -14.494  -9.924
  511    HG   LEU  65           HG       LEU  65 -16.464 -13.176  -8.121
  512   1HD1  LEU  65          3HD1      LEU  65 -14.037 -12.784  -7.359
  513   2HD1  LEU  65          1HD1      LEU  65 -13.820 -11.928  -8.886
  514   3HD1  LEU  65          2HD1      LEU  65 -15.000 -11.349  -7.709
  515   1HD2  LEU  65          1HD2      LEU  65 -16.144 -13.262 -10.856
  516   2HD2  LEU  65          2HD2      LEU  65 -16.998 -11.989  -9.982
  517   3HD2  LEU  65          3HD2      LEU  65 -15.307 -11.769 -10.433
  518    H    GLU  66           H        GLU  66 -13.989 -16.754  -8.892
  519    HA   GLU  66           HA       GLU  66 -14.146 -18.352 -11.325
  520   1HB   GLU  66          1HB       GLU  66 -12.119 -17.595  -9.531
  521   2HB   GLU  66          2HB       GLU  66 -12.244 -19.346  -9.372
  522   1HG   GLU  66          1HG       GLU  66 -10.707 -18.987 -11.159
  523   2HG   GLU  66          2HG       GLU  66 -12.229 -19.424 -11.936
  524    H    MET  67           H        MET  67 -13.272 -20.862 -10.496
  525    HA   MET  67           HA       MET  67 -15.737 -21.884  -9.172
  526   1HB   MET  67          1HB       MET  67 -13.731 -23.071 -11.074
  527   2HB   MET  67          2HB       MET  67 -14.721 -24.128 -10.068
  528   1HG   MET  67          1HG       MET  67 -15.899 -21.929 -11.781
  529   2HG   MET  67          2HG       MET  67 -15.684 -23.579 -12.364
  530   1HE   MET  67          1HE       MET  67 -18.148 -22.180 -12.537
  531   2HE   MET  67          3HE       MET  67 -18.515 -23.894 -12.726
  532   3HE   MET  67          2HE       MET  67 -19.486 -22.898 -11.642
  533    H    SER  68           H        SER  68 -12.287 -21.607  -8.787
  534    HA   SER  68           HA       SER  68 -12.363 -22.264  -6.014
  535   1HB   SER  68          1HB       SER  68 -10.865 -24.432  -6.439
  536   2HB   SER  68          2HB       SER  68 -12.622 -24.538  -6.335
  537    HG   SER  68           HG       SER  68 -11.760 -25.585  -8.194
  538    H    SER   1           H        SER   1 -15.459  14.445   0.803
  539    HA   SER   1           HA       SER   1 -17.328  13.026  -0.932
  540   1HB   SER   1          1HB       SER   1 -14.541  14.089  -1.163
  541   2HB   SER   1          2HB       SER   1 -15.053  12.849  -2.307
  542    HG   SER   1           HG       SER   1 -15.831  15.472  -2.071
  543    HA   PRO   2           HA       PRO   2 -16.295   8.861  -0.065
  544   1HB   PRO   2          1HB       PRO   2 -15.681   8.062  -2.768
  545   2HB   PRO   2          2HB       PRO   2 -17.180   7.792  -1.873
  546   1HG   PRO   2          1HG       PRO   2 -16.729   9.634  -4.049
  547   2HG   PRO   2          2HG       PRO   2 -18.228   9.363  -3.153
  548   1HD   PRO   2          1HD       PRO   2 -16.469  11.643  -3.009
  549   2HD   PRO   2          2HD       PRO   2 -17.973  11.371  -2.111
  550    H    TYR   3           H        TYR   3 -14.479   7.105  -0.920
  551    HA   TYR   3           HA       TYR   3 -11.887   8.592  -1.054
  552   1HB   TYR   3          1HB       TYR   3 -12.498   6.101   0.569
  553   2HB   TYR   3          2HB       TYR   3 -10.916   6.871   0.432
  554    HD1  TYR   3           HD2      TYR   3 -10.990   9.544   0.891
  555    HD2  TYR   3           HD1      TYR   3 -13.788   6.644   2.440
  556    HE1  TYR   3           HE2      TYR   3 -11.590  11.109   2.735
  557    HE2  TYR   3           HE1      TYR   3 -14.388   8.210   4.285
  558    HH   TYR   3           HH       TYR   3 -14.287  10.496   4.869
  559    H    SER   4           H        SER   4 -10.157   7.400  -2.122
  560    HA   SER   4           HA       SER   4 -11.208   5.627  -4.239
  561   1HB   SER   4          1HB       SER   4  -9.295   7.605  -4.245
  562   2HB   SER   4          2HB       SER   4  -8.310   6.144  -4.173
  563    HG   SER   4           HG       SER   4  -9.509   5.362  -5.967
  564    H    SER   5           H        SER   5 -11.396   3.521  -3.593
  565    HA   SER   5           HA       SER   5  -9.187   2.362  -1.950
  566   1HB   SER   5          1HB       SER   5 -11.932   1.184  -2.455
  567   2HB   SER   5          2HB       SER   5 -10.752   0.668  -1.249
  568    HG   SER   5           HG       SER   5 -12.200   3.096  -1.352
  569    H    ASP   6           H        ASP   6  -7.700   1.418  -3.278
  570    HA   ASP   6           HA       ASP   6  -8.489  -0.752  -5.038
  571   1HB   ASP   6          1HB       ASP   6  -7.781   0.237  -7.147
  572   2HB   ASP   6          2HB       ASP   6  -9.029   1.258  -6.440
  573    H    THR   7           H        THR   7  -6.040  -0.417  -6.700
  574    HA   THR   7           HA       THR   7  -4.242  -1.648  -4.803
  575    HB   THR   7           HB       THR   7  -4.367  -2.363  -7.179
  576    HG1  THR   7           HG1      THR   7  -2.463  -2.795  -6.131
  577   1HG2  THR   7          1HG2      THR   7  -4.618   0.128  -7.920
  578   2HG2  THR   7          2HG2      THR   7  -2.855   0.139  -7.904
  579   3HG2  THR   7          3HG2      THR   7  -3.721  -0.976  -8.961
  580    H    THR   8           H        THR   8  -1.816  -0.833  -4.931
