*HEADER    TOXIN                                   19-JUL-01   1JMP              
*TITLE     SOLUTION STRUCTURE OF THE VISCOTOXIN B                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: VISCOTOXIN B;                                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: VISCUM ALBUM;                                   
*SOURCE   3 ORGANISM_COMMON: EUROPEAN MISTLETOE;                                 
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA                                   
*KEYWDS    THIONIN, NMR, VISCOTOXIN, VISCUM ALBUM                                
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    A.COULON, A.MOSBAH, C.BERNARD, P.ROUGE, K.URECH, H.DARBON             
*REVDAT   1   11-NOV-03 1JMP    0                                                

 assign (resid    1 and  name HA   )(resid    1 and  name HD1  ) 4.7 2.9 0.0
 assign (resid    1 and  name HA   )(resid    1 and  name HD2  ) 4.7 2.9 0.0
 assign (resid    1 and  name HA   )(resid    1 and  name HD*  ) 4.5 2.7 0.0
 assign (resid    1 and  name HA   )(resid    1 and  name HE*  ) 7.0 5.2 0.0
 assign (resid    1 and  name HB1  )(resid    1 and  name HE*  ) 7.0 5.2 0.0
 assign (resid    1 and  name HB2  )(resid    1 and  name HE*  ) 7.0 5.2 0.0
 assign (resid    1 and  name HB*  )(resid    1 and  name HD*  ) 3.6 1.8 0.0
 assign (resid    1 and  name HB*  )(resid    2 and  name HA   ) 4.7 2.9 0.0
 assign (resid    1 and  name HG*  )(resid    2 and  name HN   ) 6.9 5.1 0.0
 assign (resid    1 and  name HD*  )(resid    2 and  name HN   ) 6.8 5.0 0.0
 assign (resid    1 and  name HE*  )(resid    2 and  name HA   ) 5.4 3.6 0.0
 assign (resid    1 and  name HZ*  )(resid   10 and  name HE   ) 4.5 2.7 0.0
 assign (resid    2 and  name HN   )(resid    2 and  name HA   ) 2.8 1.0 0.0
 assign (resid    2 and  name HN   )(resid    2 and  name HB*  ) 3.7 1.9 0.0
 assign (resid    2 and  name HN   )(resid   34 and  name HD*  ) 7.0 5.2 0.0
 assign (resid    2 and  name HA   )(resid    2 and  name HB1  ) 2.8 1.0 0.0
 assign (resid    2 and  name HA   )(resid    2 and  name HB2  ) 2.8 1.0 0.0
 assign (resid    2 and  name HA   )(resid    3 and  name HN   ) 2.4 0.6 0.0
 assign (resid    2 and  name HA   )(resid   34 and  name HA   ) 4.1 2.3 0.0
 assign (resid    2 and  name HA   )(resid   35 and  name HN   ) 3.4 1.6 0.0
 assign (resid    2 and  name HA   )(resid   35 and  name HD2  ) 5.4 3.6 0.0
 assign (resid    2 and  name HA   )(resid   35 and  name HD3  ) 3.9 2.1 0.0
 assign (resid    2 and  name HB1  )(resid   34 and  name HD*  ) 5.1 3.3 0.0
 assign (resid    2 and  name HB2  )(resid   34 and  name HD*  ) 5.1 3.3 0.0
 assign (resid    2 and  name HB*  )(resid    3 and  name HN   ) 4.4 2.6 0.0
 assign (resid    2 and  name HB*  )(resid   34 and  name HD*  ) 4.9 3.1 0.0
 assign (resid    3 and  name N    )(resid   33 and  name O    ) 3.0 1.2 0.0
 assign (resid    3 and  name HN   )(resid    3 and  name HB1  ) 3.8 2.0 0.0
 assign (resid    3 and  name HN   )(resid    3 and  name HB2  ) 3.8 2.0 0.0
 assign (resid    3 and  name HN   )(resid    4 and  name HN   ) 5.0 3.2 0.0
 assign (resid    3 and  name HN   )(resid   14 and  name HD*  ) 7.7 5.9 0.0
 assign (resid    3 and  name HN   )(resid   32 and  name HB*  ) 6.9 5.1 0.0
 assign (resid    3 and  name HN   )(resid   33 and  name HN   ) 3.6 1.8 0.0
 assign (resid    3 and  name HN   )(resid   33 and  name HB*  ) 6.9 5.1 0.0
 assign (resid    3 and  name HN   )(resid   33 and  name HD*  ) 7.0 5.2 0.0
 assign (resid    3 and  name HN   )(resid   33 and  name O    ) 2.0 0.2 0.0
 assign (resid    3 and  name HN   )(resid   34 and  name HA   ) 3.5 1.7 0.0
 assign (resid    3 and  name HN   )(resid   35 and  name HN   ) 3.8 2.0 0.0
 assign (resid    3 and  name HN   )(resid   35 and  name HD*  ) 6.3 4.5 0.0
 assign (resid    3 and  name HA   )(resid    4 and  name HN   ) 2.9 1.1 0.0
 assign (resid    3 and  name CB   )(resid   40 and  name SG   ) 3.1 1.3 0.0
 assign (resid    3 and  name HB1  )(resid   41 and  name HD1  ) 7.5 5.7 0.0
 assign (resid    3 and  name HB1  )(resid   41 and  name HD2  ) 7.5 5.7 0.0
 assign (resid    3 and  name HB1  )(resid   44 and  name CG   ) 6.7 4.9 0.0
 assign (resid    3 and  name HB1  )(resid   44 and  name CZ   ) 8.0 6.2 0.0
 assign (resid    3 and  name HB2  )(resid   41 and  name HD1  ) 7.5 5.7 0.0
 assign (resid    3 and  name HB2  )(resid   41 and  name HD2  ) 7.5 5.7 0.0
 assign (resid    3 and  name HB2  )(resid   44 and  name CG   ) 6.7 4.9 0.0
 assign (resid    3 and  name HB2  )(resid   44 and  name CZ   ) 8.0 6.2 0.0
 assign (resid    3 and  name HB*  )(resid    4 and  name HN   ) 4.5 2.7 0.0
 assign (resid    3 and  name HB*  )(resid    4 and  name HA   ) 5.6 3.8 0.0
 assign (resid    3 and  name HB*  )(resid   33 and  name HN   ) 6.9 5.1 0.0
 assign (resid    3 and  name HB*  )(resid   35 and  name HD2  ) 6.9 5.1 0.0
 assign (resid    3 and  name HB*  )(resid   35 and  name HD3  ) 6.3 4.5 0.0
 assign (resid    3 and  name HB*  )(resid   41 and  name HD*  ) 5.9 4.1 0.0
 assign (resid    3 and  name HB*  )(resid   44 and  name CG   ) 6.4 4.6 0.0
 assign (resid    3 and  name HB*  )(resid   44 and  name CZ   ) 7.7 5.9 0.0
 assign (resid    3 and  name SG   )(resid   40 and  name CB   ) 3.1 1.3 0.0
 assign (resid    3 and  name SG   )(resid   40 and  name SG   ) 2.1 0.3 0.0
 assign (resid    3 and  name O    )(resid   33 and  name N    ) 3.0 1.2 0.0
 assign (resid    3 and  name O    )(resid   33 and  name HN   ) 2.0 0.2 0.0
 assign (resid    4 and  name HN   )(resid    4 and  name HB*  ) 3.5 1.7 0.0
 assign (resid    4 and  name HN   )(resid   10 and  name HE   ) 6.0 4.2 0.0
 assign (resid    4 and  name HN   )(resid   32 and  name HB*  ) 6.9 5.1 0.0
 assign (resid    4 and  name HN   )(resid   46 and  name HN   ) 3.4 1.6 0.0
 assign (resid    4 and  name HA   )(resid    5 and  name HD1  ) 3.3 1.5 0.0
 assign (resid    4 and  name HA   )(resid    5 and  name HD2  ) 3.3 1.5 0.0
 assign (resid    4 and  name HA   )(resid    5 and  name HD*  ) 3.1 1.3 0.0
 assign (resid    4 and  name HA   )(resid   32 and  name HA   ) 6.0 4.2 0.0
 assign (resid    4 and  name HA   )(resid   32 and  name HB*  ) 4.8 3.0 0.0
 assign (resid    4 and  name HA   )(resid   33 and  name HN   ) 3.9 2.1 0.0
 assign (resid    4 and  name HA   )(resid   44 and  name CG   ) 5.9 4.1 0.0
 assign (resid    4 and  name HA   )(resid   44 and  name CZ   ) 7.6 5.8 0.0
 assign (resid    4 and  name CB   )(resid   32 and  name SG   ) 3.1 1.3 0.0
 assign (resid    4 and  name HB*  )(resid    5 and  name HA   ) 5.5 3.7 0.0
 assign (resid    4 and  name HB*  )(resid   10 and  name HN   ) 5.8 4.0 0.0
 assign (resid    4 and  name HB*  )(resid   10 and  name HG*  ) 7.6 5.8 0.0
 assign (resid    4 and  name HB*  )(resid   10 and  name HE   ) 6.9 5.1 0.0
 assign (resid    4 and  name HB*  )(resid   46 and  name HN   ) 7.0 5.2 0.0
 assign (resid    4 and  name HB*  )(resid   46 and  name HB*  ) 6.3 4.5 0.0
 assign (resid    4 and  name SG   )(resid   32 and  name CB   ) 3.1 1.3 0.0
 assign (resid    4 and  name SG   )(resid   32 and  name SG   ) 2.1 0.3 0.0
 assign (resid    5 and  name HA   )(resid   44 and  name HB1  ) 3.5 1.7 0.0
 assign (resid    5 and  name HA   )(resid   44 and  name HB2  ) 3.5 1.7 0.0
 assign (resid    5 and  name HB*  )(resid    6 and  name HN   ) 4.2 2.4 0.0
 assign (resid    5 and  name HG*  )(resid    6 and  name HD21 ) 7.0 5.2 0.0
 assign (resid    5 and  name HG*  )(resid    6 and  name HD22 ) 7.0 5.2 0.0
 assign (resid    5 and  name HG*  )(resid    6 and  name HD*  ) 6.8 5.0 0.0
 assign (resid    5 and  name HG*  )(resid   44 and  name CG   ) 7.2 5.4 0.0
 assign (resid    5 and  name HG*  )(resid   44 and  name CZ   ) 8.3 6.5 0.0
 assign (resid    5 and  name HD1  )(resid   32 and  name HA   ) 4.2 2.4 0.0
 assign (resid    5 and  name HD2  )(resid   32 and  name HA   ) 4.2 2.4 0.0
 assign (resid    5 and  name HD*  )(resid    6 and  name HN   ) 4.2 2.4 0.0
 assign (resid    5 and  name HD*  )(resid   32 and  name HA   ) 3.8 2.0 0.0
 assign (resid    5 and  name HD*  )(resid   44 and  name CG   ) 7.0 5.2 0.0
 assign (resid    5 and  name HD*  )(resid   44 and  name CZ   ) 7.9 6.1 0.0
 assign (resid    6 and  name HN   )(resid    6 and  name HD*  ) 5.6 3.8 0.0
 assign (resid    6 and  name HN   )(resid    9 and  name HN   ) 4.0 2.2 0.0
 assign (resid    6 and  name HN   )(resid   10 and  name HN   ) 4.0 2.2 0.0
 assign (resid    6 and  name HN   )(resid   46 and  name HB*  ) 6.7 4.9 0.0
 assign (resid    6 and  name HA   )(resid    9 and  name HN   ) 5.7 3.9 0.0
 assign (resid    6 and  name O    )(resid    9 and  name N    ) 3.0 1.2 0.0
 assign (resid    6 and  name O    )(resid    9 and  name HN   ) 2.0 0.2 0.0
 assign (resid    7 and  name HA   )(resid    7 and  name HB   ) 3.0 1.2 0.0
 assign (resid    7 and  name HB   )(resid   10 and  name HB*  ) 4.7 2.9 0.0
 assign (resid    7 and  name HB   )(resid   10 and  name HG*  ) 6.0 4.2 0.0
 assign (resid    7 and  name HG*  )(resid   10 and  name HB*  ) 7.3 5.5 0.0
 assign (resid    7 and  name O    )(resid   11 and  name N    ) 3.0 1.2 0.0
 assign (resid    7 and  name O    )(resid   11 and  name HN   ) 2.0 0.2 0.0
 assign (resid    8 and  name HN   )(resid    9 and  name HN   ) 3.9 2.1 0.0
 assign (resid    8 and  name HA   )(resid    9 and  name HN   ) 3.6 1.8 0.0
 assign (resid    8 and  name HB   )(resid    9 and  name HN   ) 4.2 2.4 0.0
 assign (resid    8 and  name HB   )(resid   11 and  name HD*  ) 6.8 5.0 0.0
 assign (resid    8 and  name HB   )(resid   12 and  name HN   ) 5.9 4.1 0.0
 assign (resid    8 and  name HG*  )(resid    9 and  name HN   ) 7.0 5.2 0.0
 assign (resid    8 and  name HG*  )(resid   11 and  name HN   ) 7.0 5.2 0.0
 assign (resid    8 and  name HG*  )(resid   11 and  name HD21 ) 5.6 3.8 0.0
 assign (resid    8 and  name HG*  )(resid   11 and  name HD22 ) 5.6 3.8 0.0
 assign (resid    8 and  name HG*  )(resid   11 and  name HD*  ) 5.1 3.3 0.0
 assign (resid    9 and  name HN   )(resid   10 and  name HN   ) 3.0 1.2 0.0
 assign (resid    9 and  name HN   )(resid   11 and  name HN   ) 3.8 2.0 0.0
 assign (resid    9 and  name HN   )(resid   14 and  name HD*  ) 7.9 6.1 0.0
 assign (resid    9 and  name HA*  )(resid   11 and  name HN   ) 6.0 4.2 0.0
 assign (resid    9 and  name HA*  )(resid   12 and  name HN   ) 5.2 3.4 0.0
 assign (resid    9 and  name O    )(resid   13 and  name N    ) 3.0 1.2 0.0
 assign (resid    9 and  name O    )(resid   13 and  name HN   ) 2.0 0.2 0.0
 assign (resid   10 and  name HN   )(resid   10 and  name HB*  ) 3.4 1.6 0.0
 assign (resid   10 and  name HN   )(resid   10 and  name HG*  ) 4.3 2.5 0.0
 assign (resid   10 and  name HN   )(resid   10 and  name HD1  ) 6.0 4.2 0.0
 assign (resid   10 and  name HN   )(resid   10 and  name HD2  ) 6.0 4.2 0.0
 assign (resid   10 and  name HN   )(resid   11 and  name HN   ) 3.0 1.2 0.0
 assign (resid   10 and  name HN   )(resid   12 and  name HN   ) 4.7 2.9 0.0
 assign (resid   10 and  name HA   )(resid   10 and  name HD1  ) 4.2 2.4 0.0
 assign (resid   10 and  name HA   )(resid   10 and  name HD2  ) 4.2 2.4 0.0
 assign (resid   10 and  name HA   )(resid   10 and  name HD*  ) 3.7 1.9 0.0
 assign (resid   10 and  name HA   )(resid   10 and  name HE   ) 4.8 3.0 0.0
 assign (resid   10 and  name HA   )(resid   13 and  name HN   ) 3.8 2.0 0.0
 assign (resid   10 and  name HA   )(resid   13 and  name HB*  ) 4.7 2.9 0.0
 assign (resid   10 and  name HB1  )(resid   10 and  name HE   ) 4.4 2.6 0.0
 assign (resid   10 and  name HB2  )(resid   10 and  name HE   ) 4.4 2.6 0.0
 assign (resid   10 and  name HB*  )(resid   10 and  name HE   ) 3.8 2.0 0.0
 assign (resid   10 and  name HB*  )(resid   11 and  name HN   ) 4.1 2.3 0.0
 assign (resid   10 and  name HG*  )(resid   11 and  name HN   ) 6.0 4.2 0.0
 assign (resid   10 and  name HG*  )(resid   14 and  name HD21 ) 7.0 5.2 0.0
 assign (resid   10 and  name HG*  )(resid   14 and  name HD22 ) 7.0 5.2 0.0
 assign (resid   10 and  name HG*  )(resid   14 and  name HD*  ) 6.8 5.0 0.0
 assign (resid   10 and  name HD1  )(resid   14 and  name HD21 ) 6.0 4.2 0.0
 assign (resid   10 and  name HD1  )(resid   14 and  name HD22 ) 6.0 4.2 0.0
 assign (resid   10 and  name HD2  )(resid   14 and  name HD21 ) 6.0 4.2 0.0
 assign (resid   10 and  name HD2  )(resid   14 and  name HD22 ) 6.0 4.2 0.0
 assign (resid   10 and  name HD*  )(resid   13 and  name HN   ) 6.9 5.1 0.0
 assign (resid   10 and  name HD*  )(resid   14 and  name HD*  ) 4.4 2.6 0.0
 assign (resid   10 and  name HE   )(resid   14 and  name HD*  ) 6.9 5.1 0.0
 assign (resid   10 and  name HE   )(resid   46 and  name HA   ) 7.0 5.2 0.0
 assign (resid   10 and  name O    )(resid   14 and  name N    ) 3.0 1.2 0.0
 assign (resid   10 and  name O    )(resid   14 and  name HN   ) 2.0 0.2 0.0
 assign (resid   11 and  name HN   )(resid   11 and  name HB1  ) 3.4 1.6 0.0
 assign (resid   11 and  name HN   )(resid   11 and  name HB2  ) 3.4 1.6 0.0
 assign (resid   11 and  name HN   )(resid   11 and  name HD*  ) 6.9 5.1 0.0
 assign (resid   11 and  name HN   )(resid   13 and  name HN   ) 4.6 2.8 0.0
 assign (resid   11 and  name HA   )(resid   11 and  name HB1  ) 3.0 1.2 0.0
 assign (resid   11 and  name HA   )(resid   11 and  name HB2  ) 3.0 1.2 0.0
 assign (resid   11 and  name HA   )(resid   12 and  name HN   ) 3.6 1.8 0.0
 assign (resid   11 and  name HA   )(resid   14 and  name HN   ) 3.8 2.0 0.0
 assign (resid   11 and  name HA   )(resid   15 and  name HN   ) 3.5 1.7 0.0
 assign (resid   11 and  name HB1  )(resid   12 and  name HN   ) 3.6 1.8 0.0
 assign (resid   11 and  name HB2  )(resid   12 and  name HN   ) 3.6 1.8 0.0
 assign (resid   11 and  name HB*  )(resid   12 and  name HN   ) 3.4 1.6 0.0
 assign (resid   11 and  name O    )(resid   15 and  name N    ) 3.0 1.2 0.0
 assign (resid   11 and  name O    )(resid   15 and  name HN   ) 2.0 0.2 0.0
 assign (resid   12 and  name HN   )(resid   12 and  name HB   ) 2.5 0.7 0.0
 assign (resid   12 and  name HN   )(resid   12 and  name HG*  ) 4.2 2.4 0.0
 assign (resid   12 and  name HN   )(resid   12 and  name HG*  ) 5.0 3.2 0.0
 assign (resid   12 and  name HN   )(resid   12 and  name HD2  ) 3.7 1.9 0.0
 assign (resid   12 and  name HN   )(resid   12 and  name HD3  ) 4.0 2.2 0.0
 assign (resid   12 and  name HN   )(resid   13 and  name HN   ) 2.8 1.0 0.0
 assign (resid   12 and  name HN   )(resid   14 and  name HD*  ) 6.9 5.1 0.0
 assign (resid   12 and  name HA   )(resid   12 and  name HD*  ) 4.0 2.2 0.0
 assign (resid   12 and  name HA   )(resid   15 and  name HN   ) 3.6 1.8 0.0
 assign (resid   12 and  name HA   )(resid   16 and  name HN   ) 3.5 1.7 0.0
 assign (resid   12 and  name HA   )(resid   26 and  name HB*  ) 5.5 3.7 0.0
 assign (resid   12 and  name HA   )(resid   30 and  name HB*  ) 6.4 4.6 0.0
 assign (resid   12 and  name HB   )(resid   12 and  name HD*  ) 3.4 1.6 0.0
 assign (resid   12 and  name HB   )(resid   13 and  name HN   ) 2.9 1.1 0.0
 assign (resid   12 and  name HB   )(resid   30 and  name HB1  ) 4.5 2.7 0.0
 assign (resid   12 and  name HB   )(resid   30 and  name HB2  ) 4.5 2.7 0.0
 assign (resid   12 and  name HB   )(resid   30 and  name HB*  ) 4.2 2.4 0.0
 assign (resid   12 and  name HG*  )(resid   29 and  name HN   ) 7.0 5.2 0.0
 assign (resid   12 and  name HD*  )(resid   13 and  name HN   ) 5.9 4.1 0.0
 assign (resid   12 and  name HD*  )(resid   30 and  name HB1  ) 4.8 3.0 0.0
 assign (resid   12 and  name HD*  )(resid   30 and  name HB2  ) 4.8 3.0 0.0
 assign (resid   12 and  name HD*  )(resid   30 and  name HB*  ) 4.4 2.6 0.0