  581    HA   THR   8           HA       THR   8  -1.548   2.081  -5.119
  582    HB   THR   8           HB       THR   8  -0.648   1.179  -2.478
  583    HG1  THR   8           HG1      THR   8  -2.558   0.703  -1.641
  584   1HG2  THR   8          2HG2      THR   8  -2.241   3.458  -3.649
  585   2HG2  THR   8          3HG2      THR   8  -2.076   3.265  -1.904
  586   3HG2  THR   8          1HG2      THR   8  -0.644   3.503  -2.904
  587    HA   PRO   9           HA       PRO   9   2.265   0.017  -6.422
  588   1HB   PRO   9          1HB       PRO   9   3.188   2.662  -7.180
  589   2HB   PRO   9          2HB       PRO   9   2.750   1.313  -8.237
  590   1HG   PRO   9          2HG       PRO   9   1.248   3.726  -7.757
  591   2HG   PRO   9          1HG       PRO   9   0.787   2.360  -8.774
  592   1HD   PRO   9          1HD       PRO   9  -0.328   3.115  -6.257
  593   2HD   PRO   9          2HD       PRO   9  -0.763   1.741  -7.261
  594    H    CYS  10           H        CYS  10   2.871  -0.334  -4.176
  595    HA   CYS  10           HA       CYS  10   4.686   1.791  -3.138
  596   1HB   CYS  10          2HB       CYS  10   2.540   0.288  -1.645
  597   2HB   CYS  10          1HB       CYS  10   3.890   1.023  -0.814
  598    H    CYS  11           H        CYS  11   6.414   1.022  -1.852
  599    HA   CYS  11           HA       CYS  11   7.120  -1.768  -2.514
  600   1HB   CYS  11          2HB       CYS  11   9.031  -0.717  -3.071
  601   2HB   CYS  11          1HB       CYS  11   8.575   0.740  -2.244
  602    H    PHE  12           H        PHE  12   7.607  -3.292  -0.849
  603    HA   PHE  12           HA       PHE  12   6.549  -2.515   1.816
  604   1HB   PHE  12          2HB       PHE  12   6.316  -4.881   2.251
  605   2HB   PHE  12          1HB       PHE  12   5.648  -4.557   0.672
  606    HD1  PHE  12           HD2      PHE  12   6.799  -5.293  -1.385
  607    HD2  PHE  12           HD1      PHE  12   8.412  -6.128   2.530
  608    HE1  PHE  12           HE2      PHE  12   8.351  -6.966  -2.384
  609    HE2  PHE  12           HE1      PHE  12   9.966  -7.801   1.532
  610    HZ   PHE  12           HZ       PHE  12   9.934  -8.222  -0.925
  611    H    ALA  13           H        ALA  13   9.403  -4.106   0.372
  612    HA   ALA  13           HA       ALA  13  10.925  -3.281   2.805
  613   1HB   ALA  13          2HB       ALA  13  10.477  -5.748   2.787
  614   2HB   ALA  13          3HB       ALA  13  11.339  -5.849   1.251
  615   3HB   ALA  13          1HB       ALA  13  12.194  -5.354   2.712
  616    H    TYR  14           H        TYR  14  12.932  -2.399   2.416
  617    HA   TYR  14           HA       TYR  14  13.583  -2.097  -0.457
  618   1HB   TYR  14          1HB       TYR  14  15.062  -0.126   0.663
  619   2HB   TYR  14          2HB       TYR  14  13.420   0.109   0.080
  620    HD1  TYR  14           HD1      TYR  14  11.470  -0.249   1.750
  621    HD2  TYR  14           HD2      TYR  14  15.599   0.209   2.923
  622    HE1  TYR  14           HE1      TYR  14  10.752   0.224   4.081
  623    HE2  TYR  14           HE2      TYR  14  14.878   0.691   5.263
  624    HH   TYR  14           HH       TYR  14  11.473   1.119   6.090
  625    H    ILE  15           H        ILE  15  15.633  -2.596  -1.191
  626    HA   ILE  15           HA       ILE  15  17.236  -4.368   0.438
  627    HB   ILE  15           HB       ILE  15  17.132  -4.635  -1.998
  628   1HG1  ILE  15          2HG1      ILE  15  19.922  -3.692  -1.309
  629   2HG1  ILE  15          1HG1      ILE  15  19.252  -5.195  -0.675
  630   1HG2  ILE  15          1HG2      ILE  15  18.132  -1.801  -1.915
  631   2HG2  ILE  15          2HG2      ILE  15  18.523  -2.825  -3.298
  632   3HG2  ILE  15          3HG2      ILE  15  16.839  -2.495  -2.893
  633   1HD1  ILE  15          1HD1      ILE  15  18.735  -5.823  -3.098
  634   2HD1  ILE  15          2HD1      ILE  15  19.748  -4.457  -3.567
  635   3HD1  ILE  15          3HD1      ILE  15  20.442  -5.799  -2.657
  636    H    ALA  16           H        ALA  16  19.599  -3.943   0.849
  637    HA   ALA  16           HA       ALA  16  19.977  -1.096   1.670
  638   1HB   ALA  16          3HB       ALA  16  20.143  -3.357   3.210
  639   2HB   ALA  16          1HB       ALA  16  21.829  -3.129   2.743
  640   3HB   ALA  16          2HB       ALA  16  20.964  -1.840   3.582
  641    H    ARG  17           H        ARG  17  20.871  -0.322  -0.285
  642    HA   ARG  17           HA       ARG  17  23.657  -0.515  -0.647
  643   1HB   ARG  17          2HB       ARG  17  22.240  -2.769  -1.736
  644   2HB   ARG  17          1HB       ARG  17  22.959  -1.854  -3.039
  645   1HG   ARG  17          1HG       ARG  17  25.023  -1.830  -1.298
  646   2HG   ARG  17          2HG       ARG  17  24.269  -3.356  -0.839
  647   1HD   ARG  17          1HD       ARG  17  24.218  -3.845  -3.392
  648   2HD   ARG  17          2HD       ARG  17  25.406  -2.547  -3.512
  649    HE   ARG  17           HE       ARG  17  26.412  -4.201  -1.522
  650   1HH1  ARG  17          1HH1      ARG  17  25.789  -6.816  -2.502
  651   2HH1  ARG  17          2HH1      ARG  17  25.783  -6.719  -4.231
  652   1HH2  ARG  17          2HH2      ARG  17  28.448  -4.724  -3.669
  653   2HH2  ARG  17          1HH2      ARG  17  27.379  -4.673  -5.030
  654    HA   PRO  18           HA       PRO  18  21.899   3.004  -2.854
  655   1HB   PRO  18          2HB       PRO  18  24.535   3.906  -3.522
  656   2HB   PRO  18          1HB       PRO  18  23.456   4.557  -2.294
  657   1HG   PRO  18          2HG       PRO  18  25.841   2.962  -1.897
  658   2HG   PRO  18          1HG       PRO  18  24.822   3.703  -0.681
  659   1HD   PRO  18          1HD       PRO  18  25.007   0.926  -1.304
  660   2HD   PRO  18          2HD       PRO  18  23.902   1.683  -0.169
  661    H    LEU  19           H        LEU  19  21.060   2.005  -4.681
  662    HA   LEU  19           HA       LEU  19  22.380   0.495  -6.627
  663   1HB   LEU  19          1HB       LEU  19  20.156   2.486  -7.097
  664   2HB   LEU  19          2HB       LEU  19  20.567   1.159  -8.153
  665    HG   LEU  19           HG       LEU  19  19.560   0.949  -5.306
  666   1HD1  LEU  19          1HD1      LEU  19  17.896   1.525  -7.115
  667   2HD1  LEU  19          2HD1      LEU  19  18.310  -0.002  -7.896
  668   3HD1  LEU  19          3HD1      LEU  19  17.573  -0.002  -6.293
  669   1HD2  LEU  19          2HD2      LEU  19  20.914  -0.963  -7.109
  670   2HD2  LEU  19          3HD2      LEU  19  20.770  -0.982  -5.351
  671   3HD2  LEU  19          1HD2      LEU  19  19.439  -1.566  -6.351
  672    HA   PRO  20           HA       PRO  20  25.221   3.591  -8.216
  673   1HB   PRO  20          1HB       PRO  20  25.608   1.942 -10.578
  674   2HB   PRO  20          2HB       PRO  20  26.739   2.248  -9.255
  675   1HG   PRO  20          1HG       PRO  20  25.307  -0.175  -9.773
  676   2HG   PRO  20          2HG       PRO  20  26.332   0.178  -8.380
  677   1HD   PRO  20          1HD       PRO  20  23.441  -0.029  -8.473
  678   2HD   PRO  20          2HD       PRO  20  24.477   0.237  -7.058
  679    H    ARG  21           H        ARG  21  25.056   5.205  -9.844
  680    HA   ARG  21           HA       ARG  21  22.450   5.582 -11.008
  681   1HB   ARG  21          2HB       ARG  21  24.163   7.382 -10.358
  682   2HB   ARG  21          1HB       ARG  21  24.969   7.008 -11.881
  683   1HG   ARG  21          2HG       ARG  21  22.022   7.537 -11.906
  684   2HG   ARG  21          1HG       ARG  21  23.111   8.895 -11.770
  685   1HD   ARG  21          2HD       ARG  21  24.291   7.455 -13.777
  686   2HD   ARG  21          1HD       ARG  21  22.599   7.138 -14.072
  687    HE   ARG  21           HE       ARG  21  22.779   9.904 -13.673
  688   1HH1  ARG  21          1HH1      ARG  21  22.736   7.641 -16.119
  689   2HH1  ARG  21          2HH1      ARG  21  23.222   8.768 -17.342
  690   1HH2  ARG  21          1HH2      ARG  21  23.963  11.318 -15.397
  691   2HH2  ARG  21          2HH2      ARG  21  24.980  10.324 -16.386
  692    H    ALA  22           H        ALA  22  25.366   4.048 -12.152
  693    HA   ALA  22           HA       ALA  22  24.579   4.179 -14.957
  694   1HB   ALA  22          2HB       ALA  22  26.742   2.717 -13.447
  695   2HB   ALA  22          3HB       ALA  22  26.445   2.398 -15.156
  696   3HB   ALA  22          1HB       ALA  22  26.917   4.015 -14.628
  697    H    HIS  23           H        HIS  23  23.627   2.251 -12.315
  698    HA   HIS  23           HA       HIS  23  22.844   0.018 -14.121
  699   1HB   HIS  23          2HB       HIS  23  22.660   0.203 -11.100
  700   2HB   HIS  23          1HB       HIS  23  22.358  -1.231 -12.077
  701    HD2  HIS  23           HD2      HIS  23  25.536   1.149 -12.432
  702    HE1  HIS  23           HE1      HIS  23  26.819  -2.767 -11.489
  703    HE2  HIS  23           HE2      HIS  23  27.591  -0.419 -12.096
  704    H    ILE  24           H        ILE  24  21.565   2.730 -12.344
  705    HA   ILE  24           HA       ILE  24  18.816   1.676 -12.547
  706    HB   ILE  24           HB       ILE  24  19.655   4.404 -11.602
  707   1HG1  ILE  24          2HG1      ILE  24  19.195   1.899  -9.974
  708   2HG1  ILE  24          1HG1      ILE  24  20.751   2.644 -10.251
  709   1HG2  ILE  24          3HG2      ILE  24  17.135   2.770 -11.487
  710   2HG2  ILE  24          1HG2      ILE  24  17.432   4.049 -10.310
  711   3HG2  ILE  24          2HG2      ILE  24  17.345   4.435 -12.028
  712   1HD1  ILE  24          1HD1      ILE  24  18.977   4.682  -9.337
  713   2HD1  ILE  24          2HD1      ILE  24  18.812   3.299  -8.253
  714   3HD1  ILE  24          3HD1      ILE  24  20.395   4.033  -8.515
  715    H    LYS  25           H        LYS  25  17.126   2.975 -13.613
  716    HA   LYS  25           HA       LYS  25  18.227   4.547 -15.916
  717   1HB   LYS  25          1HB       LYS  25  15.887   2.637 -15.775
  718   2HB   LYS  25          2HB       LYS  25  16.076   3.798 -17.089
  719   1HG   LYS  25          1HG       LYS  25  18.470   2.166 -16.419
  720   2HG   LYS  25          2HG       LYS  25  17.127   1.308 -17.176
  721   1HD   LYS  25          1HD       LYS  25  17.131   3.350 -18.834
  722   2HD   LYS  25          2HD       LYS  25  18.784   3.570 -18.260