 assign (resid   12 and  name HD3  )(resid   32 and  name HN   ) 7.0 5.2 0.0
 assign (resid   12 and  name O    )(resid   16 and  name N    ) 3.0 1.2 0.0
 assign (resid   12 and  name O    )(resid   16 and  name HN   ) 2.0 0.2 0.0
 assign (resid   13 and  name HN   )(resid   13 and  name HB1  ) 2.8 1.0 0.0
 assign (resid   13 and  name HN   )(resid   13 and  name HB2  ) 2.8 1.0 0.0
 assign (resid   13 and  name HN   )(resid   13 and  name HB*  ) 2.6 0.8 0.0
 assign (resid   13 and  name HN   )(resid   14 and  name HN   ) 3.0 1.2 0.0
 assign (resid   13 and  name HN   )(resid   26 and  name HB*  ) 4.1 2.3 0.0
 assign (resid   13 and  name HN   )(resid   30 and  name HB*  ) 4.6 2.8 0.0
 assign (resid   13 and  name HN   )(resid   32 and  name HB*  ) 6.9 5.1 0.0
 assign (resid   13 and  name HB*  )(resid   14 and  name HB*  ) 5.8 4.0 0.0
 assign (resid   13 and  name HB*  )(resid   16 and  name HB*  ) 5.5 3.7 0.0
 assign (resid   13 and  name HB*  )(resid   17 and  name HN   ) 6.9 5.1 0.0
 assign (resid   13 and  name HB*  )(resid   31 and  name HN   ) 6.9 5.1 0.0
 assign (resid   13 and  name HB*  )(resid   33 and  name HN   ) 7.1 5.3 0.0
 assign (resid   13 and  name CG   )(resid   14 and  name HN   ) 7.4 5.6 0.0
 assign (resid   13 and  name CG   )(resid   17 and  name HB*  ) 8.9 7.1 0.0
 assign (resid   13 and  name CG   )(resid   26 and  name HB1  ) 8.0 6.2 0.0
 assign (resid   13 and  name CG   )(resid   26 and  name HB2  ) 8.0 6.2 0.0
 assign (resid   13 and  name CG   )(resid   27 and  name HA   ) 6.5 4.7 0.0
 assign (resid   13 and  name CG   )(resid   27 and  name HB*  ) 9.0 7.2 0.0
 assign (resid   13 and  name CG   )(resid   30 and  name HA   ) 8.3 6.5 0.0
 assign (resid   13 and  name CG   )(resid   32 and  name HB*  ) 8.9 7.1 0.0
 assign (resid   13 and  name CG   )(resid   34 and  name HD*  ) 9.0 7.2 0.0
 assign (resid   13 and  name CZ   )(resid   17 and  name HB1  ) 8.0 6.2 0.0
 assign (resid   13 and  name CZ   )(resid   17 and  name HB2  ) 8.0 6.2 0.0
 assign (resid   13 and  name CZ   )(resid   17 and  name HG1  ) 8.0 6.2 0.0
 assign (resid   13 and  name CZ   )(resid   17 and  name HG2  ) 8.0 6.2 0.0
 assign (resid   13 and  name CZ   )(resid   17 and  name HG*  ) 7.6 5.8 0.0
 assign (resid   13 and  name CZ   )(resid   26 and  name HN   ) 8.0 6.2 0.0
 assign (resid   13 and  name CZ   )(resid   26 and  name HB1  ) 6.9 5.1 0.0
 assign (resid   13 and  name CZ   )(resid   26 and  name HB2  ) 6.9 5.1 0.0
 assign (resid   13 and  name CZ   )(resid   26 and  name HB*  ) 6.3 4.5 0.0
 assign (resid   13 and  name CZ   )(resid   27 and  name HN   ) 6.7 4.9 0.0
 assign (resid   13 and  name CZ   )(resid   27 and  name HA   ) 6.6 4.8 0.0
 assign (resid   13 and  name CZ   )(resid   27 and  name HB*  ) 8.3 6.5 0.0
 assign (resid   13 and  name CZ   )(resid   33 and  name HE*  ) 8.9 7.1 0.0
 assign (resid   13 and  name CZ   )(resid   34 and  name HD*  ) 7.4 5.6 0.0
 assign (resid   13 and  name O    )(resid   17 and  name N    ) 3.0 1.2 0.0
 assign (resid   13 and  name O    )(resid   17 and  name HN   ) 2.0 0.2 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HA   ) 2.9 1.1 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HB1  ) 3.4 1.6 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HB2  ) 3.4 1.6 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HB*  ) 3.0 1.2 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HD21 ) 6.0 4.2 0.0
 assign (resid   14 and  name HN   )(resid   14 and  name HD22 ) 6.0 4.2 0.0
 assign (resid   14 and  name HN   )(resid   15 and  name HN   ) 2.9 1.1 0.0
 assign (resid   14 and  name HA   )(resid   14 and  name HD21 ) 6.0 4.2 0.0
 assign (resid   14 and  name HA   )(resid   14 and  name HD22 ) 6.0 4.2 0.0
 assign (resid   14 and  name HA   )(resid   17 and  name HN   ) 4.2 2.4 0.0
 assign (resid   14 and  name HA   )(resid   18 and  name HN   ) 4.8 3.0 0.0
 assign (resid   14 and  name HB1  )(resid   15 and  name HN   ) 3.5 1.7 0.0
 assign (resid   14 and  name HB2  )(resid   15 and  name HN   ) 3.5 1.7 0.0
 assign (resid   14 and  name O    )(resid   18 and  name N    ) 3.0 1.2 0.0
 assign (resid   14 and  name O    )(resid   18 and  name HN   ) 2.0 0.2 0.0
 assign (resid   15 and  name HN   )(resid   15 and  name HA   ) 2.9 1.1 0.0
 assign (resid   15 and  name HN   )(resid   15 and  name HB   ) 2.9 1.1 0.0
 assign (resid   15 and  name HN   )(resid   15 and  name HG*  ) 4.7 2.9 0.0
 assign (resid   15 and  name HN   )(resid   16 and  name HN   ) 2.8 1.0 0.0
 assign (resid   15 and  name HB   )(resid   16 and  name HN   ) 4.1 2.3 0.0
 assign (resid   15 and  name HB   )(resid   18 and  name HN   ) 5.4 3.6 0.0
 assign (resid   15 and  name HB   )(resid   18 and  name HB1  ) 5.4 3.6 0.0
 assign (resid   15 and  name HB   )(resid   18 and  name HB2  ) 5.4 3.6 0.0
 assign (resid   15 and  name HB   )(resid   18 and  name HB*  ) 5.0 3.2 0.0
 assign (resid   15 and  name HB   )(resid   18 and  name HD*  ) 7.1 5.3 0.0
 assign (resid   15 and  name HG*  )(resid   16 and  name HN   ) 5.8 4.0 0.0
 assign (resid   16 and  name HN   )(resid   16 and  name HA   ) 2.8 1.0 0.0
 assign (resid   16 and  name HN   )(resid   16 and  name HB1  ) 2.7 0.9 0.0
 assign (resid   16 and  name HN   )(resid   16 and  name HB2  ) 2.7 0.9 0.0
 assign (resid   16 and  name HN   )(resid   17 and  name HN   ) 2.9 1.1 0.0
 assign (resid   16 and  name HN   )(resid   26 and  name HB*  ) 6.9 5.1 0.0
 assign (resid   16 and  name HN   )(resid   29 and  name HD*  ) 8.4 6.6 0.0
 assign (resid   16 and  name HA   )(resid   19 and  name HN   ) 3.7 1.9 0.0
 assign (resid   16 and  name CB   )(resid   26 and  name SG   ) 3.1 1.3 0.0
 assign (resid   16 and  name HB1  )(resid   17 and  name HN   ) 3.9 2.1 0.0
 assign (resid   16 and  name HB2  )(resid   17 and  name HN   ) 3.9 2.1 0.0
 assign (resid   16 and  name SG   )(resid   26 and  name CB   ) 3.1 1.3 0.0
 assign (resid   16 and  name SG   )(resid   26 and  name SG   ) 2.1 0.3 0.0
 assign (resid   16 and  name O    )(resid   19 and  name N    ) 3.0 1.2 0.0
 assign (resid   16 and  name O    )(resid   19 and  name HN   ) 2.0 0.2 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HB1  ) 3.4 1.6 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HB2  ) 3.4 1.6 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HG1  ) 3.8 2.0 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HG2  ) 3.8 2.0 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HG*  ) 3.6 1.8 0.0
 assign (resid   17 and  name HN   )(resid   17 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   17 and  name HN   )(resid   18 and  name HN   ) 2.8 1.0 0.0
 assign (resid   17 and  name HN   )(resid   19 and  name HN   ) 5.2 3.4 0.0
 assign (resid   17 and  name HN   )(resid   26 and  name HB*  ) 6.9 5.1 0.0
 assign (resid   17 and  name HA   )(resid   20 and  name HN   ) 3.7 1.9 0.0
 assign (resid   17 and  name HA   )(resid   21 and  name HN   ) 2.9 1.1 0.0
 assign (resid   17 and  name HB1  )(resid   17 and  name HG1  ) 3.0 1.2 0.0
 assign (resid   17 and  name HB1  )(resid   17 and  name HG2  ) 3.0 1.2 0.0
 assign (resid   17 and  name HB1  )(resid   18 and  name HN   ) 3.3 1.5 0.0
 assign (resid   17 and  name HB2  )(resid   17 and  name HG1  ) 3.0 1.2 0.0
 assign (resid   17 and  name HB2  )(resid   17 and  name HG2  ) 3.0 1.2 0.0
 assign (resid   17 and  name HB2  )(resid   18 and  name HN   ) 3.3 1.5 0.0
 assign (resid   17 and  name HB*  )(resid   17 and  name HG*  ) 2.5 0.7 0.0
 assign (resid   17 and  name HB*  )(resid   18 and  name HN   ) 3.0 1.2 0.0
 assign (resid   17 and  name HG*  )(resid   23 and  name HN   ) 6.9 5.1 0.0
 assign (resid   17 and  name O    )(resid   20 and  name N    ) 3.0 1.2 0.0
 assign (resid   17 and  name O    )(resid   20 and  name HN   ) 2.0 0.2 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HB1  ) 3.4 1.6 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HB2  ) 3.4 1.6 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HG   ) 3.2 1.4 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   18 and  name HN   )(resid   18 and  name HD*  ) 5.9 4.1 0.0
 assign (resid   18 and  name HN   )(resid   19 and  name HN   ) 2.9 1.1 0.0
 assign (resid   18 and  name HN   )(resid   20 and  name HN   ) 5.2 3.4 0.0
 assign (resid   18 and  name HA   )(resid   18 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   18 and  name HA   )(resid   18 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   18 and  name HA   )(resid   19 and  name HN   ) 3.4 1.6 0.0
 assign (resid   18 and  name HA   )(resid   20 and  name HN   ) 3.7 1.9 0.0
 assign (resid   18 and  name HB*  )(resid   18 and  name HG   ) 2.6 0.8 0.0
 assign (resid   18 and  name HB*  )(resid   19 and  name HN   ) 4.2 2.4 0.0
 assign (resid   18 and  name HG   )(resid   19 and  name HN   ) 6.0 4.2 0.0
 assign (resid   19 and  name HN   )(resid   19 and  name HA1  ) 2.9 1.1 0.0
 assign (resid   19 and  name HN   )(resid   19 and  name HA2  ) 2.9 1.1 0.0
 assign (resid   19 and  name HN   )(resid   20 and  name HN   ) 2.9 1.1 0.0
 assign (resid   19 and  name HN   )(resid   21 and  name HN   ) 3.8 2.0 0.0
 assign (resid   19 and  name HA1  )(resid   20 and  name HN   ) 3.6 1.8 0.0
 assign (resid   19 and  name HA2  )(resid   20 and  name HN   ) 3.6 1.8 0.0
 assign (resid   20 and  name HN   )(resid   20 and  name HA1  ) 2.8 1.0 0.0
 assign (resid   20 and  name HN   )(resid   20 and  name HA2  ) 2.8 1.0 0.0
 assign (resid   20 and  name HN   )(resid   21 and  name HN   ) 2.8 1.0 0.0
 assign (resid   21 and  name HN   )(resid   22 and  name HN   ) 4.1 2.3 0.0
 assign (resid   21 and  name HA1  )(resid   22 and  name HN   ) 3.5 1.7 0.0
 assign (resid   21 and  name HA2  )(resid   22 and  name HN   ) 3.5 1.7 0.0
 assign (resid   22 and  name HN   )(resid   22 and  name HB1  ) 3.7 1.9 0.0
 assign (resid   22 and  name HN   )(resid   22 and  name HB2  ) 3.7 1.9 0.0
 assign (resid   22 and  name HN   )(resid   22 and  name HB*  ) 3.4 1.6 0.0
 assign (resid   22 and  name HN   )(resid   23 and  name HN   ) 5.3 3.5 0.0
 assign (resid   22 and  name HN   )(resid   25 and  name HN   ) 4.5 2.7 0.0
 assign (resid   22 and  name HN   )(resid   25 and  name HB*  ) 3.8 2.0 0.0
 assign (resid   22 and  name HA   )(resid   23 and  name HN   ) 3.1 1.3 0.0
 assign (resid   22 and  name HA   )(resid   24 and  name HN   ) 4.2 2.4 0.0
 assign (resid   22 and  name HB1  )(resid   23 and  name HN   ) 3.2 1.4 0.0
 assign (resid   22 and  name HB1  )(resid   24 and  name HN   ) 3.9 2.1 0.0
 assign (resid   22 and  name HB2  )(resid   23 and  name HN   ) 3.2 1.4 0.0
 assign (resid   22 and  name HB2  )(resid   24 and  name HN   ) 3.9 2.1 0.0
 assign (resid   22 and  name HB*  )(resid   23 and  name HN   ) 2.9 1.1 0.0
 assign (resid   22 and  name HB*  )(resid   24 and  name HN   ) 3.5 1.7 0.0
 assign (resid   23 and  name HN   )(resid   23 and  name HB1  ) 3.3 1.5 0.0
 assign (resid   23 and  name HN   )(resid   23 and  name HB2  ) 3.3 1.5 0.0
 assign (resid   23 and  name HN   )(resid   23 and  name HG*  ) 5.5 3.7 0.0
 assign (resid   23 and  name HN   )(resid   23 and  name HD1  ) 6.0 4.2 0.0
 assign (resid   23 and  name HN   )(resid   23 and  name HD2  ) 6.0 4.2 0.0
 assign (resid   23 and  name HN   )(resid   24 and  name HN   ) 3.0 1.2 0.0
 assign (resid   23 and  name HA   )(resid   23 and  name HD*  ) 6.8 5.0 0.0
 assign (resid   23 and  name HA   )(resid   24 and  name HG*  ) 5.2 3.4 0.0
 assign (resid   23 and  name HA   )(resid   26 and  name HN   ) 4.2 2.4 0.0
 assign (resid   23 and  name HA   )(resid   27 and  name HN   ) 5.4 3.6 0.0
 assign (resid   23 and  name HB*  )(resid   23 and  name HD*  ) 3.5 1.7 0.0
 assign (resid   23 and  name HB*  )(resid   24 and  name HN   ) 4.4 2.6 0.0
 assign (resid   23 and  name HB*  )(resid   34 and  name HD*  ) 5.2 3.4 0.0
 assign (resid   23 and  name HG*  )(resid   34 and  name HD*  ) 8.0 6.2 0.0
 assign (resid   23 and  name HD*  )(resid   34 and  name HD*  ) 6.7 4.9 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HA   ) 2.9 1.1 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HB1  ) 3.8 2.0 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HB2  ) 3.8 2.0 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HG1  ) 5.7 3.9 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HG2  ) 5.7 3.9 0.0
 assign (resid   24 and  name HN   )(resid   24 and  name HG*  ) 5.2 3.4 0.0
 assign (resid   24 and  name HN   )(resid   25 and  name HN   ) 3.1 1.3 0.0
 assign (resid   24 and  name HN   )(resid   27 and  name HB*  ) 7.0 5.2 0.0
 assign (resid   24 and  name HA   )(resid   24 and  name HG1  ) 3.8 2.0 0.0
 assign (resid   24 and  name HA   )(resid   24 and  name HG2  ) 3.8 2.0 0.0
 assign (resid   24 and  name HA   )(resid   27 and  name HN   ) 3.2 1.4 0.0
 assign (resid   24 and  name HA   )(resid   28 and  name HN   ) 4.3 2.5 0.0
 assign (resid   24 and  name HB1  )(resid   24 and  name HG1  ) 3.0 1.2 0.0
 assign (resid   24 and  name HB1  )(resid   24 and  name HG2  ) 3.0 1.2 0.0
 assign (resid   24 and  name HB1  )(resid   25 and  name HN   ) 4.5 2.7 0.0
 assign (resid   24 and  name HB2  )(resid   24 and  name HG1  ) 3.0 1.2 0.0
 assign (resid   24 and  name HB2  )(resid   24 and  name HG2  ) 3.0 1.2 0.0
 assign (resid   24 and  name HB2  )(resid   25 and  name HN   ) 4.5 2.7 0.0
 assign (resid   24 and  name HB*  )(resid   25 and  name HN   ) 4.1 2.3 0.0
 assign (resid   24 and  name O    )(resid   28 and  name N    ) 3.0 1.2 0.0
 assign (resid   24 and  name O    )(resid   28 and  name HN   ) 2.0 0.2 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HA   ) 2.8 1.0 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HB*  ) 3.2 1.4 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HG1  ) 6.0 4.2 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HG2  ) 6.0 4.2 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HD1  ) 6.0 4.2 0.0
 assign (resid   25 and  name HN   )(resid   25 and  name HD2  ) 6.0 4.2 0.0
 assign (resid   25 and  name HN   )(resid   26 and  name HN   ) 2.8 1.0 0.0
 assign (resid   25 and  name HA   )(resid   25 and  name HD1  ) 6.0 4.2 0.0
 assign (resid   25 and  name HA   )(resid   25 and  name HD2  ) 6.0 4.2 0.0
 assign (resid   25 and  name HA   )(resid   26 and  name HN   ) 3.6 1.8 0.0
 assign (resid   25 and  name HA   )(resid   28 and  name HN   ) 3.8 2.0 0.0
 assign (resid   25 and  name HB*  )(resid   26 and  name HN   ) 4.0 2.2 0.0
 assign (resid   25 and  name HG1  )(resid   26 and  name HN   ) 5.1 3.3 0.0
 assign (resid   25 and  name HG2  )(resid   26 and  name HN   ) 5.1 3.3 0.0
 assign (resid   26 and  name HN   )(resid   26 and  name HA   ) 2.9 1.1 0.0
 assign (resid   26 and  name HN   )(resid   26 and  name HB1  ) 3.5 1.7 0.0
 assign (resid   26 and  name HN   )(resid   26 and  name HB2  ) 3.5 1.7 0.0
 assign (resid   26 and  name HN   )(resid   26 and  name HB*  ) 3.2 1.4 0.0
 assign (resid   26 and  name HN   )(resid   27 and  name HN   ) 2.9 1.1 0.0
 assign (resid   26 and  name HN   )(resid   28 and  name HN   ) 5.0 3.2 0.0
 assign (resid   26 and  name HA   )(resid   26 and  name HB1  ) 2.9 1.1 0.0
 assign (resid   26 and  name HA   )(resid   26 and  name HB2  ) 2.9 1.1 0.0
 assign (resid   26 and  name HA   )(resid   29 and  name HN   ) 3.5 1.7 0.0
 assign (resid   26 and  name HB1  )(resid   27 and  name HN   ) 4.1 2.3 0.0
 assign (resid   26 and  name HB2  )(resid   27 and  name HN   ) 4.1 2.3 0.0
 assign (resid   26 and  name HB*  )(resid   27 and  name HN   ) 3.6 1.8 0.0
 assign (resid   26 and  name HB*  )(resid   29 and  name HN   ) 6.1 4.3 0.0
 assign (resid   26 and  name O    )(resid   30 and  name N    ) 3.0 1.2 0.0