  723   1HE   LYS  25          1HE       LYS  25  19.054   2.141 -20.111
  724   2HE   LYS  25          2HE       LYS  25  19.046   1.024 -18.747
  725   1HZ   LYS  25          3HZ       LYS  25  16.569   1.736 -20.197
  726   2HZ   LYS  25          1HZ       LYS  25  17.568   0.460 -20.707
  727   3HZ   LYS  25          2HZ       LYS  25  16.847   0.412 -19.170
  728    H    GLU  26           H        GLU  26  15.861   4.368 -13.343
  729    HA   GLU  26           HA       GLU  26  15.354   7.214 -13.462
  730   1HB   GLU  26          1HB       GLU  26  12.747   6.621 -13.674
  731   2HB   GLU  26          2HB       GLU  26  13.723   6.945 -15.088
  732   1HG   GLU  26          2HG       GLU  26  13.800   4.136 -14.243
  733   2HG   GLU  26          1HG       GLU  26  12.207   4.681 -14.701
  734    H    TYR  27           H        TYR  27  12.888   7.113 -11.926
  735    HA   TYR  27           HA       TYR  27  13.216   5.148  -9.846
  736   1HB   TYR  27          2HB       TYR  27  14.003   6.490  -8.079
  737   2HB   TYR  27          1HB       TYR  27  14.999   7.009  -9.433
  738    HD1  TYR  27           HD1      TYR  27  14.214   9.088 -10.784
  739    HD2  TYR  27           HD2      TYR  27  12.672   8.035  -6.892
  740    HE1  TYR  27           HE1      TYR  27  13.360  11.412 -10.492
  741    HE2  TYR  27           HE2      TYR  27  11.822  10.359  -6.598
  742    HH   TYR  27           HH       TYR  27  12.660  12.924  -8.812
  743    H    PHE  28           H        PHE  28  11.640   6.109  -7.855
  744    HA   PHE  28           HA       PHE  28   9.466   7.672  -8.941
  745   1HB   PHE  28          2HB       PHE  28   8.975   5.637 -10.146
  746   2HB   PHE  28          1HB       PHE  28   9.147   4.671  -8.683
  747    HD1  PHE  28           HD1      PHE  28   7.063   7.308 -10.321
  748    HD2  PHE  28           HD2      PHE  28   7.338   4.382  -7.159
  749    HE1  PHE  28           HE1      PHE  28   4.639   7.615  -9.826
  750    HE2  PHE  28           HE2      PHE  28   4.920   4.695  -6.657
  751    HZ   PHE  28           HZ       PHE  28   3.566   6.308  -7.994
  752    H    TYR  29           H        TYR  29   9.402   8.856  -7.006
  753    HA   TYR  29           HA       TYR  29   9.630   7.765  -4.389
  754   1HB   TYR  29          1HB       TYR  29   9.793  10.169  -4.811
  755   2HB   TYR  29          2HB       TYR  29   8.123  10.218  -5.311
  756    HD1  TYR  29           HD2      TYR  29  10.300   9.279  -2.408
  757    HD2  TYR  29           HD1      TYR  29   6.412  10.607  -3.730
  758    HE1  TYR  29           HE2      TYR  29   9.604   9.595  -0.038
  759    HE2  TYR  29           HE1      TYR  29   5.715  10.925  -1.359
  760    HH   TYR  29           HH       TYR  29   7.684   9.806   1.308
  761    H    THR  30           H        THR  30   8.244   6.627  -3.200
  762    HA   THR  30           HA       THR  30   5.708   5.746  -4.319
  763    HB   THR  30           HB       THR  30   6.781   5.360  -1.508
  764    HG1  THR  30           HG1      THR  30   6.959   3.602  -3.716
  765   1HG2  THR  30          3HG2      THR  30   4.653   3.966  -3.154
  766   2HG2  THR  30          1HG2      THR  30   5.319   3.298  -1.663
  767   3HG2  THR  30          2HG2      THR  30   4.434   4.824  -1.629
  768    H    SER  31           H        SER  31   3.619   6.318  -3.623
  769    HA   SER  31           HA       SER  31   3.243   8.991  -2.681
  770   1HB   SER  31          1HB       SER  31   1.424   6.618  -3.030
  771   2HB   SER  31          2HB       SER  31   0.828   8.092  -2.267
  772    HG   SER  31           HG       SER  31   0.696   7.821  -4.684
  773    H    GLY  32           H        GLY  32   1.708   9.330  -0.654
  774   1HA   GLY  32          1HA       GLY  32   2.929   7.810   1.609
  775   2HA   GLY  32          2HA       GLY  32   2.489   9.497   1.714
  776    H    LYS  33           H        LYS  33   0.849   6.479   0.691
  777    HA   LYS  33           HA       LYS  33  -1.231   6.951   2.730
  778   1HB   LYS  33          1HB       LYS  33  -3.034   6.728   0.969
  779   2HB   LYS  33          2HB       LYS  33  -2.153   8.235   0.915
  780   1HG   LYS  33          2HG       LYS  33  -1.474   7.805  -1.186
  781   2HG   LYS  33          1HG       LYS  33  -0.776   6.285  -0.680
  782   1HD   LYS  33          2HD       LYS  33  -2.671   5.072  -1.233
  783   2HD   LYS  33          1HD       LYS  33  -3.740   6.431  -0.981
  784   1HE   LYS  33          1HE       LYS  33  -2.389   7.446  -3.031
  785   2HE   LYS  33          2HE       LYS  33  -2.089   5.743  -3.375
  786   1HZ   LYS  33          3HZ       LYS  33  -4.825   6.439  -2.701
  787   2HZ   LYS  33          1HZ       LYS  33  -4.259   7.042  -4.184
  788   3HZ   LYS  33          2HZ       LYS  33  -4.232   5.371  -3.881
  789    H    CYS  34           H        CYS  34   0.838   4.892   2.045
  790    HA   CYS  34           HA       CYS  34  -1.017   2.565   2.050
  791   1HB   CYS  34          1HB       CYS  34   0.559   1.344   0.540
  792   2HB   CYS  34          2HB       CYS  34  -0.214   2.721  -0.246