 assign (resid   26 and  name O    )(resid   30 and  name HN   ) 2.0 0.2 0.0
 assign (resid   27 and  name HN   )(resid   27 and  name HB*  ) 3.4 1.6 0.0
 assign (resid   27 and  name HN   )(resid   28 and  name HN   ) 2.9 1.1 0.0
 assign (resid   27 and  name HN   )(resid   29 and  name HN   ) 6.8 5.0 0.0
 assign (resid   27 and  name HN   )(resid   34 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   27 and  name HA   )(resid   30 and  name HN   ) 3.8 2.0 0.0
 assign (resid   27 and  name HA   )(resid   34 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   27 and  name HB*  )(resid   28 and  name HN   ) 4.2 2.4 0.0
 assign (resid   27 and  name HB*  )(resid   31 and  name HN   ) 7.5 5.7 0.0
 assign (resid   27 and  name HB*  )(resid   32 and  name HN   ) 7.0 5.2 0.0
 assign (resid   27 and  name HB*  )(resid   34 and  name HN   ) 6.7 4.9 0.0
 assign (resid   27 and  name HB*  )(resid   34 and  name HD*  ) 5.5 3.7 0.0
 assign (resid   28 and  name HN   )(resid   28 and  name HA   ) 2.8 1.0 0.0
 assign (resid   28 and  name HN   )(resid   28 and  name HB*  ) 3.5 1.7 0.0
 assign (resid   28 and  name HN   )(resid   29 and  name HN   ) 2.9 1.1 0.0
 assign (resid   28 and  name HB*  )(resid   29 and  name HN   ) 4.4 2.6 0.0
 assign (resid   29 and  name HN   )(resid   29 and  name HA   ) 2.9 1.1 0.0
 assign (resid   29 and  name HN   )(resid   29 and  name HB1  ) 3.2 1.4 0.0
 assign (resid   29 and  name HN   )(resid   29 and  name HB2  ) 3.2 1.4 0.0
 assign (resid   29 and  name HN   )(resid   29 and  name HD*  ) 8.6 6.8 0.0
 assign (resid   29 and  name HN   )(resid   30 and  name HN   ) 2.8 1.0 0.0
 assign (resid   29 and  name HB1  )(resid   30 and  name HN   ) 3.2 1.4 0.0
 assign (resid   29 and  name HB2  )(resid   30 and  name HN   ) 3.2 1.4 0.0
 assign (resid   29 and  name HD*  )(resid   30 and  name HN   ) 7.9 6.1 0.0
 assign (resid   30 and  name HN   )(resid   30 and  name HA   ) 2.9 1.1 0.0
 assign (resid   30 and  name HN   )(resid   30 and  name HB1  ) 3.9 2.1 0.0
 assign (resid   30 and  name HN   )(resid   30 and  name HB2  ) 3.9 2.1 0.0
 assign (resid   30 and  name HN   )(resid   30 and  name HB*  ) 3.6 1.8 0.0
 assign (resid   30 and  name HN   )(resid   31 and  name HN   ) 2.8 1.0 0.0
 assign (resid   30 and  name HA   )(resid   31 and  name HN   ) 3.6 1.8 0.0
 assign (resid   30 and  name HB1  )(resid   31 and  name HN   ) 3.9 2.1 0.0
 assign (resid   30 and  name HB2  )(resid   31 and  name HN   ) 3.9 2.1 0.0
 assign (resid   30 and  name HB*  )(resid   31 and  name HN   ) 3.6 1.8 0.0
 assign (resid   31 and  name HN   )(resid   31 and  name HA*  ) 2.6 0.8 0.0
 assign (resid   31 and  name HA1  )(resid   32 and  name HN   ) 3.5 1.7 0.0
 assign (resid   31 and  name HA2  )(resid   32 and  name HN   ) 3.5 1.7 0.0
 assign (resid   31 and  name HA*  )(resid   32 and  name HN   ) 3.2 1.4 0.0
 assign (resid   32 and  name HN   )(resid   32 and  name HB1  ) 3.5 1.7 0.0
 assign (resid   32 and  name HN   )(resid   32 and  name HB2  ) 3.5 1.7 0.0
 assign (resid   32 and  name HN   )(resid   33 and  name HN   ) 5.3 3.5 0.0
 assign (resid   32 and  name HA   )(resid   33 and  name HN   ) 3.3 1.5 0.0
 assign (resid   32 and  name HA   )(resid   33 and  name HB*  ) 4.8 3.0 0.0
 assign (resid   32 and  name HA   )(resid   44 and  name CG   ) 6.8 5.0 0.0
 assign (resid   32 and  name HA   )(resid   44 and  name CZ   ) 6.2 4.4 0.0
 assign (resid   32 and  name HB1  )(resid   33 and  name HN   ) 3.4 1.6 0.0
 assign (resid   32 and  name HB2  )(resid   33 and  name HN   ) 3.4 1.6 0.0
 assign (resid   32 and  name HB*  )(resid   33 and  name HN   ) 3.1 1.3 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HB1  ) 3.5 1.7 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HB2  ) 3.5 1.7 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HB*  ) 3.2 1.4 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HG*  ) 7.0 5.2 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HD*  ) 5.4 3.6 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HE1  ) 5.4 3.6 0.0
 assign (resid   33 and  name HN   )(resid   33 and  name HE2  ) 5.4 3.6 0.0
 assign (resid   33 and  name HN   )(resid   34 and  name HN   ) 5.2 3.4 0.0
 assign (resid   33 and  name HN   )(resid   44 and  name CG   ) 7.9 6.1 0.0
 assign (resid   33 and  name HN   )(resid   44 and  name CZ   ) 8.0 6.2 0.0
 assign (resid   33 and  name HA   )(resid   33 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   33 and  name HA   )(resid   33 and  name HE*  ) 6.9 5.1 0.0
 assign (resid   33 and  name HA   )(resid   34 and  name HN   ) 2.5 0.7 0.0
 assign (resid   33 and  name HB1  )(resid   33 and  name HE1  ) 6.0 4.2 0.0
 assign (resid   33 and  name HB1  )(resid   33 and  name HE2  ) 6.0 4.2 0.0
 assign (resid   33 and  name HB1  )(resid   34 and  name HN   ) 4.5 2.7 0.0
 assign (resid   33 and  name HB2  )(resid   33 and  name HE1  ) 6.0 4.2 0.0
 assign (resid   33 and  name HB2  )(resid   33 and  name HE2  ) 6.0 4.2 0.0
 assign (resid   33 and  name HB2  )(resid   34 and  name HN   ) 4.5 2.7 0.0
 assign (resid   33 and  name HB*  )(resid   33 and  name HE*  ) 5.2 3.4 0.0
 assign (resid   33 and  name HB*  )(resid   44 and  name CG   ) 8.9 7.1 0.0
 assign (resid   33 and  name HB*  )(resid   44 and  name CZ   ) 8.9 7.1 0.0
 assign (resid   33 and  name HD*  )(resid   34 and  name HN   ) 7.0 5.2 0.0
 assign (resid   33 and  name HD*  )(resid   44 and  name CG   ) 9.0 7.2 0.0
 assign (resid   34 and  name HN   )(resid   34 and  name HA   ) 2.9 1.1 0.0
 assign (resid   34 and  name HN   )(resid   34 and  name HB   ) 3.1 1.3 0.0
 assign (resid   34 and  name HN   )(resid   34 and  name HG11 ) 5.5 3.7 0.0
 assign (resid   34 and  name HN   )(resid   34 and  name HG12 ) 5.5 3.7 0.0
 assign (resid   34 and  name HN   )(resid   34 and  name HD*  ) 5.8 4.0 0.0
 assign (resid   34 and  name HN   )(resid   35 and  name HN   ) 5.0 3.2 0.0
 assign (resid   34 and  name HA   )(resid   34 and  name HD*  ) 4.4 2.6 0.0
 assign (resid   34 and  name HA   )(resid   35 and  name HN   ) 2.4 0.6 0.0
 assign (resid   34 and  name HD*  )(resid   35 and  name HN   ) 5.3 3.5 0.0
 assign (resid   35 and  name HN   )(resid   35 and  name HB   ) 3.5 1.7 0.0
 assign (resid   35 and  name HN   )(resid   35 and  name HG*  ) 4.5 2.7 0.0
 assign (resid   35 and  name HN   )(resid   35 and  name HG*  ) 5.8 4.0 0.0
 assign (resid   35 and  name HN   )(resid   35 and  name HD2  ) 3.9 2.1 0.0
 assign (resid   35 and  name HN   )(resid   35 and  name HD3  ) 3.7 1.9 0.0
 assign (resid   35 and  name HA   )(resid   35 and  name HD2  ) 6.0 4.2 0.0
 assign (resid   35 and  name HA   )(resid   35 and  name HD3  ) 6.0 4.2 0.0
 assign (resid   35 and  name HB   )(resid   35 and  name HD2  ) 3.9 2.1 0.0
 assign (resid   35 and  name HB   )(resid   35 and  name HD3  ) 4.1 2.3 0.0
 assign (resid   35 and  name HB   )(resid   36 and  name HN   ) 3.3 1.5 0.0
 assign (resid   35 and  name HB   )(resid   38 and  name HN   ) 4.0 2.2 0.0
 assign (resid   35 and  name HG*  )(resid   35 and  name HD2  ) 4.6 2.8 0.0
 assign (resid   35 and  name HG*  )(resid   35 and  name HD3  ) 4.6 2.8 0.0
 assign (resid   35 and  name HG*  )(resid   36 and  name HN   ) 7.0 5.2 0.0
 assign (resid   35 and  name HG*  )(resid   36 and  name HN   ) 6.2 4.4 0.0
 assign (resid   35 and  name HD2  )(resid   36 and  name HN   ) 4.9 3.1 0.0
 assign (resid   35 and  name HD2  )(resid   40 and  name HA   ) 5.3 3.5 0.0
 assign (resid   35 and  name HD2  )(resid   41 and  name HB1  ) 7.0 5.2 0.0
 assign (resid   35 and  name HD2  )(resid   41 and  name HB2  ) 7.0 5.2 0.0
 assign (resid   35 and  name HD2  )(resid   41 and  name HD1  ) 4.8 3.0 0.0
 assign (resid   35 and  name HD2  )(resid   41 and  name HD2  ) 4.8 3.0 0.0
 assign (resid   35 and  name HD2  )(resid   41 and  name HD*  ) 4.5 2.7 0.0
 assign (resid   35 and  name HD3  )(resid   36 and  name HN   ) 4.6 2.8 0.0
 assign (resid   35 and  name HD3  )(resid   40 and  name HA   ) 3.0 1.2 0.0
 assign (resid   35 and  name HD3  )(resid   41 and  name HB*  ) 6.4 4.6 0.0
 assign (resid   35 and  name HD3  )(resid   41 and  name HD1  ) 4.1 2.3 0.0
 assign (resid   35 and  name HD3  )(resid   41 and  name HD2  ) 4.1 2.3 0.0
 assign (resid   35 and  name HD3  )(resid   41 and  name HD*  ) 3.8 2.0 0.0
 assign (resid   35 and  name HD3  )(resid   46 and  name HD*  ) 6.7 4.9 0.0
 assign (resid   36 and  name HN   )(resid   38 and  name HA   ) 5.2 3.4 0.0
 assign (resid   36 and  name HA   )(resid   37 and  name HN   ) 3.4 1.6 0.0
 assign (resid   37 and  name HN   )(resid   38 and  name HN   ) 6.0 4.2 0.0
 assign (resid   37 and  name HA   )(resid   38 and  name HN   ) 3.5 1.7 0.0
 assign (resid   37 and  name HB*  )(resid   39 and  name HN   ) 4.2 2.4 0.0
 assign (resid   38 and  name HN   )(resid   38 and  name HB1  ) 4.2 2.4 0.0
 assign (resid   38 and  name HN   )(resid   38 and  name HB2  ) 4.2 2.4 0.0
 assign (resid   38 and  name HN   )(resid   38 and  name HB*  ) 3.8 2.0 0.0
 assign (resid   38 and  name HA   )(resid   38 and  name HB1  ) 2.9 1.1 0.0
 assign (resid   38 and  name HA   )(resid   38 and  name HB2  ) 2.9 1.1 0.0
 assign (resid   38 and  name HA   )(resid   39 and  name HN   ) 3.6 1.8 0.0
 assign (resid   38 and  name HB*  )(resid   39 and  name HA   ) 4.4 2.6 0.0
 assign (resid   39 and  name HN   )(resid   39 and  name HB   ) 2.9 1.1 0.0
 assign (resid   39 and  name HA   )(resid   40 and  name HN   ) 3.6 1.8 0.0
 assign (resid   39 and  name HB   )(resid   40 and  name HN   ) 4.0 2.2 0.0
 assign (resid   39 and  name HG*  )(resid   40 and  name HN   ) 7.0 5.2 0.0
 assign (resid   40 and  name HN   )(resid   45 and  name HD*  ) 8.0 6.2 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HB1  ) 5.6 3.8 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HB2  ) 5.6 3.8 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HB*  ) 5.3 3.5 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HD1  ) 2.8 1.0 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HD2  ) 2.8 1.0 0.0
 assign (resid   40 and  name HA   )(resid   41 and  name HD*  ) 2.5 0.7 0.0
 assign (resid   40 and  name HB*  )(resid   41 and  name HD*  ) 4.5 2.7 0.0
 assign (resid   40 and  name HB*  )(resid   45 and  name HA   ) 5.6 3.8 0.0
 assign (resid   41 and  name HB*  )(resid   42 and  name HN   ) 4.0 2.2 0.0
 assign (resid   41 and  name HB*  )(resid   44 and  name CG   ) 8.2 6.4 0.0
 assign (resid   41 and  name HG*  )(resid   44 and  name HN   ) 6.1 4.3 0.0
 assign (resid   42 and  name HN   )(resid   42 and  name HB1  ) 3.7 1.9 0.0
 assign (resid   42 and  name HN   )(resid   42 and  name HB2  ) 3.7 1.9 0.0
 assign (resid   42 and  name HN   )(resid   43 and  name HN   ) 3.8 2.0 0.0
 assign (resid   42 and  name HB1  )(resid   43 and  name HN   ) 3.8 2.0 0.0
 assign (resid   42 and  name HB2  )(resid   43 and  name HN   ) 3.8 2.0 0.0
 assign (resid   42 and  name HB*  )(resid   43 and  name HN   ) 3.5 1.7 0.0
 assign (resid   43 and  name HN   )(resid   43 and  name HB*  ) 3.8 2.0 0.0
 assign (resid   43 and  name HN   )(resid   44 and  name HN   ) 2.7 0.9 0.0
 assign (resid   43 and  name HN   )(resid   44 and  name CG   ) 8.0 6.2 0.0
 assign (resid   43 and  name HN   )(resid   44 and  name CZ   ) 8.0 6.2 0.0
 assign (resid   43 and  name HB*  )(resid   44 and  name CG   ) 8.6 6.8 0.0
 assign (resid   43 and  name HB*  )(resid   44 and  name CZ   ) 9.0 7.2 0.0
 assign (resid   44 and  name HN   )(resid   44 and  name HA   ) 2.9 1.1 0.0
 assign (resid   44 and  name HN   )(resid   44 and  name HB1  ) 3.7 1.9 0.0
 assign (resid   44 and  name HN   )(resid   44 and  name HB2  ) 3.7 1.9 0.0
 assign (resid   44 and  name HN   )(resid   44 and  name HB*  ) 3.4 1.6 0.0
 assign (resid   44 and  name HN   )(resid   45 and  name HD*  ) 5.2 3.4 0.0
 assign (resid   45 and  name HA   )(resid   46 and  name HN   ) 3.5 1.7 0.0
 assign (resid   45 and  name HD*  )(resid   46 and  name HN   ) 5.5 3.7 0.0
 assign (resid   45 and  name HD*  )(resid   46 and  name HB*  ) 6.9 5.1 0.0
 assign (resid   46 and  name HN   )(resid   46 and  name HA   ) 2.9 1.1 0.0
 assign (resid   46 and  name HN   )(resid   46 and  name HB1  ) 3.6 1.8 0.0
 assign (resid   46 and  name HN   )(resid   46 and  name HB2  ) 3.6 1.8 0.0
 assign (resid   46 and  name HN   )(resid   46 and  name HG*  ) 7.0 5.2 0.0
 assign (resid   46 and  name HN   )(resid   46 and  name HD*  ) 7.0 5.2 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HB1  ) 2.9 1.1 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HB2  ) 2.9 1.1 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HD*  ) 5.0 3.2 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HE1  ) 6.0 4.2 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HE2  ) 6.0 4.2 0.0
 assign (resid   46 and  name HA   )(resid   46 and  name HE*  ) 5.4 3.6 0.0
 assign (resid   46 and  name HB1  )(resid   46 and  name HE1  ) 5.8 4.0 0.0
 assign (resid   46 and  name HB1  )(resid   46 and  name HE2  ) 5.8 4.0 0.0
 assign (resid   46 and  name HB2  )(resid   46 and  name HE1  ) 5.8 4.0 0.0
 assign (resid   46 and  name HB2  )(resid   46 and  name HE2  ) 5.8 4.0 0.0
 assign (resid   46 and  name HB*  )(resid   46 and  name HE*  ) 4.8 3.0 0.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LYS   1          HT1       LYS   1  -7.590   1.423  -0.865
    2   2H    LYS   1          HT2       LYS   1  -6.296   2.247  -0.096
    3   3H    LYS   1          HT3       LYS   1  -6.217   0.549  -0.328
    4    HA   LYS   1           HA       LYS   1  -6.247   0.888  -2.703
    5   1HB   LYS   1          HB2       LYS   1  -6.918   3.537  -1.809
    6   2HB   LYS   1          HB1       LYS   1  -5.471   3.612  -2.802
    7   1HG   LYS   1          HG2       LYS   1  -8.137   2.452  -3.580
    8   2HG   LYS   1          HG1       LYS   1  -7.413   3.946  -4.175
    9   1HD   LYS   1          HD2       LYS   1  -6.328   1.161  -4.593
   10   2HD   LYS   1          HD1       LYS   1  -7.170   2.136  -5.797
   11   1HE   LYS   1          HE2       LYS   1  -5.347   3.359  -6.253
   12   2HE   LYS   1          HE1       LYS   1  -4.887   3.485  -4.557
   13   1HZ   LYS   1          HZ1       LYS   1  -3.781   1.846  -6.531
   14   2HZ   LYS   1          HZ2       LYS   1  -4.502   0.836  -5.381
   15   3HZ   LYS   1          HZ3       LYS   1  -3.337   1.964  -4.903
   16    H    SER   2           HN       SER   2  -4.322   3.475  -1.235
   17    HA   SER   2           HA       SER   2  -2.089   3.740  -0.937
   18   1HB   SER   2          HB2       SER   2  -0.944   2.045   0.178
   19   2HB   SER   2          HB1       SER   2  -2.627   1.644   0.518
   20    HG   SER   2           HG       SER   2  -1.008  -0.027  -0.371
   21    H    CYS   3           HN       CYS   3  -0.069   3.623  -1.979
   22    HA   CYS   3           HA       CYS   3  -0.112   2.298  -4.615
   23   1HB   CYS   3          HB2       CYS   3   0.183   5.083  -3.965
   24   2HB   CYS   3          HB1       CYS   3   1.667   4.502  -4.712
   25    H    CYS   4           HN       CYS   4   1.789   1.263  -5.274
   26    HA   CYS   4           HA       CYS   4   4.085   1.416  -3.455
   27   1HB   CYS   4          HB2       CYS   4   2.358  -0.620  -3.158
   28   2HB   CYS   4          HB1       CYS   4   3.378  -1.296  -4.424
   29    HA   PRO   5           HA       PRO   5   6.280   1.596  -7.302
   30   1HB   PRO   5          HB2       PRO   5   8.771   0.979  -6.381
   31   2HB   PRO   5          HB1       PRO   5   8.023   2.567  -6.180
   32   1HG   PRO   5          HG2       PRO   5   8.214   0.301  -4.233