  793    H    SER  35           H        SER  35   0.821   4.096   3.996
  794    HA   SER  35           HA       SER  35   2.280   3.549   5.750
  795   1HB   SER  35          1HB       SER  35   0.637   1.139   5.224
  796   2HB   SER  35          2HB       SER  35   2.108   0.867   6.160
  797    HG   SER  35           HG       SER  35   0.986   1.602   7.761
  798    H    ASN  36           H        ASN  36   3.251   3.372   2.908
  799    HA   ASN  36           HA       ASN  36   5.697   1.782   3.513
  800   1HB   ASN  36          1HB       ASN  36   3.832   1.418   1.197
  801   2HB   ASN  36          2HB       ASN  36   5.543   1.172   0.947
  802   1HD2  ASN  36          1HD2      ASN  36   4.030  -2.029   1.845
  803   2HD2  ASN  36          2HD2      ASN  36   2.942  -0.773   1.499
  804    HA   PRO  37           HA       PRO  37   6.216   6.086   1.556
  805   1HB   PRO  37          1HB       PRO  37   7.889   6.808   3.783
  806   2HB   PRO  37          2HB       PRO  37   6.329   7.508   3.338
  807   1HG   PRO  37          1HG       PRO  37   6.931   5.736   5.555
  808   2HG   PRO  37          2HG       PRO  37   5.388   6.502   5.158
  809   1HD   PRO  37          2HD       PRO  37   6.084   3.734   4.870
  810   2HD   PRO  37          1HD       PRO  37   4.571   4.525   4.391
  811    H    ALA  38           H        ALA  38   7.997   6.186   0.177
  812    HA   ALA  38           HA       ALA  38  10.676   5.617   0.931
  813   1HB   ALA  38          3HB       ALA  38   9.215   3.284   0.838
  814   2HB   ALA  38          1HB       ALA  38   9.908   3.350  -0.782
  815   3HB   ALA  38          2HB       ALA  38  10.964   3.382   0.630
  816    H    VAL  39           H        VAL  39  11.416   4.307  -1.599
  817    HA   VAL  39           HA       VAL  39  10.426   6.168  -3.657
  818    HB   VAL  39           HB       VAL  39  12.804   6.694  -2.255
  819   1HG1  VAL  39          1HG1      VAL  39  13.447   5.476  -4.949
  820   2HG1  VAL  39          2HG1      VAL  39  14.554   6.503  -4.038
  821   3HG1  VAL  39          3HG1      VAL  39  14.046   4.951  -3.375
  822   1HG2  VAL  39          2HG2      VAL  39  11.527   7.643  -4.774
  823   2HG2  VAL  39          3HG2      VAL  39  11.847   8.514  -3.273
  824   3HG2  VAL  39          1HG2      VAL  39  13.160   8.202  -4.408
  825    H    VAL  40           H        VAL  40  11.126   5.271  -5.839
  826    HA   VAL  40           HA       VAL  40  11.925   2.435  -5.538
  827    HB   VAL  40           HB       VAL  40   9.453   3.446  -6.935
  828   1HG1  VAL  40          2HG1      VAL  40  11.081   1.383  -7.886
  829   2HG1  VAL  40          3HG1      VAL  40   9.866   0.557  -6.920
  830   3HG1  VAL  40          1HG1      VAL  40   9.373   1.608  -8.245
  831   1HG2  VAL  40          3HG2      VAL  40   9.378   3.005  -4.500
  832   2HG2  VAL  40          1HG2      VAL  40   8.387   1.853  -5.395
  833   3HG2  VAL  40          2HG2      VAL  40   9.976   1.370  -4.792
  834    H    PHE  41           H        PHE  41  13.640   2.097  -6.750
  835    HA   PHE  41           HA       PHE  41  14.130   3.810  -9.051
  836   1HB   PHE  41          1HB       PHE  41  15.738   1.664  -7.673
  837   2HB   PHE  41          2HB       PHE  41  16.259   2.370  -9.203
  838    HD1  PHE  41           HD1      PHE  41  16.048   5.087  -9.234
  839    HD2  PHE  41           HD2      PHE  41  16.590   2.629  -5.725
  840    HE1  PHE  41           HE1      PHE  41  16.988   7.044  -8.008
  841    HE2  PHE  41           HE2      PHE  41  17.529   4.587  -4.500
  842    HZ   PHE  41           HZ       PHE  41  17.731   6.793  -5.641
  843    H    VAL  42           H        VAL  42  14.129   3.250 -11.098
  844    HA   VAL  42           HA       VAL  42  12.979   0.575 -11.766
  845    HB   VAL  42           HB       VAL  42  12.737   2.326 -13.973
  846   1HG1  VAL  42          2HG2      VAL  42  11.013   0.952 -11.983
  847   2HG1  VAL  42          3HG2      VAL  42  10.247   2.190 -12.975
  848   3HG1  VAL  42          1HG2      VAL  42  11.020   0.803 -13.743
  849   1HG2  VAL  42          1HG1      VAL  42  11.781   3.607 -11.400
  850   2HG2  VAL  42          2HG1      VAL  42  13.020   4.239 -12.472
  851   3HG2  VAL  42          3HG1      VAL  42  11.355   4.147 -13.025
  852    H    THR  43           H        THR  43  15.302  -0.064 -11.577
  853    HA   THR  43           HA       THR  43  17.340   1.054 -13.278
  854    HB   THR  43           HB       THR  43  18.795  -0.515 -12.295
  855    HG1  THR  43           HG1      THR  43  17.842  -2.425 -11.276
  856   1HG2  THR  43          2HG2      THR  43  17.048   0.894 -10.687
  857   2HG2  THR  43          3HG2      THR  43  16.925  -0.744 -10.046
  858   3HG2  THR  43          1HG2      THR  43  18.494   0.055 -10.125
  859    H    ARG  44           H        ARG  44  18.705  -1.246 -14.139
  860    HA   ARG  44           HA       ARG  44  17.997  -1.424 -16.783
  861   1HB   ARG  44          2HB       ARG  44  19.103  -3.788 -16.677
  862   2HB   ARG  44          1HB       ARG  44  20.069  -2.383 -16.306
  863   1HG   ARG  44          1HG       ARG  44  18.787  -3.220 -13.888
  864   2HG   ARG  44          2HG       ARG  44  19.526  -4.633 -14.637
  865   1HD   ARG  44          1HD       ARG  44  21.677  -3.700 -14.568
  866   2HD   ARG  44          2HD       ARG  44  21.062  -2.053 -14.427
  867    HE   ARG  44           HE       ARG  44  20.438  -2.594 -12.080
  868   1HH1  ARG  44          2HH1      ARG  44  20.900  -5.832 -12.032
  869   2HH1  ARG  44          1HH1      ARG  44  22.385  -5.763 -12.920
  870   1HH2  ARG  44          1HH2      ARG  44  22.468  -2.980 -10.526
  871   2HH2  ARG  44          2HH2      ARG  44  23.638  -3.995 -11.301
  872    H    LYS  45           H        LYS  45  17.186  -4.094 -14.494
  873    HA   LYS  45           HA       LYS  45  15.326  -5.373 -16.238
  874   1HB   LYS  45          2HB       LYS  45  15.981  -5.486 -13.389
  875   2HB   LYS  45          1HB       LYS  45  14.254  -5.700 -13.676
  876   1HG   LYS  45          1HG       LYS  45  14.677  -7.830 -14.279
  877   2HG   LYS  45          2HG       LYS  45  15.566  -7.212 -15.671
  878   1HD   LYS  45          1HD       LYS  45  16.934  -7.277 -13.005
  879   2HD   LYS  45          2HD       LYS  45  16.762  -8.784 -13.906
  880   1HE   LYS  45          1HE       LYS  45  17.734  -6.384 -15.396
  881   2HE   LYS  45          2HE       LYS  45  18.856  -7.163 -14.282
  882   1HZ   LYS  45          1HZ       LYS  45  18.009  -9.304 -15.464
  883   2HZ   LYS  45          2HZ       LYS  45  17.614  -8.228 -16.717
  884   3HZ   LYS  45          3HZ       LYS  45  19.220  -8.355 -16.180
  885    H    ASN  46           H        ASN  46  15.169  -2.599 -14.191
  886    HA   ASN  46           HA       ASN  46  13.743  -0.814 -14.109
  887   1HB   ASN  46          1HB       ASN  46  13.225  -2.035 -16.690
  888   2HB   ASN  46          2HB       ASN  46  11.741  -1.400 -16.027
  889   1HD2  ASN  46          1HD2      ASN  46  13.616   1.321 -17.860
  890   2HD2  ASN  46          2HD2      ASN  46  13.442  -0.312 -18.289
  891    H    ARG  47           H        ARG  47  13.013  -3.757 -13.063
  892    HA   ARG  47           HA       ARG  47  10.161  -3.610 -12.642
  893   1HB   ARG  47          1HB       ARG  47  12.261  -4.702 -10.731
  894   2HB   ARG  47          2HB       ARG  47  10.540  -5.086 -10.723
  895   1HG   ARG  47          1HG       ARG  47  11.438  -5.605 -13.351
  896   2HG   ARG  47          2HG       ARG  47  12.658  -6.291 -12.278
  897   1HD   ARG  47          1HD       ARG  47  10.207  -6.964 -11.094
  898   2HD   ARG  47          2HD       ARG  47   9.960  -7.226 -12.821
  899    HE   ARG  47           HE       ARG  47  12.312  -8.491 -12.494
  900   1HH1  ARG  47          2HH2      ARG  47  10.972  -8.381  -9.445
  901   2HH1  ARG  47          1HH2      ARG  47  11.532 -10.017  -9.338
  902   1HH2  ARG  47          1HH1      ARG  47  11.089 -10.921 -12.443
  903   2HH2  ARG  47          2HH1      ARG  47   9.751 -10.831 -11.346
  904    H    GLN  48           H        GLN  48   9.262  -2.787 -10.392
  905    HA   GLN  48           HA       GLN  48  10.586  -0.217 -10.021
  906   1HB   GLN  48          2HB       GLN  48   7.909  -1.305  -9.456
  907   2HB   GLN  48          1HB       GLN  48   8.493  -0.111  -8.293
  908   1HG   GLN  48          2HG       GLN  48   9.040   1.422 -10.126
  909   2HG   GLN  48          1HG       GLN  48   8.577   0.232 -11.304
  910   1HE2  GLN  48          2HE2      GLN  48   5.809   2.653  -9.713
  911   2HE2  GLN  48          1HE2      GLN  48   7.363   3.030 -10.281
  912    H    VAL  49           H        VAL  49  12.439  -1.150  -9.201
  913    HA   VAL  49           HA       VAL  49  12.651  -2.677  -6.828
  914    HB   VAL  49           HB       VAL  49  14.860  -0.798  -7.363
  915   1HG1  VAL  49          3HG1      VAL  49  14.569  -3.793  -7.093
  916   2HG1  VAL  49          1HG1      VAL  49  16.116  -2.958  -7.255
  917   3HG1  VAL  49          2HG1      VAL  49  15.098  -2.666  -5.843
  918   1HG2  VAL  49          1HG2      VAL  49  13.728  -2.536  -9.539
  919   2HG2  VAL  49          2HG2      VAL  49  14.590  -1.010  -9.688
  920   3HG2  VAL  49          3HG2      VAL  49  15.478  -2.493  -9.358
  921    H    CYS  50           H        CYS  50  13.489  -1.888  -4.731
  922    HA   CYS  50           HA       CYS  50  12.365   0.796  -4.081
  923   1HB   CYS  50          1HB       CYS  50  11.519  -1.453  -3.024
  924   2HB   CYS  50          2HB       CYS  50  12.966  -1.339  -2.062
  925    H    ALA  51           H        ALA  51  13.560   1.797  -2.080
  926    HA   ALA  51           HA       ALA  51  16.306   0.990  -1.639
  927   1HB   ALA  51          2HB       ALA  51  15.680   3.130  -3.634
  928   2HB   ALA  51          3HB       ALA  51  17.082   3.348  -2.590
  929   3HB   ALA  51          1HB       ALA  51  16.980   1.939  -3.643
  930    H    ASN  52           H        ASN  52  13.793   2.000  -0.206
  931    HA   ASN  52           HA       ASN  52  13.465   3.136   1.811
  932   1HB   ASN  52          1HB       ASN  52  15.794   2.198   2.235
  933   2HB   ASN  52          2HB       ASN  52  16.421   3.760   1.696