   33   2HG   PRO   5          HG1       PRO   5   8.450   2.037  -3.957
   34   1HD   PRO   5          HD2       PRO   5   6.160   0.782  -3.295
   35   2HD   PRO   5          HD1       PRO   5   6.181   2.461  -3.867
   36    H    ASN   6           HN       ASN   6   5.849  -1.236  -5.449
   37    HA   ASN   6           HA       ASN   6   6.300  -2.882  -7.765
   38   1HB   ASN   6          HB2       ASN   6   8.107  -3.050  -5.361
   39   2HB   ASN   6          HB1       ASN   6   7.832  -4.442  -6.405
   40   1HD2  ASN   6          HD21      ASN   6   9.468  -1.479  -5.997
   41   2HD2  ASN   6          HD22      ASN   6  10.333  -1.485  -7.492
   42    H    THR   7           HN       THR   7   4.875  -4.521  -7.767
   43    HA   THR   7           HA       THR   7   2.827  -4.755  -5.952
   44    HB   THR   7           HB       THR   7   2.407  -5.856  -7.940
   45    HG1  THR   7           HG1      THR   7   1.828  -7.200  -6.157
   46   1HG2  THR   7          HG21      THR   7   4.136  -7.928  -8.385
   47   2HG2  THR   7          HG22      THR   7   5.204  -6.642  -7.824
   48   3HG2  THR   7          HG23      THR   7   4.154  -6.372  -9.215
   49    H    THR   8           HN       THR   8   6.044  -6.054  -5.745
   50    HA   THR   8           HA       THR   8   5.715  -8.093  -3.892
   51    HB   THR   8           HB       THR   8   8.062  -7.057  -3.066
   52    HG1  THR   8           HG1      THR   8   7.607  -5.208  -4.515
   53   1HG2  THR   8          HG21      THR   8   7.856  -9.227  -4.127
   54   2HG2  THR   8          HG22      THR   8   9.194  -8.313  -4.822
   55   3HG2  THR   8          HG23      THR   8   7.672  -8.455  -5.701
   56    H    GLY   9           HN       GLY   9   5.857  -4.604  -3.438
   57   1HA   GLY   9          HA2       GLY   9   5.703  -4.808  -0.552
   58   2HA   GLY   9          HA1       GLY   9   5.658  -3.326  -1.501
   59    H    ARG  10           HN       ARG  10   3.597  -3.763  -3.213
   60    HA   ARG  10           HA       ARG  10   1.326  -3.124  -1.742
   61   1HB   ARG  10          HB2       ARG  10   1.792  -2.876  -4.265
   62   2HB   ARG  10          HB1       ARG  10   1.134  -4.507  -4.386
   63   1HG   ARG  10          HG2       ARG  10  -0.928  -3.780  -4.175
   64   2HG   ARG  10          HG1       ARG  10  -0.520  -2.846  -2.737
   65   1HD   ARG  10          HD2       ARG  10  -0.353  -0.924  -3.883
   66   2HD   ARG  10          HD1       ARG  10   0.434  -1.703  -5.263
   67    HE   ARG  10           HE       ARG  10  -2.108  -2.614  -5.324
   68   1HH1  ARG  10          HH11      ARG  10  -0.695   0.565  -5.295
   69   2HH1  ARG  10          HH12      ARG  10  -1.956   1.277  -6.243
   70   1HH2  ARG  10          HH21      ARG  10  -3.774  -1.694  -6.579
   71   2HH2  ARG  10          HH22      ARG  10  -3.707  -0.012  -6.981
   72    H    ASN  11           HN       ASN  11   2.744  -6.204  -2.450
   73    HA   ASN  11           HA       ASN  11   0.461  -7.829  -2.057
   74   1HB   ASN  11          HB2       ASN  11   3.405  -8.225  -2.177
   75   2HB   ASN  11          HB1       ASN  11   2.470  -9.474  -1.368
   76   1HD2  ASN  11          HD21      ASN  11   3.895  -8.917  -4.120
   77   2HD2  ASN  11          HD22      ASN  11   2.810  -9.660  -5.240
   78    H    ILE  12           HN       ILE  12   3.083  -6.787   0.117
   79    HA   ILE  12           HA       ILE  12   2.030  -8.125   2.388
   80    HB   ILE  12           HB       ILE  12   3.936  -5.789   2.212
   81   1HG1  ILE  12          HG12      ILE  12   5.400  -7.840   3.145
   82   2HG1  ILE  12          HG11      ILE  12   4.210  -8.745   2.214
   83   1HG2  ILE  12          HG21      ILE  12   4.448  -6.834   4.629
   84   2HG2  ILE  12          HG22      ILE  12   2.713  -7.138   4.538
   85   3HG2  ILE  12          HG23      ILE  12   3.331  -5.494   4.372
   86   1HD1  ILE  12          HD11      ILE  12   6.492  -7.278   1.313
   87   2HD1  ILE  12          HD12      ILE  12   5.025  -6.648   0.563
   88   3HD1  ILE  12          HD13      ILE  12   5.427  -8.359   0.416
   89    H    TYR  13           HN       TYR  13   1.704  -4.848   1.119
   90    HA   TYR  13           HA       TYR  13   0.213  -3.806   3.265
   91   1HB   TYR  13          HB2       TYR  13   1.351  -2.682   1.162
   92   2HB   TYR  13          HB1       TYR  13  -0.250  -2.881   0.467
   93    HD1  TYR  13           HD1      TYR  13   1.790  -1.039   2.831
   94    HD2  TYR  13           HD2      TYR  13  -2.187  -1.699   1.474
   95    HE1  TYR  13           HE1      TYR  13   1.074   1.031   3.945
   96    HE2  TYR  13           HE2      TYR  13  -2.916   0.370   2.585
   97    HH   TYR  13           HH       TYR  13  -0.874   2.101   4.769
   98    H    ASN  14           HN       ASN  14  -0.766  -5.275   0.194
   99    HA   ASN  14           HA       ASN  14  -3.538  -5.053   0.578
  100   1HB   ASN  14          HB2       ASN  14  -1.744  -6.626  -1.210
  101   2HB   ASN  14          HB1       ASN  14  -3.427  -7.110  -1.089
  102   1HD2  ASN  14          HD21      ASN  14  -1.414  -4.244  -1.597
  103   2HD2  ASN  14          HD22      ASN  14  -2.471  -3.490  -2.738
  104    H    THR  15           HN       THR  15  -1.360  -7.874   1.013
  105    HA   THR  15           HA       THR  15  -3.358  -9.558   2.071
  106    HB   THR  15           HB       THR  15  -1.198 -10.379   1.231
  107    HG1  THR  15           HG1      THR  15  -1.701 -12.012   2.417
  108   1HG2  THR  15          HG21      THR  15   0.830 -10.052   2.191
  109   2HG2  THR  15          HG22      THR  15   0.150  -9.776   3.795
  110   3HG2  THR  15          HG23      THR  15   0.079  -8.504   2.577
  111    H    CYS  16           HN       CYS  16  -1.077  -7.350   3.610
  112    HA   CYS  16           HA       CYS  16  -1.490  -7.922   6.274
  113   1HB   CYS  16          HB2       CYS  16   0.173  -6.349   5.835
  114   2HB   CYS  16          HB1       CYS  16  -0.853  -5.420   4.754
  115    H    ARG  17           HN       ARG  17  -3.249  -5.545   4.276
  116    HA   ARG  17           HA       ARG  17  -5.183  -4.897   6.208
  117   1HB   ARG  17          HB2       ARG  17  -4.787  -4.458   3.340
  118   2HB   ARG  17          HB1       ARG  17  -6.482  -4.586   3.789
  119   1HG   ARG  17          HG2       ARG  17  -5.584  -2.909   5.709
  120   2HG   ARG  17          HG1       ARG  17  -4.526  -2.475   4.365
  121   1HD   ARG  17          HD2       ARG  17  -6.444  -1.068   4.247
  122   2HD   ARG  17          HD1       ARG  17  -6.570  -2.246   2.941
  123    HE   ARG  17           HE       ARG  17  -8.481  -3.035   3.903
  124   1HH1  ARG  17          HH11      ARG  17  -6.702  -1.232   6.304
  125   2HH1  ARG  17          HH12      ARG  17  -7.956  -1.336   7.493
  126   1HH2  ARG  17          HH21      ARG  17 -10.132  -3.173   5.466
  127   2HH2  ARG  17          HH22      ARG  17  -9.904  -2.438   7.018
  128    H    LEU  18           HN       LEU  18  -5.034  -7.415   3.742
  129    HA   LEU  18           HA       LEU  18  -7.672  -8.365   4.030
  130   1HB   LEU  18          HB2       LEU  18  -5.190  -9.249   2.756
  131   2HB   LEU  18          HB1       LEU  18  -6.202 -10.574   3.294
  132    HG   LEU  18           HG       LEU  18  -7.004  -8.369   1.396
  133   1HD1  LEU  18          HD11      LEU  18  -5.517 -10.037   0.413
  134   2HD1  LEU  18          HD12      LEU  18  -7.148 -10.164  -0.247
  135   3HD1  LEU  18          HD13      LEU  18  -6.592 -11.323   0.960
  136   1HD2  LEU  18          HD21      LEU  18  -8.967  -8.861   2.557
  137   2HD2  LEU  18          HD22      LEU  18  -8.568 -10.573   2.695
  138   3HD2  LEU  18          HD23      LEU  18  -9.046  -9.901   1.135
  139    H    GLY  19           HN       GLY  19  -4.982  -8.570   6.109
  140   1HA   GLY  19          HA2       GLY  19  -6.186 -10.839   7.540
  141   2HA   GLY  19          HA1       GLY  19  -4.501 -10.361   7.663
  142    H    GLY  20           HN       GLY  20  -6.802  -7.806   7.615
  143   1HA   GLY  20          HA2       GLY  20  -7.608  -6.413   9.257
  144   2HA   GLY  20          HA1       GLY  20  -7.362  -7.723  10.400
  145    H    GLY  21           HN       GLY  21  -5.339  -5.552   8.431
  146   1HA   GLY  21          HA2       GLY  21  -3.855  -4.859  10.869
  147   2HA   GLY  21          HA1       GLY  21  -2.985  -5.371   9.428
  148    H    SER  22           HN       SER  22  -3.724  -2.755  11.118
  149    HA   SER  22           HA       SER  22  -4.845  -0.816   9.601
  150   1HB   SER  22          HB2       SER  22  -2.323   0.115  10.774
  151   2HB   SER  22          HB1       SER  22  -3.979   0.625  11.102
  152    HG   SER  22           HG       SER  22  -2.517  -1.501  12.235
  153    H    ARG  23           HN       ARG  23  -4.041   0.816   8.175
  154    HA   ARG  23           HA       ARG  23  -2.581  -0.229   6.012
  155   1HB   ARG  23          HB2       ARG  23  -4.018   2.192   6.646
  156   2HB   ARG  23          HB1       ARG  23  -2.540   2.559   5.772
  157   1HG   ARG  23          HG2       ARG  23  -3.606   2.076   3.893
  158   2HG   ARG  23          HG1       ARG  23  -3.678   0.394   4.423
  159   1HD   ARG  23          HD2       ARG  23  -5.884   1.411   3.787
  160   2HD   ARG  23          HD1       ARG  23  -5.819   0.708   5.403
  161    HE   ARG  23           HE       ARG  23  -6.171   2.789   6.285
  162   1HH1  ARG  23          HH11      ARG  23  -5.229   3.129   2.942
  163   2HH1  ARG  23          HH12      ARG  23  -5.553   4.829   2.894
  164   1HH2  ARG  23          HH21      ARG  23  -6.598   5.025   6.224
  165   2HH2  ARG  23          HH22      ARG  23  -6.329   5.906   4.757
  166    H    GLU  24           HN       GLU  24  -1.680   1.762   8.723
  167    HA   GLU  24           HA       GLU  24   0.879   2.509   7.739
  168   1HB   GLU  24          HB2       GLU  24   0.321   2.364  10.669
  169   2HB   GLU  24          HB1       GLU  24   1.177   3.597   9.753
  170   1HG   GLU  24          HG2       GLU  24  -1.129   4.108   8.719
  171   2HG   GLU  24          HG1       GLU  24  -1.768   3.204  10.091
  172    H    ARG  25           HN       ARG  25  -0.263  -0.136   9.801
  173    HA   ARG  25           HA       ARG  25   2.191  -1.106  10.669
  174   1HB   ARG  25          HB2       ARG  25   0.030  -1.937  11.495
  175   2HB   ARG  25          HB1       ARG  25  -0.275  -2.697   9.940
  176   1HG   ARG  25          HG2       ARG  25   1.819  -4.047  10.320
  177   2HG   ARG  25          HG1       ARG  25   1.814  -3.425  11.971
  178   1HD   ARG  25          HD2       ARG  25  -0.196  -4.505  12.494
  179   2HD   ARG  25          HD1       ARG  25  -0.599  -4.764  10.797
  180    HE   ARG  25           HE       ARG  25   0.656  -6.678  10.826
  181   1HH1  ARG  25          HH11      ARG  25   1.440  -4.771  13.642
  182   2HH1  ARG  25          HH12      ARG  25   2.408  -6.011  14.367
  183   1HH2  ARG  25          HH21      ARG  25   1.928  -8.310  11.778
  184   2HH2  ARG  25          HH22      ARG  25   2.685  -8.020  13.309
  185    H    CYS  26           HN       CYS  26   0.425  -1.857   7.696
  186    HA   CYS  26           HA       CYS  26   2.395  -3.670   6.717
  187   1HB   CYS  26          HB2       CYS  26   0.831  -2.425   4.604
  188   2HB   CYS  26          HB1       CYS  26   0.922  -4.111   5.086
  189    H    ALA  27           HN       ALA  27   1.732  -0.240   6.261
  190    HA   ALA  27           HA       ALA  27   3.468   0.341   4.189
  191   1HB   ALA  27          HB1       ALA  27   1.833   1.840   5.645
  192   2HB   ALA  27          HB2       ALA  27   3.160   2.541   4.719
  193   3HB   ALA  27          HB3       ALA  27   3.343   2.264   6.451
  194    H    SER  28           HN       SER  28   4.169   0.224   7.675
  195    HA   SER  28           HA       SER  28   6.935   0.797   7.365
  196   1HB   SER  28          HB2       SER  28   5.599   1.127   9.482
  197   2HB   SER  28          HB1       SER  28   5.626  -0.624   9.691
  198    HG   SER  28           HG       SER  28   7.495  -0.334  10.584
  199    H    LEU  29           HN       LEU  29   5.001  -2.038   7.094
  200    HA   LEU  29           HA       LEU  29   7.015  -3.985   7.556
  201   1HB   LEU  29          HB2       LEU  29   4.313  -4.047   7.268
  202   2HB   LEU  29          HB1       LEU  29   4.820  -4.667   5.710
  203    HG   LEU  29           HG       LEU  29   4.348  -6.431   7.398
  204   1HD1  LEU  29          HD11      LEU  29   5.896  -7.799   6.494
  205   2HD1  LEU  29          HD12      LEU  29   7.237  -6.720   6.881
  206   3HD1  LEU  29          HD13      LEU  29   6.221  -6.396   5.476
  207   1HD2  LEU  29          HD21      LEU  29   5.654  -6.741   9.301
  208   2HD2  LEU  29          HD22      LEU  29   5.360  -5.002   9.278
  209   3HD2  LEU  29          HD23      LEU  29   6.911  -5.641   8.735
  210    H    SER  30           HN       SER  30   5.491  -2.887   4.515
  211    HA   SER  30           HA       SER  30   7.722  -4.022   3.023
  212   1HB   SER  30          HB2       SER  30   4.936  -3.286   2.409
  213   2HB   SER  30          HB1       SER  30   6.094  -2.949   1.121
  214    HG   SER  30           HG       SER  30   6.799  -5.172   1.405
  215    H    GLY  31           HN       GLY  31   5.896  -1.024   2.462
  216   1HA   GLY  31          HA2       GLY  31   7.452   0.996   3.059
  217   2HA   GLY  31          HA1       GLY  31   8.421   0.286   1.781
  218    H    CYS  32           HN       CYS  32   4.991   0.049   1.432
  219    HA   CYS  32           HA       CYS  32   5.024   1.554  -0.976
  220   1HB   CYS  32          HB2       CYS  32   2.610   0.703   0.633
  221   2HB   CYS  32          HB1       CYS  32   2.671   1.071  -1.081
  222    H    LYS  33           HN       LYS  33   3.421   3.361  -1.339
  223    HA   LYS  33           HA       LYS  33   3.695   5.296   0.847
  224   1HB   LYS  33          HB2       LYS  33   4.616   5.759  -1.494
  225   2HB   LYS  33          HB1       LYS  33   2.940   5.937  -1.996
  226   1HG   LYS  33          HG2       LYS  33   4.050   8.083  -1.491
  227   2HG   LYS  33          HG1       LYS  33   2.625   7.782  -0.496
  228   1HD   LYS  33          HD2       LYS  33   5.056   6.753   0.717
  229   2HD   LYS  33          HD1       LYS  33   5.148   8.487   0.405
  230   1HE   LYS  33          HE2       LYS  33   2.577   7.891   1.481
  231   2HE   LYS  33          HE1       LYS  33   3.801   7.139   2.503
  232   1HZ   LYS  33          HZ1       LYS  33   3.858   9.987   1.670
  233   2HZ   LYS  33          HZ2       LYS  33   4.872   9.235   2.796
  234   3HZ   LYS  33          HZ3       LYS  33   3.230   9.443   3.145
  235    H    ILE  34           HN       ILE  34   1.984   6.037   1.910
  236    HA   ILE  34           HA       ILE  34  -0.648   5.052   1.179
  237    HB   ILE  34           HB       ILE  34   0.178   4.941   3.529
  238   1HG1  ILE  34          HG12      ILE  34  -2.107   6.642   3.999
  239   2HG1  ILE  34          HG11      ILE  34  -2.370   5.648   2.569
  240   1HG2  ILE  34          HG21      ILE  34  -0.349   7.880   3.747
  241   2HG2  ILE  34          HG22      ILE  34   1.253   7.271   3.329
  242   3HG2  ILE  34          HG23      ILE  34   0.508   6.815   4.861
  243   1HD1  ILE  34          HD11      ILE  34  -2.800   4.892   5.168
  244   2HD1  ILE  34          HD12      ILE  34  -1.249   4.146   4.784
  245   3HD1  ILE  34          HD13      ILE  34  -2.661   3.812   3.782
  246    H    ILE  35           HN       ILE  35  -2.038   6.207   0.015
  247    HA   ILE  35           HA       ILE  35  -1.571   9.083  -0.288
  248    HB   ILE  35           HB       ILE  35  -3.728   8.036  -1.935
  249   1HG1  ILE  35          HG12      ILE  35  -1.782   6.913  -3.430
  250   2HG1  ILE  35          HG11      ILE  35  -1.185   6.503  -1.827
  251   1HG2  ILE  35          HG21      ILE  35  -2.815  10.102  -2.518
  252   2HG2  ILE  35          HG22      ILE  35  -2.157   8.993  -3.719
  253   3HG2  ILE  35          HG23      ILE  35  -1.158   9.519  -2.365
  254   1HD1  ILE  35          HD11      ILE  35  -2.607   4.763  -2.870
  255   2HD1  ILE  35          HD12      ILE  35  -3.961   5.889  -2.802
  256   3HD1  ILE  35          HD13      ILE  35  -3.203   5.331  -1.311
  257    H    SER  36           HN       SER  36  -4.145   9.818  -1.133
  258    HA   SER  36           HA       SER  36  -5.983   9.220   1.027
  259   1HB   SER  36          HB2       SER  36  -6.292  11.620   1.596
  260   2HB   SER  36          HB1       SER  36  -4.675  11.040   1.995
  261    HG   SER  36           HG       SER  36  -3.838  12.197   0.377
  262    H    ALA  37           HN       ALA  37  -8.139   9.832   0.546
  263    HA   ALA  37           HA       ALA  37  -9.932  10.196  -0.809
  264   1HB   ALA  37          HB1       ALA  37  -8.597  12.419  -1.081
  265   2HB   ALA  37          HB2       ALA  37  -9.934  12.056  -2.172
  266   3HB   ALA  37          HB3       ALA  37  -8.271  11.803  -2.701
  267    H    SER  38           HN       SER  38  -7.716   8.137  -1.400
  268    HA   SER  38           HA       SER  38  -7.668   6.304  -2.754
  269   1HB   SER  38          HB2       SER  38 -10.127   7.419  -3.480
  270   2HB   SER  38          HB1       SER  38  -9.272   7.186  -5.004
  271    HG   SER  38           HG       SER  38  -9.492   5.172  -3.023
  272    H    THR  39           HN       THR  39  -7.845   9.318  -4.660
  273    HA   THR  39           HA       THR  39  -6.379   8.678  -6.837
  274    HB   THR  39           HB       THR  39  -7.157  10.861  -6.829
  275    HG1  THR  39           HG1      THR  39  -5.315  11.319  -7.740
  276   1HG2  THR  39          HG21      THR  39  -6.497  10.849  -4.051
  277   2HG2  THR  39          HG22      THR  39  -7.550  11.943  -4.946
  278   3HG2  THR  39          HG23      THR  39  -5.825  12.286  -4.821
  279    H    CYS  40           HN       CYS  40  -4.414   7.947  -7.263
  280    HA   CYS  40           HA       CYS  40  -2.501   7.666  -5.107
  281   1HB   CYS  40          HB2       CYS  40  -3.048   6.334  -7.620
  282   2HB   CYS  40          HB1       CYS  40  -1.334   6.701  -7.458
  283    HA   PRO  41           HA       PRO  41   0.230  10.968  -6.047
  284   1HB   PRO  41          HB2       PRO  41   2.680   9.740  -5.837
  285   2HB   PRO  41          HB1       PRO  41   1.694  10.208  -4.455
  286   1HG   PRO  41          HG2       PRO  41   1.965   7.536  -5.774
  287   2HG   PRO  41          HG1       PRO  41   1.928   7.935  -4.046
  288   1HD   PRO  41          HD2       PRO  41  -0.230   6.972  -5.309
  289   2HD   PRO  41          HD1       PRO  41  -0.370   8.187  -4.022
  290    H    SER  42           HN       SER  42   2.934  10.243  -7.306
  291    HA   SER  42           HA       SER  42   2.604  11.045  -9.849
  292   1HB   SER  42          HB2       SER  42   4.593   9.258  -8.549
  293   2HB   SER  42          HB1       SER  42   4.599   9.316 -10.311
  294    HG   SER  42           HG       SER  42   4.701  11.606  -8.639
  295    H    ASP  43           HN       ASP  43   3.209   7.564  -9.387
  296    HA   ASP  43           HA       ASP  43   0.889   6.536 -10.452
  297   1HB   ASP  43          HB2       ASP  43   2.589   7.755 -12.488
  298   2HB   ASP  43          HB1       ASP  43   2.240   6.064 -12.830
  299    H    TYR  44           HN       TYR  44   2.466   5.571  -8.534
  300    HA   TYR  44           HA       TYR  44   3.673   3.204  -9.768
  301   1HB   TYR  44          HB2       TYR  44   5.303   3.145  -7.933
  302   2HB   TYR  44          HB1       TYR  44   5.453   4.605  -8.895
  303    HD1  TYR  44           HD1      TYR  44   5.033   3.257  -5.613
  304    HD2  TYR  44           HD2      TYR  44   4.386   6.738  -7.972
  305    HE1  TYR  44           HE1      TYR  44   4.886   4.609  -3.566
  306    HE2  TYR  44           HE2      TYR  44   4.236   8.100  -5.930
  307    HH   TYR  44           HH       TYR  44   3.553   7.345  -3.258
  308    HA   PRO  45           HA       PRO  45   0.469   1.950  -6.618
  309   1HB   PRO  45          HB2       PRO  45  -1.431   0.984  -8.218
  310   2HB   PRO  45          HB1       PRO  45  -1.281   2.724  -7.939
  311   1HG   PRO  45          HG2       PRO  45  -0.368   1.095 -10.278
  312   2HG   PRO  45          HG1       PRO  45  -1.159   2.681 -10.260
  313   1HD   PRO  45          HD2       PRO  45   1.560   2.292 -10.533
  314   2HD   PRO  45          HD1       PRO  45   0.811   3.787  -9.939
  315    H    LYS  46           HN       LYS  46   2.669   0.556  -8.528
  316    HA   LYS  46           HA       LYS  46   2.452  -1.988  -7.313
  317   1HB   LYS  46          HB2       LYS  46   0.842  -1.725  -9.555
  318   2HB   LYS  46          HB1       LYS  46   2.282  -2.522 -10.170
  319   1HG   LYS  46          HG2       LYS  46   1.254  -4.397  -9.521
  320   2HG   LYS  46          HG1       LYS  46   1.821  -3.950  -7.911
  321   1HD   LYS  46          HD2       LYS  46  -0.261  -3.060  -7.303
  322   2HD   LYS  46          HD1       LYS  46  -0.810  -2.973  -8.978
  323   1HE   LYS  46          HE2       LYS  46  -1.222  -5.250  -9.095
  324   2HE   LYS  46          HE1       LYS  46  -0.140  -5.617  -7.753
  325   1HZ   LYS  46          HZ1       LYS  46  -1.702  -4.880  -6.203
  326   2HZ   LYS  46          HZ2       LYS  46  -2.619  -5.760  -7.319
  327   3HZ   LYS  46          HZ3       LYS  46  -2.630  -4.070  -7.364
  Start of MODEL    2
    1   1H    LYS   1          HT1       LYS   1  -8.032   3.568  -0.130
    2   2H    LYS   1          HT2       LYS   1  -6.519   4.358  -0.018
    3   3H    LYS   1          HT3       LYS   1  -6.853   3.006   0.970
    4    HA   LYS   1           HA       LYS   1  -6.942   1.589  -0.923
    5   1HB   LYS   1          HB2       LYS   1  -7.430   4.060  -2.169
    6   2HB   LYS   1          HB1       LYS   1  -5.937   3.449  -2.868
    7   1HG   LYS   1          HG2       LYS   1  -8.014   1.425  -2.636
    8   2HG   LYS   1          HG1       LYS   1  -8.469   2.791  -3.658
    9   1HD   LYS   1          HD2       LYS   1  -7.414   1.102  -5.004
   10   2HD   LYS   1          HD1       LYS   1  -6.355   2.511  -4.898
   11   1HE   LYS   1          HE2       LYS   1  -4.956   1.430  -3.305
   12   2HE   LYS   1          HE1       LYS   1  -6.102   0.094  -3.128
   13   1HZ   LYS   1          HZ1       LYS   1  -3.998   0.166  -4.842
   14   2HZ   LYS   1          HZ2       LYS   1  -5.317   0.525  -5.841
   15   3HZ   LYS   1          HZ3       LYS   1  -5.316  -0.893  -4.933
   16    H    SER   2           HN       SER   2  -4.680   4.342  -1.198
   17    HA   SER   2           HA       SER   2  -2.438   4.501  -0.711
   18   1HB   SER   2          HB2       SER   2  -3.138   2.144   0.686
   19   2HB   SER   2          HB1       SER   2  -1.589   1.881  -0.103
   20    HG   SER   2           HG       SER   2  -0.694   3.316   1.174
   21    H    CYS   3           HN       CYS   3  -0.251   3.443  -1.424
   22    HA   CYS   3           HA       CYS   3  -0.364   1.867  -3.772
   23   1HB   CYS   3          HB2       CYS   3   0.317   4.765  -4.169
   24   2HB   CYS   3          HB1       CYS   3   0.384   3.518  -5.389
   25    H    CYS   4           HN       CYS   4   1.436   0.715  -3.865
   26    HA   CYS   4           HA       CYS   4   3.943   1.662  -2.640
   27   1HB   CYS   4          HB2       CYS   4   3.535  -1.158  -3.484
   28   2HB   CYS   4          HB1       CYS   4   4.417  -0.535  -2.102
   29    HA   PRO   5           HA       PRO   5   5.752   1.948  -6.703
   30   1HB   PRO   5          HB2       PRO   5   8.389   1.727  -6.023
   31   2HB   PRO   5          HB1       PRO   5   7.448   3.205  -5.890
   32   1HG   PRO   5          HG2       PRO   5   8.208   1.249  -3.781
   33   2HG   PRO   5          HG1       PRO   5   8.056   3.012  -3.679
   34   1HD   PRO   5          HD2       PRO   5   6.184   1.298  -2.712
   35   2HD   PRO   5          HD1       PRO   5   5.805   2.922  -3.305
   36    H    ASN   6           HN       ASN   6   5.255  -0.885  -5.477
   37    HA   ASN   6           HA       ASN   6   6.188  -2.260  -7.758
   38   1HB   ASN   6          HB2       ASN   6   7.894  -2.509  -5.288
   39   2HB   ASN   6          HB1       ASN   6   7.738  -3.865  -6.400
   40   1HD2  ASN   6          HD21      ASN   6   9.439  -1.083  -5.681
   41   2HD2  ASN   6          HD22      ASN   6  10.289  -0.898  -7.173
   42    H    THR   7           HN       THR   7   5.155  -4.239  -7.951
   43    HA   THR   7           HA       THR   7   2.927  -4.723  -6.397
   44    HB   THR   7           HB       THR   7   3.075  -5.851  -8.481
   45    HG1  THR   7           HG1      THR   7   1.992  -7.102  -7.004
   46   1HG2  THR   7          HG21      THR   7   5.312  -7.609  -7.586
   47   2HG2  THR   7          HG22      THR   7   5.654  -6.052  -8.338
   48   3HG2  THR   7          HG23      THR   7   4.730  -7.270  -9.215
   49    H    THR   8           HN       THR   8   6.246  -5.669  -5.938
   50    HA   THR   8           HA       THR   8   6.050  -7.620  -3.991
   51    HB   THR   8           HB       THR   8   8.259  -6.785  -3.189
   52    HG1  THR   8           HG1      THR   8   8.044  -4.590  -3.530
   53   1HG2  THR   8          HG21      THR   8   8.107  -8.297  -5.148
   54   2HG2  THR   8          HG22      THR   8   9.504  -7.224  -5.186
   55   3HG2  THR   8          HG23      THR   8   8.099  -6.874  -6.189
   56    H    GLY   9           HN       GLY   9   5.698  -4.143  -3.678
   57   1HA   GLY   9          HA2       GLY   9   5.434  -4.353  -0.779
   58   2HA   GLY   9          HA1       GLY   9   5.411  -2.861  -1.719
   59    H    ARG  10           HN       ARG  10   3.544  -3.928  -3.667
   60    HA   ARG  10           HA       ARG  10   1.097  -3.072  -2.630
   61   1HB   ARG  10          HB2       ARG  10   1.959  -3.695  -5.125
   62   2HB   ARG  10          HB1       ARG  10   1.006  -5.127  -4.783
   63   1HG   ARG  10          HG2       ARG  10  -0.050  -2.395  -4.531
   64   2HG   ARG  10          HG1       ARG  10  -0.064  -3.299  -6.031
   65   1HD   ARG  10          HD2       ARG  10  -1.491  -4.944  -5.163
   66   2HD   ARG  10          HD1       ARG  10  -1.169  -4.461  -3.502
   67    HE   ARG  10           HE       ARG  10  -2.352  -2.656  -5.383
   68   1HH1  ARG  10          HH11      ARG  10  -2.956  -4.452  -2.413
   69   2HH1  ARG  10          HH12      ARG  10  -4.155  -3.373  -1.855
   70   1HH2  ARG  10          HH21      ARG  10  -4.024  -1.341  -4.660
   71   2HH2  ARG  10          HH22      ARG  10  -4.777  -1.603  -3.127
   72    H    ASN  11           HN       ASN  11   2.498  -6.264  -3.006
   73    HA   ASN  11           HA       ASN  11   0.344  -7.822  -2.158
   74   1HB   ASN  11          HB2       ASN  11   3.245  -8.457  -1.689
   75   2HB   ASN  11          HB1       ASN  11   1.918  -9.575  -1.979
   76   1HD2  ASN  11          HD21      ASN  11   4.566  -8.875  -3.359
   77   2HD2  ASN  11          HD22      ASN  11   4.119  -8.722  -5.021
   78    H    ILE  12           HN       ILE  12   3.121  -6.673  -0.227
   79    HA   ILE  12           HA       ILE  12   2.254  -7.769   2.181
   80    HB   ILE  12           HB       ILE  12   4.101  -5.536   1.473
   81   1HG1  ILE  12          HG12      ILE  12   5.205  -7.288   3.374
   82   2HG1  ILE  12          HG11      ILE  12   4.254  -8.302   2.295
   83   1HG2  ILE  12          HG21      ILE  12   4.540  -5.293   3.986
   84   2HG2  ILE  12          HG22      ILE  12   2.947  -6.023   4.194
   85   3HG2  ILE  12          HG23      ILE  12   3.109  -4.503   3.319
   86   1HD1  ILE  12          HD11      ILE  12   6.702  -6.745   1.772
   87   2HD1  ILE  12          HD12      ILE  12   5.515  -6.838   0.474
   88   3HD1  ILE  12          HD13      ILE  12   6.195  -8.315   1.154
   89    H    TYR  13           HN       TYR  13   1.617  -4.523   0.852
   90    HA   TYR  13           HA       TYR  13   0.139  -3.625   3.062
   91   1HB   TYR  13          HB2       TYR  13   1.102  -2.561   0.734
   92   2HB   TYR  13          HB1       TYR  13  -0.613  -2.634   0.418
   93    HD1  TYR  13           HD1      TYR  13   1.935  -1.252   2.712
   94    HD2  TYR  13           HD2      TYR  13  -2.103  -1.086   1.408
   95    HE1  TYR  13           HE1      TYR  13   1.626   0.843   3.964
   96    HE2  TYR  13           HE2      TYR  13  -2.422   1.005   2.663
   97    HH   TYR  13           HH       TYR  13  -0.017   2.248   4.842
   98    H    ASN  14           HN       ASN  14  -0.653  -5.480   0.191
   99    HA   ASN  14           HA       ASN  14  -3.459  -5.359   0.376
  100   1HB   ASN  14          HB2       ASN  14  -1.482  -7.166  -1.000
  101   2HB   ASN  14          HB1       ASN  14  -3.205  -7.556  -0.999
  102   1HD2  ASN  14          HD21      ASN  14  -1.560  -4.472  -1.076
  103   2HD2  ASN  14          HD22      ASN  14  -2.282  -3.904  -2.485
  104    H    THR  15           HN       THR  15  -1.286  -8.080   1.004
  105    HA   THR  15           HA       THR  15  -3.235  -9.590   2.297
  106    HB   THR  15           HB       THR  15  -1.417 -10.719   1.393
  107    HG1  THR  15           HG1      THR  15  -1.288 -12.032   2.992
  108   1HG2  THR  15          HG21      THR  15   0.804 -10.039   3.002
  109   2HG2  THR  15          HG22      THR  15   0.138  -8.546   2.342
  110   3HG2  THR  15          HG23      THR  15   0.611  -9.856   1.258
  111    H    CYS  16           HN       CYS  16  -0.960  -7.222   3.472
  112    HA   CYS  16           HA       CYS  16  -1.173  -7.719   6.196
  113   1HB   CYS  16          HB2       CYS  16   0.382  -6.106   5.600
  114   2HB   CYS  16          HB1       CYS  16  -0.737  -5.266   4.543
  115    H    ARG  17           HN       ARG  17  -3.039  -5.360   4.255
  116    HA   ARG  17           HA       ARG  17  -4.963  -4.855   6.247
  117   1HB   ARG  17          HB2       ARG  17  -4.530  -4.157   3.475
  118   2HB   ARG  17          HB1       ARG  17  -6.238  -4.425   3.806
  119   1HG   ARG  17          HG2       ARG  17  -5.230  -2.889   5.940
  120   2HG   ARG  17          HG1       ARG  17  -4.584  -2.191   4.459
  121   1HD   ARG  17          HD2       ARG  17  -6.564  -1.063   4.677
  122   2HD   ARG  17          HD1       ARG  17  -7.049  -2.376   3.618
  123    HE   ARG  17           HE       ARG  17  -7.706  -3.345   6.003
  124   1HH1  ARG  17          HH11      ARG  17  -8.269  -0.282   4.437
  125   2HH1  ARG  17          HH12      ARG  17  -9.560   0.171   5.483
  126   1HH2  ARG  17          HH21      ARG  17  -9.447  -2.810   7.367
  127   2HH2  ARG  17          HH22      ARG  17 -10.257  -1.300   7.160
  128    H    LEU  18           HN       LEU  18  -4.786  -7.244   3.670
  129    HA   LEU  18           HA       LEU  18  -7.416  -8.196   3.827
  130   1HB   LEU  18          HB2       LEU  18  -6.741  -9.687   2.275
  131   2HB   LEU  18          HB1       LEU  18  -5.241  -8.802   2.280
  132    HG   LEU  18           HG       LEU  18  -4.395 -10.441   3.989