  934   1HD2  ASN  52          2HD2      ASN  52  14.815   2.970   5.256
  935   2HD2  ASN  52          1HD2      ASN  52  13.597   3.025   4.075
  936    HA   PRO  53           HA       PRO  53  13.184   7.347   0.395
  937   1HB   PRO  53          1HB       PRO  53  11.905   8.341   2.653
  938   2HB   PRO  53          2HB       PRO  53  11.087   7.484   1.335
  939   1HG   PRO  53          1HG       PRO  53  11.674   6.555   4.085
  940   2HG   PRO  53          2HG       PRO  53  10.522   5.904   2.912
  941   1HD   PRO  53          1HD       PRO  53  13.103   4.845   3.587
  942   2HD   PRO  53          2HD       PRO  53  11.990   4.246   2.366
  943    H    GLU  54           H        GLU  54  14.064   6.831   3.835
  944    HA   GLU  54           HA       GLU  54  15.709   9.301   3.777
  945   1HB   GLU  54          1HB       GLU  54  14.014   8.614   5.649
  946   2HB   GLU  54          2HB       GLU  54  15.320   7.566   6.201
  947   1HG   GLU  54          1HG       GLU  54  16.237   9.348   7.228
  948   2HG   GLU  54          2HG       GLU  54  16.518  10.060   5.640
  949    H    LYS  55           H        LYS  55  16.790   7.124   2.293
  950    HA   LYS  55           HA       LYS  55  18.894   5.990   4.048
  951   1HB   LYS  55          1HB       LYS  55  17.691   5.238   1.495
  952   2HB   LYS  55          2HB       LYS  55  19.435   5.164   1.454
  953   1HG   LYS  55          1HG       LYS  55  17.931   3.988   3.776
  954   2HG   LYS  55          2HG       LYS  55  18.121   3.070   2.284
  955   1HD   LYS  55          1HD       LYS  55  20.364   2.764   2.598
  956   2HD   LYS  55          2HD       LYS  55  20.581   4.352   3.333
  957   1HE   LYS  55          1HE       LYS  55  19.289   3.408   5.347
  958   2HE   LYS  55          2HE       LYS  55  19.548   1.821   4.623
  959   1HZ   LYS  55          3HZ       LYS  55  22.000   2.792   4.482
  960   2HZ   LYS  55          1HZ       LYS  55  21.460   3.638   5.853
  961   3HZ   LYS  55          2HZ       LYS  55  21.429   1.940   5.837
  962    H    LYS  56           H        LYS  56  18.628   8.904   3.082
  963    HA   LYS  56           HA       LYS  56  20.097  10.613   2.495
  964   1HB   LYS  56          1HB       LYS  56  21.581   9.598   4.139
  965   2HB   LYS  56          2HB       LYS  56  22.146   8.425   2.954
  966   1HG   LYS  56          1HG       LYS  56  23.721   9.891   2.287
  967   2HG   LYS  56          2HG       LYS  56  22.450  11.011   1.797
  968   1HD   LYS  56          1HD       LYS  56  22.389  11.447   4.452
  969   2HD   LYS  56          2HD       LYS  56  24.077  10.959   4.293
  970   1HE   LYS  56          1HE       LYS  56  22.728  13.131   2.659
  971   2HE   LYS  56          2HE       LYS  56  23.800  13.413   4.031
  972   1HZ   LYS  56          1HZ       LYS  56  25.534  12.174   2.821
  973   2HZ   LYS  56          2HZ       LYS  56  24.500  12.073   1.477
  974   3HZ   LYS  56          3HZ       LYS  56  25.048  13.588   2.015
  975    H    TRP  57           H        TRP  57  22.204   8.166   1.063
  976    HA   TRP  57           HA       TRP  57  22.611   9.408  -1.371
  977   1HB   TRP  57          1HB       TRP  57  23.247   7.234  -2.259
  978   2HB   TRP  57          2HB       TRP  57  23.811   7.383  -0.591
  979    HD1  TRP  57           HD1      TRP  57  22.905   5.595   1.079
  980    HE1  TRP  57           HE1      TRP  57  21.288   3.598   0.822
  981    HE3  TRP  57           HE3      TRP  57  21.154   6.573  -3.560
  982    HZ2  TRP  57           HZ2      TRP  57  19.489   2.528  -1.183
  983    HZ3  TRP  57           HZ3      TRP  57  19.622   5.033  -4.699
  984    HH2  TRP  57           HH2      TRP  57  18.766   3.013  -3.521
  985    H    VAL  58           H        VAL  58  19.766   7.481  -0.525
  986    HA   VAL  58           HA       VAL  58  18.737   7.102  -3.130
  987    HB   VAL  58           HB       VAL  58  16.427   7.485  -1.891
  988   1HG1  VAL  58          1HG1      VAL  58  17.770   5.364  -2.679
  989   2HG1  VAL  58          2HG1      VAL  58  17.978   5.128  -0.943
  990   3HG1  VAL  58          3HG1      VAL  58  16.358   5.209  -1.640
  991   1HG2  VAL  58          2HG2      VAL  58  17.621   8.487   0.092
  992   2HG2  VAL  58          3HG2      VAL  58  16.487   7.183   0.442
  993   3HG2  VAL  58          1HG2      VAL  58  18.221   6.865   0.431
  994    H    ARG  59           H        ARG  59  18.224   9.938  -0.988
  995    HA   ARG  59           HA       ARG  59  16.603  11.321  -2.927
  996   1HB   ARG  59          1HB       ARG  59  17.251  13.380  -1.563
  997   2HB   ARG  59          2HB       ARG  59  16.446  12.106  -0.682
  998   1HG   ARG  59          2HG       ARG  59  18.423  11.415   0.375
  999   2HG   ARG  59          1HG       ARG  59  19.442  12.173  -0.826
 1000   1HD   ARG  59          1HD       ARG  59  17.653  14.036   0.594
 1001   2HD   ARG  59          2HD       ARG  59  18.863  13.266   1.618
 1002    HE   ARG  59           HE       ARG  59  19.953  14.358  -0.868
 1003   1HH1  ARG  59          2HH2      ARG  59  20.427  14.173   2.397
 1004   2HH1  ARG  59          1HH2      ARG  59  20.729  15.854   2.684