  133   1HD1  LEU  18          HD11      LEU  18  -5.836 -11.857   4.915
  134   2HD1  LEU  18          HD12      LEU  18  -5.980 -12.666   3.357
  135   3HD1  LEU  18          HD13      LEU  18  -7.107 -11.382   3.792
  136   1HD2  LEU  18          HD21      LEU  18  -4.891 -12.227   1.799
  137   2HD2  LEU  18          HD22      LEU  18  -3.400 -11.427   2.277
  138   3HD2  LEU  18          HD23      LEU  18  -4.542 -10.603   1.212
  139    H    GLY  19           HN       GLY  19  -4.727  -8.495   5.939
  140   1HA   GLY  19          HA2       GLY  19  -6.108 -10.587   7.471
  141   2HA   GLY  19          HA1       GLY  19  -4.393 -10.211   7.594
  142    H    GLY  20           HN       GLY  20  -6.898  -7.757   7.457
  143   1HA   GLY  20          HA2       GLY  20  -7.589  -6.190   8.993
  144   2HA   GLY  20          HA1       GLY  20  -7.253  -7.395  10.227
  145    H    GLY  21           HN       GLY  21  -4.959  -5.936   7.964
  146   1HA   GLY  21          HA2       GLY  21  -3.488  -4.900  10.289
  147   2HA   GLY  21          HA1       GLY  21  -2.746  -5.398   8.774
  148    H    SER  22           HN       SER  22  -3.717  -2.858  10.551
  149    HA   SER  22           HA       SER  22  -4.838  -1.031   8.804
  150   1HB   SER  22          HB2       SER  22  -2.776   0.064  10.605
  151   2HB   SER  22          HB1       SER  22  -4.464   0.514  10.420
  152    HG   SER  22           HG       SER  22  -3.323  -1.524  11.979
  153    H    ARG  23           HN       ARG  23  -3.899   0.794   7.693
  154    HA   ARG  23           HA       ARG  23  -2.123   0.160   5.721
  155   1HB   ARG  23          HB2       ARG  23  -3.245   2.645   6.882
  156   2HB   ARG  23          HB1       ARG  23  -1.832   2.823   5.855
  157   1HG   ARG  23          HG2       ARG  23  -3.686   3.130   4.459
  158   2HG   ARG  23          HG1       ARG  23  -3.092   1.516   4.108
  159   1HD   ARG  23          HD2       ARG  23  -4.943   0.521   4.893
  160   2HD   ARG  23          HD1       ARG  23  -5.134   1.669   6.210
  161    HE   ARG  23           HE       ARG  23  -6.099   3.222   4.556
  162   1HH1  ARG  23          HH11      ARG  23  -5.909  -0.154   3.825
  163   2HH1  ARG  23          HH12      ARG  23  -7.173  -0.118   2.659
  164   1HH2  ARG  23          HH21      ARG  23  -7.709   3.355   2.905
  165   2HH2  ARG  23          HH22      ARG  23  -8.159   1.908   2.063
  166    H    GLU  24           HN       GLU  24  -1.508   1.267   8.934
  167    HA   GLU  24           HA       GLU  24   1.155   2.157   8.577
  168   1HB   GLU  24          HB2       GLU  24   1.173   1.668  11.180
  169   2HB   GLU  24          HB1       GLU  24   0.264   3.024  10.516
  170   1HG   GLU  24          HG2       GLU  24  -1.779   1.839  10.656
  171   2HG   GLU  24          HG1       GLU  24  -0.953   0.323  10.994
  172    H    ARG  25           HN       ARG  25  -0.010  -0.874  10.113
  173    HA   ARG  25           HA       ARG  25   2.448  -1.996  10.620
  174   1HB   ARG  25          HB2       ARG  25   0.080  -2.873  11.176
  175   2HB   ARG  25          HB1       ARG  25   0.154  -3.683   9.616
  176   1HG   ARG  25          HG2       ARG  25   1.501  -5.294  10.412
  177   2HG   ARG  25          HG1       ARG  25   2.526  -4.126  11.254
  178   1HD   ARG  25          HD2       ARG  25   1.539  -4.523  13.215
  179   2HD   ARG  25          HD1       ARG  25  -0.069  -4.366  12.522
  180    HE   ARG  25           HE       ARG  25  -0.146  -6.620  12.961
  181   1HH1  ARG  25          HH11      ARG  25   2.908  -5.937  11.366
  182   2HH1  ARG  25          HH12      ARG  25   3.380  -7.588  11.322
  183   1HH2  ARG  25          HH21      ARG  25   0.548  -8.805  12.962
  184   2HH2  ARG  25          HH22      ARG  25   2.068  -9.209  12.245
  185    H    CYS  26           HN       CYS  26   0.599  -2.103   7.620
  186    HA   CYS  26           HA       CYS  26   2.456  -3.765   6.272
  187   1HB   CYS  26          HB2       CYS  26   0.979  -2.006   4.508
  188   2HB   CYS  26          HB1       CYS  26   0.979  -3.750   4.598
  189    H    ALA  27           HN       ALA  27   2.071  -0.278   6.593
  190    HA   ALA  27           HA       ALA  27   3.940   0.505   4.632
  191   1HB   ALA  27          HB1       ALA  27   2.263   1.986   5.712
  192   2HB   ALA  27          HB2       ALA  27   3.892   2.665   5.687
  193   3HB   ALA  27          HB3       ALA  27   3.249   1.965   7.173
  194    H    SER  28           HN       SER  28   4.323  -0.165   8.098
  195    HA   SER  28           HA       SER  28   7.069   0.515   8.203
  196   1HB   SER  28          HB2       SER  28   5.257   0.085  10.117
  197   2HB   SER  28          HB1       SER  28   5.970  -1.526  10.077
  198    HG   SER  28           HG       SER  28   7.207   0.939  10.671
  199    H    LEU  29           HN       LEU  29   5.295  -2.408   7.514
  200    HA   LEU  29           HA       LEU  29   7.492  -4.197   7.589
  201   1HB   LEU  29          HB2       LEU  29   4.691  -4.330   7.199
  202   2HB   LEU  29          HB1       LEU  29   5.435  -5.107   5.819
  203    HG   LEU  29           HG       LEU  29   6.477  -5.911   8.469
  204   1HD1  LEU  29          HD11      LEU  29   4.589  -7.488   8.786
  205   2HD1  LEU  29          HD12      LEU  29   3.713  -6.643   7.512
  206   3HD1  LEU  29          HD13      LEU  29   4.131  -5.800   9.003
  207   1HD2  LEU  29          HD21      LEU  29   5.624  -7.477   6.038
  208   2HD2  LEU  29          HD22      LEU  29   6.573  -8.070   7.399
  209   3HD2  LEU  29          HD23      LEU  29   7.250  -6.857   6.314
  210    H    SER  30           HN       SER  30   5.663  -2.885   4.810
  211    HA   SER  30           HA       SER  30   7.867  -3.649   3.061
  212   1HB   SER  30          HB2       SER  30   5.024  -3.571   2.785
  213   2HB   SER  30          HB1       SER  30   5.737  -2.514   1.568
  214    HG   SER  30           HG       SER  30   6.926  -4.220   0.795
  215    H    GLY  31           HN       GLY  31   5.820  -0.753   3.588
  216   1HA   GLY  31          HA2       GLY  31   6.824   1.429   3.838
  217   2HA   GLY  31          HA1       GLY  31   8.163   0.870   2.845
  218    H    CYS  32           HN       CYS  32   4.647   0.759   2.413
  219    HA   CYS  32           HA       CYS  32   4.777   1.372  -0.381
  220   1HB   CYS  32          HB2       CYS  32   2.508   1.168   1.601
  221   2HB   CYS  32          HB1       CYS  32   2.263   1.518  -0.098
  222    H    LYS  33           HN       LYS  33   2.943   3.064  -1.056
  223    HA   LYS  33           HA       LYS  33   3.582   5.617   0.257
  224   1HB   LYS  33          HB2       LYS  33   4.638   5.137  -2.053
  225   2HB   LYS  33          HB1       LYS  33   3.023   5.381  -2.684
  226   1HG   LYS  33          HG2       LYS  33   4.607   7.362  -2.722
  227   2HG   LYS  33          HG1       LYS  33   2.988   7.633  -2.080
  228   1HD   LYS  33          HD2       LYS  33   4.863   8.664  -0.750
  229   2HD   LYS  33          HD1       LYS  33   3.779   7.612   0.159
  230   1HE   LYS  33          HE2       LYS  33   5.396   6.101   0.580
  231   2HE   LYS  33          HE1       LYS  33   6.096   6.255  -1.028
  232   1HZ   LYS  33          HZ1       LYS  33   7.153   8.300  -0.337
  233   2HZ   LYS  33          HZ2       LYS  33   7.604   7.034   0.688
  234   3HZ   LYS  33          HZ3       LYS  33   6.467   8.173   1.201
  235    H    ILE  34           HN       ILE  34   1.806   6.227   1.287
  236    HA   ILE  34           HA       ILE  34  -0.830   5.481   0.538
  237    HB   ILE  34           HB       ILE  34   0.371   6.444   2.814
  238   1HG1  ILE  34          HG12      ILE  34  -2.306   6.748   3.373
  239   2HG1  ILE  34          HG11      ILE  34  -2.324   5.682   1.970
  240   1HG2  ILE  34          HG21      ILE  34  -1.575   8.577   2.001
  241   2HG2  ILE  34          HG22      ILE  34   0.168   8.738   1.813
  242   3HG2  ILE  34          HG23      ILE  34  -0.528   8.540   3.420
  243   1HD1  ILE  34          HD11      ILE  34  -0.710   4.208   3.160
  244   2HD1  ILE  34          HD12      ILE  34  -2.288   4.337   3.937
  245   3HD1  ILE  34          HD13      ILE  34  -0.912   5.227   4.585
  246    H    ILE  35           HN       ILE  35  -2.350   6.541  -0.624
  247    HA   ILE  35           HA       ILE  35  -1.612   8.436  -2.536
  248    HB   ILE  35           HB       ILE  35  -4.460   8.096  -1.591
  249   1HG1  ILE  35          HG12      ILE  35  -3.520   5.874  -1.927
  250   2HG1  ILE  35          HG11      ILE  35  -4.545   6.279  -3.306
  251   1HG2  ILE  35          HG21      ILE  35  -4.629   8.289  -4.211
  252   2HG2  ILE  35          HG22      ILE  35  -3.085   9.110  -4.023
  253   3HG2  ILE  35          HG23      ILE  35  -4.517   9.723  -3.202
  254   1HD1  ILE  35          HD11      ILE  35  -2.775   5.620  -4.471
  255   2HD1  ILE  35          HD12      ILE  35  -1.643   5.925  -3.146
  256   3HD1  ILE  35          HD13      ILE  35  -2.205   7.251  -4.154
  257    H    SER  36           HN       SER  36  -2.743  10.572  -2.879
  258    HA   SER  36           HA       SER  36  -3.201  12.070  -0.431
  259   1HB   SER  36          HB2       SER  36  -0.693  12.044  -1.261
  260   2HB   SER  36          HB1       SER  36  -1.285  13.263  -2.387
  261    HG   SER  36           HG       SER  36  -0.454  14.051  -0.324
  262    H    ALA  37           HN       ALA  37  -4.930  11.264  -2.579
  263    HA   ALA  37           HA       ALA  37  -6.376  13.585  -3.059
  264   1HB   ALA  37          HB1       ALA  37  -4.726  14.467  -4.476
  265   2HB   ALA  37          HB2       ALA  37  -5.914  13.769  -5.580
  266   3HB   ALA  37          HB3       ALA  37  -4.417  12.903  -5.231
  267    H    SER  38           HN       SER  38  -5.358  10.623  -4.658
  268    HA   SER  38           HA       SER  38  -7.474   9.003  -4.414
  269   1HB   SER  38          HB2       SER  38  -8.167  11.209  -6.241
  270   2HB   SER  38          HB1       SER  38  -8.440   9.610  -6.932
  271    HG   SER  38           HG       SER  38 -10.278  10.316  -5.805
  272    H    THR  39           HN       THR  39  -5.798  10.472  -7.187
  273    HA   THR  39           HA       THR  39  -5.111   7.940  -8.318
  274    HB   THR  39           HB       THR  39  -3.851  10.643  -8.862
  275    HG1  THR  39           HG1      THR  39  -6.011  10.803  -9.336
  276   1HG2  THR  39          HG21      THR  39  -2.556   8.761  -9.729
  277   2HG2  THR  39          HG22      THR  39  -3.273   9.722 -11.026
  278   3HG2  THR  39          HG23      THR  39  -3.989   8.175 -10.572
  279    H    CYS  40           HN       CYS  40  -3.047   6.969  -8.305
  280    HA   CYS  40           HA       CYS  40  -1.785   6.928  -5.847
  281   1HB   CYS  40          HB2       CYS  40  -1.016   5.929  -8.546
  282   2HB   CYS  40          HB1       CYS  40   0.060   5.699  -7.176
  283    HA   PRO  41           HA       PRO  41   1.307   9.994  -5.611
  284   1HB   PRO  41          HB2       PRO  41   3.473   8.556  -4.734
  285   2HB   PRO  41          HB1       PRO  41   2.103   8.974  -3.711
  286   1HG   PRO  41          HG2       PRO  41   2.707   6.413  -5.116
  287   2HG   PRO  41          HG1       PRO  41   2.038   6.670  -3.496
  288   1HD   PRO  41          HD2       PRO  41   0.516   5.994  -5.614
  289   2HD   PRO  41          HD1       PRO  41  -0.091   6.986  -4.282
  290    H    SER  42           HN       SER  42   3.910   7.791  -6.305
  291    HA   SER  42           HA       SER  42   4.756   9.383  -8.485
  292   1HB   SER  42          HB2       SER  42   6.612   7.873  -8.677
  293   2HB   SER  42          HB1       SER  42   6.252   8.073  -6.956
  294    HG   SER  42           HG       SER  42   5.076   6.136  -7.062
  295    H    ASP  43           HN       ASP  43   3.595   5.929  -8.572
  296    HA   ASP  43           HA       ASP  43   2.384   6.460 -11.176
  297   1HB   ASP  43          HB2       ASP  43   5.038   5.394 -10.902
  298   2HB   ASP  43          HB1       ASP  43   4.000   4.208 -11.682
  299    H    TYR  44           HN       TYR  44   3.361   3.959  -8.945
  300    HA   TYR  44           HA       TYR  44   1.683   1.875  -9.792
  301   1HB   TYR  44          HB2       TYR  44   2.275   1.114  -7.328
  302   2HB   TYR  44          HB1       TYR  44   3.534   1.221  -8.555
  303    HD1  TYR  44           HD1      TYR  44   5.286   2.855  -8.371
  304    HD2  TYR  44           HD2      TYR  44   2.065   2.875  -5.623
  305    HE1  TYR  44           HE1      TYR  44   6.480   4.483  -6.975
  306    HE2  TYR  44           HE2      TYR  44   3.251   4.494  -4.224
  307    HH   TYR  44           HH       TYR  44   5.150   6.348  -4.770
  308    HA   PRO  45           HA       PRO  45  -2.203   2.874  -7.792
  309   1HB   PRO  45          HB2       PRO  45  -3.246   0.329  -7.839
  310   2HB   PRO  45          HB1       PRO  45  -3.431   1.547  -9.103
  311   1HG   PRO  45          HG2       PRO  45  -1.833  -0.866  -9.107
  312   2HG   PRO  45          HG1       PRO  45  -2.237   0.206 -10.449
  313   1HD   PRO  45          HD2       PRO  45   0.253  -0.017  -9.056
  314   2HD   PRO  45          HD1       PRO  45  -0.155   1.068 -10.392
  315    H    LYS  46           HN       LYS  46  -0.159   0.169  -6.897
  316    HA   LYS  46           HA       LYS  46  -0.054   0.880  -4.223
  317   1HB   LYS  46          HB2       LYS  46  -2.041  -1.094  -4.892
  318   2HB   LYS  46          HB1       LYS  46  -0.910  -1.605  -3.638
  319   1HG   LYS  46          HG2       LYS  46  -1.949   1.091  -3.330
  320   2HG   LYS  46          HG1       LYS  46  -3.151  -0.150  -3.132
  321   1HD   LYS  46          HD2       LYS  46  -0.583  -0.547  -1.753
  322   2HD   LYS  46          HD1       LYS  46  -1.604   0.735  -1.134
  323   1HE   LYS  46          HE2       LYS  46  -2.900  -1.849  -1.678
  324   2HE   LYS  46          HE1       LYS  46  -1.801  -1.807  -0.333
  325   1HZ   LYS  46          HZ1       LYS  46  -3.174   0.226   0.368
  326   2HZ   LYS  46          HZ2       LYS  46  -3.832  -1.312   0.602
  327   3HZ   LYS  46          HZ3       LYS  46  -4.338  -0.370  -0.704
  Start of MODEL    3
    1   1H    LYS   1          HT1       LYS   1  -4.567  -3.008   0.683
    2   2H    LYS   1          HT2       LYS   1  -3.933  -1.894   1.824
    3   3H    LYS   1          HT3       LYS   1  -2.921  -2.536   0.596
    4    HA   LYS   1           HA       LYS   1  -4.342  -1.491  -1.055
    5   1HB   LYS   1          HB2       LYS   1  -6.090  -1.295   1.038
    6   2HB   LYS   1          HB1       LYS   1  -5.452   0.341   0.967
    7   1HG   LYS   1          HG2       LYS   1  -7.531  -0.002  -0.342
    8   2HG   LYS   1          HG1       LYS   1  -6.175   0.600  -1.293
    9   1HD   LYS   1          HD2       LYS   1  -6.354  -2.319  -1.206
   10   2HD   LYS   1          HD1       LYS   1  -7.751  -1.540  -1.952
   11   1HE   LYS   1          HE2       LYS   1  -6.452  -0.543  -3.618
   12   2HE   LYS   1          HE1       LYS   1  -4.957  -0.770  -2.715
   13   1HZ   LYS   1          HZ1       LYS   1  -5.174  -3.168  -3.076
   14   2HZ   LYS   1          HZ2       LYS   1  -5.076  -2.321  -4.537
   15   3HZ   LYS   1          HZ3       LYS   1  -6.567  -2.909  -4.000
   16    H    SER   2           HN       SER   2  -4.539   1.381  -0.515
   17    HA   SER   2           HA       SER   2  -3.255   3.261  -0.337
   18   1HB   SER   2          HB2       SER   2  -1.574   3.373   1.225
   19   2HB   SER   2          HB1       SER   2  -2.345   1.879   1.754
   20    HG   SER   2           HG       SER   2  -0.738   0.712   0.840
   21    H    CYS   3           HN       CYS   3  -1.248   4.207  -1.247
   22    HA   CYS   3           HA       CYS   3  -0.761   3.185  -3.854
   23   1HB   CYS   3          HB2       CYS   3  -0.736   5.543  -3.624
   24   2HB   CYS   3          HB1       CYS   3   0.385   5.473  -2.273
   25    H    CYS   4           HN       CYS   4   0.546   1.540  -4.320
   26    HA   CYS   4           HA       CYS   4   2.824   1.105  -2.497
   27   1HB   CYS   4          HB2       CYS   4   1.305  -0.844  -4.220
   28   2HB   CYS   4          HB1       CYS   4   2.788  -1.251  -3.366
   29    HA   PRO   5           HA       PRO   5   5.009   2.556  -6.247
   30   1HB   PRO   5          HB2       PRO   5   7.250   2.537  -4.307
   31   2HB   PRO   5          HB1       PRO   5   6.726   3.810  -5.414
   32   1HG   PRO   5          HG2       PRO   5   6.265   4.006  -2.798
   33   2HG   PRO   5          HG1       PRO   5   5.059   4.553  -3.980
   34   1HD   PRO   5          HD2       PRO   5   5.129   2.032  -2.367
   35   2HD   PRO   5          HD1       PRO   5   3.750   3.085  -2.749
   36    H    ASN   6           HN       ASN   6   4.757  -0.390  -5.025
   37    HA   ASN   6           HA       ASN   6   6.419  -1.601  -6.933
   38   1HB   ASN   6          HB2       ASN   6   8.027  -2.718  -5.339
   39   2HB   ASN   6          HB1       ASN   6   8.306  -0.999  -5.598
   40   1HD2  ASN   6          HD21      ASN   6   9.502  -1.154  -3.594
   41   2HD2  ASN   6          HD22      ASN   6   8.654  -1.039  -2.093
   42    H    THR   7           HN       THR   7   5.862  -3.712  -7.224
   43    HA   THR   7           HA       THR   7   3.519  -4.707  -6.106
   44    HB   THR   7           HB       THR   7   4.209  -5.639  -8.165
   45    HG1  THR   7           HG1      THR   7   3.573  -7.533  -7.585
   46   1HG2  THR   7          HG21      THR   7   6.481  -7.210  -7.555
   47   2HG2  THR   7          HG22      THR   7   6.822  -5.544  -7.086
   48   3HG2  THR   7          HG23      THR   7   6.320  -5.910  -8.737
   49    H    THR   8           HN       THR   8   6.858  -5.094  -5.127
   50    HA   THR   8           HA       THR   8   6.582  -7.167  -3.277
   51    HB   THR   8           HB       THR   8   8.574  -5.950  -2.136
   52    HG1  THR   8           HG1      THR   8   8.158  -3.907  -3.067
   53   1HG2  THR   8          HG21      THR   8   8.563  -7.780  -4.053
   54   2HG2  THR   8          HG22      THR   8  10.044  -7.005  -3.491
   55   3HG2  THR   8          HG23      THR   8   9.261  -6.444  -4.968
   56    H    GLY   9           HN       GLY   9   5.469  -3.915  -3.167
   57   1HA   GLY   9          HA2       GLY   9   5.106  -4.024  -0.260
   58   2HA   GLY   9          HA1       GLY   9   4.892  -2.600  -1.272
   59    H    ARG  10           HN       ARG  10   3.340  -3.773  -3.282
   60    HA   ARG  10           HA       ARG  10   0.760  -3.436  -2.334
   61   1HB   ARG  10          HB2       ARG  10   1.033  -3.262  -4.651
   62   2HB   ARG  10          HB1       ARG  10   1.910  -4.779  -4.756
   63   1HG   ARG  10          HG2       ARG  10  -0.164  -5.208  -5.732
   64   2HG   ARG  10          HG1       ARG  10  -0.284  -5.905  -4.116
   65   1HD   ARG  10          HD2       ARG  10  -2.275  -4.763  -4.267
   66   2HD   ARG  10          HD1       ARG  10  -1.243  -3.559  -3.498
   67    HE   ARG  10           HE       ARG  10  -1.926  -3.590  -6.356
   68   1HH1  ARG  10          HH11      ARG  10  -1.061  -1.851  -3.456
   69   2HH1  ARG  10          HH12      ARG  10  -1.174  -0.302  -4.214
   70   1HH2  ARG  10          HH21      ARG  10  -2.064  -1.582  -7.351
   71   2HH2  ARG  10          HH22      ARG  10  -1.736  -0.150  -6.441
   72    H    ASN  11           HN       ASN  11   2.576  -6.440  -2.812
   73    HA   ASN  11           HA       ASN  11   0.516  -8.196  -2.143
   74   1HB   ASN  11          HB2       ASN  11   3.426  -8.678  -1.531
   75   2HB   ASN  11          HB1       ASN  11   2.194  -9.849  -1.959
   76   1HD2  ASN  11          HD21      ASN  11   4.856  -8.991  -3.129
   77   2HD2  ASN  11          HD22      ASN  11   4.515  -8.773  -4.809
   78    H    ILE  12           HN       ILE  12   3.199  -7.163  -0.012
   79    HA   ILE  12           HA       ILE  12   2.100  -8.327   2.278
   80    HB   ILE  12           HB       ILE  12   4.048  -6.047   2.008
   81   1HG1  ILE  12          HG12      ILE  12   5.389  -8.130   3.120
   82   2HG1  ILE  12          HG11      ILE  12   4.211  -8.993   2.136
   83   1HG2  ILE  12          HG21      ILE  12   4.591  -6.551   4.421
   84   2HG2  ILE  12          HG22      ILE  12   3.074  -7.448   4.487
   85   3HG2  ILE  12          HG23      ILE  12   3.062  -5.719   4.138
   86   1HD1  ILE  12          HD11      ILE  12   6.033  -6.848   1.094
   87   2HD1  ILE  12          HD12      ILE  12   4.983  -7.907   0.156
   88   3HD1  ILE  12          HD13      ILE  12   6.374  -8.574   1.010
   89    H    TYR  13           HN       TYR  13   1.767  -5.006   1.062
   90    HA   TYR  13           HA       TYR  13   0.318  -4.057   3.270
   91   1HB   TYR  13          HB2       TYR  13   1.440  -2.860   1.216
   92   2HB   TYR  13          HB1       TYR  13  -0.172  -2.994   0.532
   93    HD1  TYR  13           HD1      TYR  13  -2.076  -2.267   2.351
   94    HD2  TYR  13           HD2      TYR  13   1.937  -0.869   2.227
   95    HE1  TYR  13           HE1      TYR  13  -2.751  -0.237   3.564
   96    HE2  TYR  13           HE2      TYR  13   1.275   1.163   3.439
   97    HH   TYR  13           HH       TYR  13  -0.435   2.010   4.824
   98    H    ASN  14           HN       ASN  14  -0.735  -5.431   0.177
   99    HA   ASN  14           HA       ASN  14  -3.488  -5.123   0.682
  100   1HB   ASN  14          HB2       ASN  14  -1.851  -6.669  -1.279
  101   2HB   ASN  14          HB1       ASN  14  -3.565  -7.001  -1.138
  102   1HD2  ASN  14          HD21      ASN  14  -1.855  -3.906  -0.832
  103   2HD2  ASN  14          HD22      ASN  14  -2.667  -3.133  -2.145
  104    H    THR  15           HN       THR  15  -1.346  -8.021   0.950
  105    HA   THR  15           HA       THR  15  -3.440  -9.637   1.983
  106    HB   THR  15           HB       THR  15  -1.564 -10.776   1.087
  107    HG1  THR  15           HG1      THR  15  -1.407 -11.076   3.896
  108   1HG2  THR  15          HG21      THR  15   0.534 -10.112   1.294
  109   2HG2  THR  15          HG22      THR  15   0.467 -10.394   3.034
  110   3HG2  THR  15          HG23      THR  15   0.009  -8.823   2.379
  111    H    CYS  16           HN       CYS  16  -0.996  -7.605   3.502
  112    HA   CYS  16           HA       CYS  16  -1.347  -8.281   6.162
  113   1HB   CYS  16          HB2       CYS  16   0.369  -6.746   5.708
  114   2HB   CYS  16          HB1       CYS  16  -0.680  -5.717   4.746
  115    H    ARG  17           HN       ARG  17  -3.062  -5.799   4.272
  116    HA   ARG  17           HA       ARG  17  -4.945  -5.125   6.249
  117   1HB   ARG  17          HB2       ARG  17  -4.567  -4.649   3.384
  118   2HB   ARG  17          HB1       ARG  17  -6.259  -4.720   3.854
  119   1HG   ARG  17          HG2       ARG  17  -4.468  -3.064   5.527
  120   2HG   ARG  17          HG1       ARG  17  -4.842  -2.472   3.907
  121   1HD   ARG  17          HD2       ARG  17  -6.878  -3.287   5.979
  122   2HD   ARG  17          HD1       ARG  17  -6.405  -1.626   5.621
  123    HE   ARG  17           HE       ARG  17  -8.172  -3.294   4.090
  124   1HH1  ARG  17          HH11      ARG  17  -5.999  -0.565   3.964
  125   2HH1  ARG  17          HH12      ARG  17  -6.755   0.130   2.571
  126   1HH2  ARG  17          HH21      ARG  17  -9.167  -2.379   2.257
  127   2HH2  ARG  17          HH22      ARG  17  -8.553  -0.898   1.602
  128    H    LEU  18           HN       LEU  18  -4.838  -7.657   3.821
  129    HA   LEU  18           HA       LEU  18  -7.509  -8.493   3.985
  130   1HB   LEU  18          HB2       LEU  18  -6.839  -9.928   2.390
  131   2HB   LEU  18          HB1       LEU  18  -5.263  -9.195   2.533
  132    HG   LEU  18           HG       LEU  18  -4.724 -10.940   4.260
  133   1HD1  LEU  18          HD11      LEU  18  -6.387 -13.014   3.491
  134   2HD1  LEU  18          HD12      LEU  18  -7.482 -11.648   3.708
  135   3HD1  LEU  18          HD13      LEU  18  -6.430 -12.154   5.030
  136   1HD2  LEU  18          HD21      LEU  18  -5.167 -12.638   1.993
  137   2HD2  LEU  18          HD22      LEU  18  -3.663 -11.930   2.578
  138   3HD2  LEU  18          HD23      LEU  18  -4.681 -11.031   1.454
  139    H    GLY  19           HN       GLY  19  -4.868  -8.849   6.146
  140   1HA   GLY  19          HA2       GLY  19  -6.328 -10.909   7.654
  141   2HA   GLY  19          HA1       GLY  19  -4.607 -10.594   7.797
  142    H    GLY  20           HN       GLY  20  -6.734  -7.879   7.598
  143   1HA   GLY  20          HA2       GLY  20  -7.433  -6.348   9.164
  144   2HA   GLY  20          HA1       GLY  20  -7.270  -7.610  10.374
  145    H    GLY  21           HN       GLY  21  -5.110  -5.691   8.294
  146   1HA   GLY  21          HA2       GLY  21  -3.507  -5.085  10.688
  147   2HA   GLY  21          HA1       GLY  21  -2.754  -5.532   9.163
  148    H    SER  22           HN       SER  22  -3.355  -3.009  11.051
  149    HA   SER  22           HA       SER  22  -4.511  -0.963   9.714
  150   1HB   SER  22          HB2       SER  22  -1.933  -0.112  10.795
  151   2HB   SER  22          HB1       SER  22  -3.565   0.352  11.272
  152    HG   SER  22           HG       SER  22  -3.654  -1.318  12.659
  153    H    ARG  23           HN       ARG  23  -3.778   0.718   8.336
  154    HA   ARG  23           HA       ARG  23  -2.434  -0.202   6.049
  155   1HB   ARG  23          HB2       ARG  23  -3.781   2.212   6.922
  156   2HB   ARG  23          HB1       ARG  23  -2.377   2.574   5.933
  157   1HG   ARG  23          HG2       ARG  23  -3.352   1.831   4.058
  158   2HG   ARG  23          HG1       ARG  23  -4.082   0.446   4.870
  159   1HD   ARG  23          HD2       ARG  23  -5.868   1.819   4.142
  160   2HD   ARG  23          HD1       ARG  23  -5.733   2.052   5.884
  161    HE   ARG  23           HE       ARG  23  -5.183   4.243   5.515
  162   1HH1  ARG  23          HH11      ARG  23  -4.872   2.481   2.518
  163   2HH1  ARG  23          HH12      ARG  23  -4.615   3.903   1.564
  164   1HH2  ARG  23          HH21      ARG  23  -4.846   6.114   4.261
  165   2HH2  ARG  23          HH22      ARG  23  -4.601   5.966   2.553
  166    H    GLU  24           HN       GLU  24  -1.413   1.731   8.775
  167    HA   GLU  24           HA       GLU  24   1.122   2.435   7.707
  168   1HB   GLU  24          HB2       GLU  24   0.644   2.313  10.653
  169   2HB   GLU  24          HB1       GLU  24   1.506   3.521   9.709
  170   1HG   GLU  24          HG2       GLU  24  -0.807   4.084   8.728
  171   2HG   GLU  24          HG1       GLU  24  -1.437   3.199  10.116
  172    H    ARG  25           HN       ARG  25   0.004  -0.243   9.731
  173    HA   ARG  25           HA       ARG  25   2.504  -1.192  10.537
  174   1HB   ARG  25          HB2       ARG  25  -0.003  -1.968  11.054
  175   2HB   ARG  25          HB1       ARG  25   0.403  -3.184   9.851
  176   1HG   ARG  25          HG2       ARG  25   1.903  -4.223  11.199
  177   2HG   ARG  25          HG1       ARG  25   2.350  -2.734  12.035
  178   1HD   ARG  25          HD2       ARG  25   0.724  -2.960  13.586
  179   2HD   ARG  25          HD1       ARG  25  -0.423  -3.642  12.435
  180    HE   ARG  25           HE       ARG  25   0.219  -5.723  13.109
  181   1HH1  ARG  25          HH11      ARG  25   2.713  -3.457  14.016
  182   2HH1  ARG  25          HH12      ARG  25   3.637  -4.631  14.890
  183   1HH2  ARG  25          HH21      ARG  25   1.433  -7.270  14.258
  184   2HH2  ARG  25          HH22      ARG  25   2.910  -6.797  15.027
  185    H    CYS  26           HN       CYS  26   0.586  -2.072   7.685
  186    HA   CYS  26           HA       CYS  26   2.601  -3.787   6.619
  187   1HB   CYS  26          HB2       CYS  26   0.813  -2.673   4.603
  188   2HB   CYS  26          HB1       CYS  26   1.077  -4.342   5.070
  189    H    ALA  27           HN       ALA  27   1.751  -0.416   6.275
  190    HA   ALA  27           HA       ALA  27   3.250   0.288   4.051
  191   1HB   ALA  27          HB1       ALA  27   1.663   1.766   5.291
  192   2HB   ALA  27          HB2       ALA  27   3.188   2.539   4.864
  193   3HB   ALA  27          HB3       ALA  27   2.911   1.990   6.516
  194    H    SER  28           HN       SER  28   4.264   0.363   7.475
  195    HA   SER  28           HA       SER  28   6.963   1.004   6.862
  196   1HB   SER  28          HB2       SER  28   5.760   1.422   9.067
  197   2HB   SER  28          HB1       SER  28   5.991  -0.291   9.409
  198    HG   SER  28           HG       SER  28   7.865   0.320  10.127
  199    H    LEU  29           HN       LEU  29   5.154  -1.909   6.910
  200    HA   LEU  29           HA       LEU  29   7.271  -3.728   7.407
  201   1HB   LEU  29          HB2       LEU  29   4.503  -3.867   7.066
  202   2HB   LEU  29          HB1       LEU  29   5.166  -4.829   5.758
  203    HG   LEU  29           HG       LEU  29   6.198  -5.293   8.517
  204   1HD1  LEU  29          HD11      LEU  29   4.293  -7.070   8.608
  205   2HD1  LEU  29          HD12      LEU  29   3.455  -5.943   7.543
  206   3HD1  LEU  29          HD13      LEU  29   3.987  -5.416   9.139
  207   1HD2  LEU  29          HD21      LEU  29   6.490  -7.531   7.711
  208   2HD2  LEU  29          HD22      LEU  29   7.135  -6.418   6.505
  209   3HD2  LEU  29          HD23      LEU  29   5.564  -7.177   6.253
  210    H    SER  30           HN       SER  30   5.729  -2.622   4.375
  211    HA   SER  30           HA       SER  30   7.975  -3.847   2.937
  212   1HB   SER  30          HB2       SER  30   5.277  -4.167   2.497
  213   2HB   SER  30          HB1       SER  30   5.730  -2.976   1.281
  214    HG   SER  30           HG       SER  30   7.454  -4.448   0.701
  215    H    GLY  31           HN       GLY  31   5.779  -1.225   1.927
  216   1HA   GLY  31          HA2       GLY  31   7.199   1.007   2.269
  217   2HA   GLY  31          HA1       GLY  31   8.094   0.237   0.976
  218    H    CYS  32           HN       CYS  32   4.586   0.236   1.431
  219    HA   CYS  32           HA       CYS  32   4.118   1.017  -1.278
  220   1HB   CYS  32          HB2       CYS  32   2.328   0.731   1.144
  221   2HB   CYS  32          HB1       CYS  32   1.726   1.209  -0.434
  222    H    LYS  33           HN       LYS  33   1.832   2.851   0.105
  223    HA   LYS  33           HA       LYS  33   3.172   5.158   0.998
  224   1HB   LYS  33          HB2       LYS  33   3.273   4.818  -1.766
  225   2HB   LYS  33          HB1       LYS  33   1.972   5.967  -1.517
  226   1HG   LYS  33          HG2       LYS  33   3.685   7.432  -1.630
  227   2HG   LYS  33          HG1       LYS  33   3.792   7.060   0.090
  228   1HD   LYS  33          HD2       LYS  33   5.256   5.163  -1.556
  229   2HD   LYS  33          HD1       LYS  33   5.823   6.820  -1.766
  230   1HE   LYS  33          HE2       LYS  33   5.339   6.073   1.020
  231   2HE   LYS  33          HE1       LYS  33   6.594   5.117   0.233
  232   1HZ   LYS  33          HZ1       LYS  33   6.552   8.078   0.155
  233   2HZ   LYS  33          HZ2       LYS  33   7.829   7.047  -0.253