 1005   1HH2  ARG  59          2HH1      ARG  59  19.625  17.097  -0.054
 1006   2HH2  ARG  59          1HH1      ARG  59  21.300  16.967   0.367
 1007    H    GLU  60           H        GLU  60  20.060  11.083  -2.351
 1008    HA   GLU  60           HA       GLU  60  20.842  13.235  -4.114
 1009   1HB   GLU  60          2HB       GLU  60  22.198  10.916  -2.826
 1010   2HB   GLU  60          1HB       GLU  60  22.977  11.609  -4.228
 1011   1HG   GLU  60          2HG       GLU  60  22.428  13.885  -2.954
 1012   2HG   GLU  60          1HG       GLU  60  22.464  12.833  -1.560
 1013    H    TYR  61           H        TYR  61  19.566  10.102  -4.631
 1014    HA   TYR  61           HA       TYR  61  20.601   9.905  -7.392
 1015   1HB   TYR  61          1HB       TYR  61  19.289   8.086  -5.450
 1016   2HB   TYR  61          2HB       TYR  61  18.848   7.843  -7.122
 1017    HD1  TYR  61           HD2      TYR  61  21.735   8.034  -4.775
 1018    HD2  TYR  61           HD1      TYR  61  20.365   6.866  -8.695
 1019    HE1  TYR  61           HE2      TYR  61  23.885   6.846  -5.167
 1020    HE2  TYR  61           HE1      TYR  61  22.510   5.668  -9.082
 1021    HH   TYR  61           HH       TYR  61  25.225   6.191  -7.504
 1022    H    ILE  62           H        ILE  62  17.722  10.654  -5.550
 1023    HA   ILE  62           HA       ILE  62  15.796  10.526  -7.647
 1024    HB   ILE  62           HB       ILE  62  15.946  12.275  -5.172
 1025   1HG1  ILE  62          2HG1      ILE  62  14.321   9.786  -5.733
 1026   2HG1  ILE  62          1HG1      ILE  62  15.853   9.767  -4.898
 1027   1HG2  ILE  62          1HG2      ILE  62  14.188  12.446  -7.417
 1028   2HG2  ILE  62          2HG2      ILE  62  13.271  11.804  -6.054
 1029   3HG2  ILE  62          3HG2      ILE  62  14.114  13.346  -5.903
 1030   1HD1  ILE  62          3HD1      ILE  62  14.707  11.628  -3.405
 1031   2HD1  ILE  62          1HD1      ILE  62  13.225  10.879  -3.998
 1032   3HD1  ILE  62          2HD1      ILE  62  14.398   9.920  -3.095
 1033    H    ASN  63           H        ASN  63  17.915  13.181  -6.560
 1034    HA   ASN  63           HA       ASN  63  16.922  14.919  -8.726
 1035   1HB   ASN  63          1HB       ASN  63  18.117  15.358  -6.216
 1036   2HB   ASN  63          2HB       ASN  63  19.295  15.895  -7.388
 1037   1HD2  ASN  63          1HD2      ASN  63  17.801  18.569  -8.568
 1038   2HD2  ASN  63          2HD2      ASN  63  18.756  18.405  -7.175
 1039    H    SER  64           H        SER  64  19.763  12.972  -7.954
 1040    HA   SER  64           HA       SER  64  21.513  13.960  -9.966
 1041   1HB   SER  64          1HB       SER  64  22.342  12.455  -8.253
 1042   2HB   SER  64          2HB       SER  64  21.244  11.181  -8.783
 1043    HG   SER  64           HG       SER  64  23.623  12.060  -9.884
 1044    H    LEU  65           H        LEU  65  18.706  11.898 -10.163
 1045    HA   LEU  65           HA       LEU  65  19.333  10.852 -12.812
 1046   1HB   LEU  65          1HB       LEU  65  16.893  10.836 -11.052
 1047   2HB   LEU  65          2HB       LEU  65  16.792  10.301 -12.712
 1048    HG   LEU  65           HG       LEU  65  18.934   9.230 -10.888
 1049   1HD1  LEU  65          3HD1      LEU  65  16.566   8.960  -9.914
 1050   2HD1  LEU  65          1HD1      LEU  65  16.247   7.906 -11.291
 1051   3HD1  LEU  65          2HD1      LEU  65  17.508   7.484 -10.131
 1052   1HD2  LEU  65          1HD2      LEU  65  18.427   8.942 -13.580
 1053   2HD2  LEU  65          2HD2      LEU  65  19.341   7.795 -12.602
 1054   3HD2  LEU  65          3HD2      LEU  65  17.624   7.526 -12.901
 1055    H    GLU  66           H        GLU  66  16.400  12.684 -11.971
 1056    HA   GLU  66           HA       GLU  66  16.384  13.933 -14.605
 1057   1HB   GLU  66          1HB       GLU  66  14.488  13.441 -12.589
 1058   2HB   GLU  66          2HB       GLU  66  14.617  15.197 -12.681
 1059   1HG   GLU  66          1HG       GLU  66  12.962  14.606 -14.292
 1060   2HG   GLU  66          2HG       GLU  66  14.426  14.922 -15.225
 1061    H    MET  67           H        MET  67  15.561  16.539 -14.069
 1062    HA   MET  67           HA       MET  67  18.109  17.716 -13.070
 1063   1HB   MET  67          1HB       MET  67  15.972  18.645 -14.974
 1064   2HB   MET  67          2HB       MET  67  17.026  19.823 -14.192
 1065   1HG   MET  67          1HG       MET  67  18.091  17.402 -15.664
 1066   2HG   MET  67          2HG       MET  67  17.830  18.958 -16.453
 1067   1HE   MET  67          1HE       MET  67  20.281  17.532 -16.601
 1068   2HE   MET  67          3HE       MET  67  20.630  19.202 -17.047
 1069   3HE   MET  67          2HE       MET  67  21.676  18.359 -15.905
 1070    H    SER  68           H        SER  68  14.693  17.518 -12.416
 1071    HA   SER  68           HA       SER  68  14.959  18.546  -9.770
 1072   1HB   SER  68          1HB       SER  68  13.428  20.646 -10.384
 1073   2HB   SER  68          2HB       SER  68  15.188  20.754 -10.416
 1074    HG   SER  68           HG       SER  68  14.197  21.542 -12.338
   
  No H/Q in entry =        1074