  234   3HZ   LYS  33          HZ3       LYS  33   7.355   7.207   1.362
  235    H    ILE  34           HN       ILE  34   1.711   5.903   2.364
  236    HA   ILE  34           HA       ILE  34  -1.072   5.288   2.057
  237    HB   ILE  34           HB       ILE  34   0.160   5.352   4.253
  238   1HG1  ILE  34          HG12      ILE  34  -1.868   6.824   5.273
  239   2HG1  ILE  34          HG11      ILE  34  -2.488   6.512   3.654
  240   1HG2  ILE  34          HG21      ILE  34   1.072   7.749   3.571
  241   2HG2  ILE  34          HG22      ILE  34   0.861   7.260   5.253
  242   3HG2  ILE  34          HG23      ILE  34  -0.360   8.258   4.466
  243   1HD1  ILE  34          HD11      ILE  34  -2.410   4.173   3.979
  244   2HD1  ILE  34          HD12      ILE  34  -3.152   4.861   5.424
  245   3HD1  ILE  34          HD13      ILE  34  -1.467   4.342   5.460
  246    H    ILE  35           HN       ILE  35  -1.835   6.359   0.237
  247    HA   ILE  35           HA       ILE  35  -2.355   9.200   0.644
  248    HB   ILE  35           HB       ILE  35  -1.159   8.242  -1.958
  249   1HG1  ILE  35          HG12      ILE  35   0.684   9.928  -1.166
  250   2HG1  ILE  35          HG11      ILE  35   0.052   9.582   0.438
  251   1HG2  ILE  35          HG21      ILE  35  -1.626  10.255  -2.830
  252   2HG2  ILE  35          HG22      ILE  35  -1.240  11.105  -1.334
  253   3HG2  ILE  35          HG23      ILE  35  -2.822  10.354  -1.538
  254   1HD1  ILE  35          HD11      ILE  35   1.356   7.803   0.505
  255   2HD1  ILE  35          HD12      ILE  35   1.850   8.059  -1.168
  256   3HD1  ILE  35          HD13      ILE  35   0.414   7.101  -0.810
  257    H    SER  36           HN       SER  36  -2.638   6.853  -2.034
  258    HA   SER  36           HA       SER  36  -4.507   5.901  -2.970
  259   1HB   SER  36          HB2       SER  36  -6.569   5.959  -1.961
  260   2HB   SER  36          HB1       SER  36  -5.579   6.469  -0.594
  261    HG   SER  36           HG       SER  36  -6.364   8.442  -0.743
  262    H    ALA  37           HN       ALA  37  -3.395   8.967  -3.102
  263    HA   ALA  37           HA       ALA  37  -5.300  10.330  -4.667
  264   1HB   ALA  37          HB1       ALA  37  -2.322  10.725  -4.827
  265   2HB   ALA  37          HB2       ALA  37  -3.298  11.324  -3.487
  266   3HB   ALA  37          HB3       ALA  37  -3.595  11.907  -5.124
  267    H    SER  38           HN       SER  38  -3.245   7.707  -5.366
  268    HA   SER  38           HA       SER  38  -3.211   6.370  -7.224
  269   1HB   SER  38          HB2       SER  38  -5.299   8.069  -7.916
  270   2HB   SER  38          HB1       SER  38  -4.165   8.220  -9.259
  271    HG   SER  38           HG       SER  38  -5.853   6.391  -9.128
  272    H    THR  39           HN       THR  39  -2.496   9.795  -7.872
  273    HA   THR  39           HA       THR  39  -0.775   9.681  -9.936
  274    HB   THR  39           HB       THR  39  -0.124  11.275  -7.458
  275    HG1  THR  39           HG1      THR  39  -2.117  11.937  -7.715
  276   1HG2  THR  39          HG21      THR  39   0.453  13.016  -9.168
  277   2HG2  THR  39          HG22      THR  39   0.339  11.745 -10.385
  278   3HG2  THR  39          HG23      THR  39   1.535  11.625  -9.096
  279    H    CYS  40           HN       CYS  40   0.127   9.052  -6.563
  280    HA   CYS  40           HA       CYS  40   1.914   8.025  -5.610
  281   1HB   CYS  40          HB2       CYS  40   1.547   6.478  -8.152
  282   2HB   CYS  40          HB1       CYS  40   2.790   6.037  -6.989
  283    HA   PRO  41           HA       PRO  41   5.818   9.736  -6.537
  284   1HB   PRO  41          HB2       PRO  41   7.447   7.462  -6.426
  285   2HB   PRO  41          HB1       PRO  41   7.001   8.489  -5.062
  286   1HG   PRO  41          HG2       PRO  41   5.820   5.903  -5.961
  287   2HG   PRO  41          HG1       PRO  41   6.084   6.509  -4.314
  288   1HD   PRO  41          HD2       PRO  41   3.651   6.519  -5.403
  289   2HD   PRO  41          HD1       PRO  41   4.196   7.866  -4.381
  290    H    SER  42           HN       SER  42   6.513   6.544  -7.898
  291    HA   SER  42           HA       SER  42   7.595   7.679 -10.263
  292   1HB   SER  42          HB2       SER  42   7.012   4.845  -9.418
  293   2HB   SER  42          HB1       SER  42   7.675   5.227 -11.007
  294    HG   SER  42           HG       SER  42   9.431   6.233  -9.946
  295    H    ASP  43           HN       ASP  43   5.322   5.003 -10.543
  296    HA   ASP  43           HA       ASP  43   3.440   6.661 -12.030
  297   1HB   ASP  43          HB2       ASP  43   5.180   4.546 -13.214
  298   2HB   ASP  43          HB1       ASP  43   3.529   4.695 -13.805
  299    H    TYR  44           HN       TYR  44   3.566   4.920  -9.540
  300    HA   TYR  44           HA       TYR  44   1.939   2.653 -10.049
  301   1HB   TYR  44          HB2       TYR  44   3.489   3.343  -7.991
  302   2HB   TYR  44          HB1       TYR  44   1.949   3.893  -7.350
  303    HD1  TYR  44           HD1      TYR  44   3.528   0.910  -8.926
  304    HD2  TYR  44           HD2      TYR  44   0.572   2.395  -6.253
  305    HE1  TYR  44           HE1      TYR  44   2.989  -1.393  -8.249
  306    HE2  TYR  44           HE2      TYR  44   0.033   0.099  -5.568
  307    HH   TYR  44           HH       TYR  44   0.786  -2.540  -7.225
  308    HA   PRO  45           HA       PRO  45  -1.976   4.722  -9.951
  309   1HB   PRO  45          HB2       PRO  45  -3.525   2.569 -10.259
  310   2HB   PRO  45          HB1       PRO  45  -2.369   3.066 -11.500
  311   1HG   PRO  45          HG2       PRO  45  -2.268   0.766  -9.661
  312   2HG   PRO  45          HG1       PRO  45  -1.439   1.005 -11.206
  313   1HD   PRO  45          HD2       PRO  45  -0.429   1.426  -8.521
  314   2HD   PRO  45          HD1       PRO  45   0.448   1.515 -10.060
  315    H    LYS  46           HN       LYS  46  -1.129   2.746  -7.215
  316    HA   LYS  46           HA       LYS  46  -3.786   2.956  -6.072
  317   1HB   LYS  46          HB2       LYS  46  -1.472   1.337  -5.596
  318   2HB   LYS  46          HB1       LYS  46  -1.939   2.120  -4.100
  319   1HG   LYS  46          HG2       LYS  46  -3.603   0.306  -5.815
  320   2HG   LYS  46          HG1       LYS  46  -3.074   0.054  -4.152
  321   1HD   LYS  46          HD2       LYS  46  -4.921   1.031  -3.394
  322   2HD   LYS  46          HD1       LYS  46  -4.528   2.504  -4.278
  323   1HE   LYS  46          HE2       LYS  46  -5.671   0.261  -5.839
  324   2HE   LYS  46          HE1       LYS  46  -6.752   1.090  -4.720
  325   1HZ   LYS  46          HZ1       LYS  46  -5.780   3.199  -5.852
  326   2HZ   LYS  46          HZ2       LYS  46  -7.007   2.322  -6.620
  327   3HZ   LYS  46          HZ3       LYS  46  -5.399   2.134  -7.110
  Start of MODEL    4
    1   1H    LYS   1          HT1       LYS   1  -7.685   3.053  -2.907
    2   2H    LYS   1          HT2       LYS   1  -8.266   3.251  -1.304
    3   3H    LYS   1          HT3       LYS   1  -8.856   1.968  -2.282
    4    HA   LYS   1           HA       LYS   1  -7.236   1.310  -0.583
    5   1HB   LYS   1          HB2       LYS   1  -7.011   0.859  -3.520
    6   2HB   LYS   1          HB1       LYS   1  -5.754   0.192  -2.492
    7   1HG   LYS   1          HG2       LYS   1  -8.696  -0.340  -2.143
    8   2HG   LYS   1          HG1       LYS   1  -7.578  -1.398  -3.007
    9   1HD   LYS   1          HD2       LYS   1  -7.363  -0.609  -0.101
   10   2HD   LYS   1          HD1       LYS   1  -7.966  -2.153  -0.701
   11   1HE   LYS   1          HE2       LYS   1  -5.184  -1.057  -1.094
   12   2HE   LYS   1          HE1       LYS   1  -5.646  -2.336   0.024
   13   1HZ   LYS   1          HZ1       LYS   1  -4.680  -3.203  -2.031
   14   2HZ   LYS   1          HZ2       LYS   1  -5.917  -2.479  -2.931
   15   3HZ   LYS   1          HZ3       LYS   1  -6.281  -3.715  -1.836
   16    H    SER   2           HN       SER   2  -4.683   0.766  -0.947
   17    HA   SER   2           HA       SER   2  -3.394   3.329  -0.634
   18   1HB   SER   2          HB2       SER   2  -1.408   1.685  -0.064
   19   2HB   SER   2          HB1       SER   2  -2.700   1.978   1.098
   20    HG   SER   2           HG       SER   2  -1.965  -0.325   0.082
   21    H    CYS   3           HN       CYS   3  -1.060   3.407  -1.439
   22    HA   CYS   3           HA       CYS   3  -0.929   2.383  -4.202
   23   1HB   CYS   3          HB2       CYS   3  -1.440   4.699  -4.423
   24   2HB   CYS   3          HB1       CYS   3  -0.288   5.144  -3.170
   25    H    CYS   4           HN       CYS   4   0.884   1.319  -4.708
   26    HA   CYS   4           HA       CYS   4   3.285   1.774  -3.081
   27   1HB   CYS   4          HB2       CYS   4   1.737  -0.496  -2.843
   28   2HB   CYS   4          HB1       CYS   4   2.979  -0.995  -3.986
   29    HA   PRO   5           HA       PRO   5   5.168   2.176  -7.049
   30   1HB   PRO   5          HB2       PRO   5   7.771   1.817  -6.376
   31   2HB   PRO   5          HB1       PRO   5   6.868   3.283  -5.983
   32   1HG   PRO   5          HG2       PRO   5   7.496   0.925  -4.250
   33   2HG   PRO   5          HG1       PRO   5   7.568   2.653  -3.857
   34   1HD   PRO   5          HD2       PRO   5   5.497   1.074  -3.119
   35   2HD   PRO   5          HD1       PRO   5   5.298   2.795  -3.499
   36    H    ASN   6           HN       ASN   6   4.961  -0.792  -5.467
   37    HA   ASN   6           HA       ASN   6   5.602  -2.195  -7.888
   38   1HB   ASN   6          HB2       ASN   6   7.460  -2.274  -5.544
   39   2HB   ASN   6          HB1       ASN   6   7.238  -3.728  -6.512
   40   1HD2  ASN   6          HD21      ASN   6   9.114  -1.092  -6.128
   41   2HD2  ASN   6          HD22      ASN   6   9.755  -0.943  -7.725
   42    H    THR   7           HN       THR   7   4.767  -4.269  -7.955
   43    HA   THR   7           HA       THR   7   2.548  -4.826  -6.366
   44    HB   THR   7           HB       THR   7   2.469  -6.968  -7.451
   45    HG1  THR   7           HG1      THR   7   5.200  -6.506  -8.037
   46   1HG2  THR   7          HG21      THR   7   3.817  -5.410  -9.588
   47   2HG2  THR   7          HG22      THR   7   2.331  -4.778  -8.879
   48   3HG2  THR   7          HG23      THR   7   2.337  -6.367  -9.644
   49    H    THR   8           HN       THR   8   5.913  -5.670  -5.981
   50    HA   THR   8           HA       THR   8   5.712  -7.730  -4.114
   51    HB   THR   8           HB       THR   8   7.963  -6.496  -3.283
   52    HG1  THR   8           HG1      THR   8   7.381  -4.725  -4.784
   53   1HG2  THR   8          HG21      THR   8   7.695  -8.723  -4.477
   54   2HG2  THR   8          HG22      THR   8   9.203  -7.845  -4.728
   55   3HG2  THR   8          HG23      THR   8   7.951  -7.820  -5.969
   56    H    GLY   9           HN       GLY   9   5.373  -4.267  -3.757
   57   1HA   GLY   9          HA2       GLY   9   5.322  -4.410  -0.854
   58   2HA   GLY   9          HA1       GLY   9   5.091  -2.967  -1.835
   59    H    ARG  10           HN       ARG  10   3.072  -3.796  -3.513
   60    HA   ARG  10           HA       ARG  10   0.766  -3.266  -2.071
   61   1HB   ARG  10          HB2       ARG  10   1.151  -4.704  -4.699
   62   2HB   ARG  10          HB1       ARG  10  -0.436  -4.312  -4.055
   63   1HG   ARG  10          HG2       ARG  10   1.720  -2.312  -4.696
   64   2HG   ARG  10          HG1       ARG  10   0.333  -2.689  -5.720
   65   1HD   ARG  10          HD2       ARG  10   0.137  -1.648  -2.898
   66   2HD   ARG  10          HD1       ARG  10   0.053  -0.637  -4.338
   67    HE   ARG  10           HE       ARG  10  -1.872  -2.514  -4.743
   68   1HH1  ARG  10          HH11      ARG  10  -1.164  -0.315  -2.130
   69   2HH1  ARG  10          HH12      ARG  10  -2.826  -0.097  -1.700
   70   1HH2  ARG  10          HH21      ARG  10  -4.054  -2.222  -4.186
   71   2HH2  ARG  10          HH22      ARG  10  -4.464  -1.169  -2.876
   72    H    ASN  11           HN       ASN  11   2.366  -6.307  -2.729
   73    HA   ASN  11           HA       ASN  11   0.321  -8.071  -2.008
   74   1HB   ASN  11          HB2       ASN  11   3.311  -8.214  -2.109
   75   2HB   ASN  11          HB1       ASN  11   2.408  -9.531  -1.382
   76   1HD2  ASN  11          HD21      ASN  11   3.899  -8.732  -4.071
   77   2HD2  ASN  11          HD22      ASN  11   2.929  -9.536  -5.252
   78    H    ILE  12           HN       ILE  12   3.077  -6.960  -0.005
   79    HA   ILE  12           HA       ILE  12   2.150  -8.147   2.353
   80    HB   ILE  12           HB       ILE  12   3.900  -5.713   2.010
   81   1HG1  ILE  12          HG12      ILE  12   5.538  -7.634   2.911
   82   2HG1  ILE  12          HG11      ILE  12   4.355  -8.647   2.089
   83   1HG2  ILE  12          HG21      ILE  12   2.937  -7.114   4.443
   84   2HG2  ILE  12          HG22      ILE  12   3.317  -5.410   4.191
   85   3HG2  ILE  12          HG23      ILE  12   4.617  -6.579   4.413
   86   1HD1  ILE  12          HD11      ILE  12   5.360  -8.229   0.173
   87   2HD1  ILE  12          HD12      ILE  12   6.503  -7.162   0.989
   88   3HD1  ILE  12          HD13      ILE  12   4.990  -6.514   0.356
   89    H    TYR  13           HN       TYR  13   1.623  -4.870   1.098
   90    HA   TYR  13           HA       TYR  13   0.153  -3.940   3.298
   91   1HB   TYR  13          HB2       TYR  13   1.159  -2.816   1.080
   92   2HB   TYR  13          HB1       TYR  13  -0.517  -2.964   0.587
   93    HD1  TYR  13           HD1      TYR  13   1.856  -1.186   2.637
   94    HD2  TYR  13           HD2      TYR  13  -2.293  -1.806   1.936
   95    HE1  TYR  13           HE1      TYR  13   1.347   0.866   3.888
   96    HE2  TYR  13           HE2      TYR  13  -2.815   0.247   3.185
   97    HH   TYR  13           HH       TYR  13  -0.364   1.993   4.961
   98    H    ASN  14           HN       ASN  14  -0.771  -5.620   0.343
   99    HA   ASN  14           HA       ASN  14  -3.563  -5.456   0.709
  100   1HB   ASN  14          HB2       ASN  14  -1.712  -7.017  -1.017
  101   2HB   ASN  14          HB1       ASN  14  -3.347  -7.626  -0.826
  102   1HD2  ASN  14          HD21      ASN  14  -1.808  -4.453  -1.271
  103   2HD2  ASN  14          HD22      ASN  14  -2.860  -3.933  -2.537
  104    H    THR  15           HN       THR  15  -1.350  -8.261   1.175
  105    HA   THR  15           HA       THR  15  -3.307  -9.854   2.415
  106    HB   THR  15           HB       THR  15  -1.450 -11.052   1.695
  107    HG1  THR  15           HG1      THR  15  -0.912 -10.774   4.459
  108   1HG2  THR  15          HG21      THR  15   0.500 -10.047   1.415
  109   2HG2  THR  15          HG22      THR  15   0.790 -10.281   3.140
  110   3HG2  THR  15          HG23      THR  15   0.081  -8.774   2.562
  111    H    CYS  16           HN       CYS  16  -0.946  -7.595   3.759
  112    HA   CYS  16           HA       CYS  16  -1.278  -8.037   6.461
  113   1HB   CYS  16          HB2       CYS  16   0.357  -6.463   5.865
  114   2HB   CYS  16          HB1       CYS  16  -0.747  -5.567   4.834
  115    H    ARG  17           HN       ARG  17  -3.104  -5.769   4.407
  116    HA   ARG  17           HA       ARG  17  -5.011  -5.032   6.327
  117   1HB   ARG  17          HB2       ARG  17  -4.661  -4.777   3.437
  118   2HB   ARG  17          HB1       ARG  17  -6.350  -4.903   3.910
  119   1HG   ARG  17          HG2       ARG  17  -4.702  -3.028   5.480
  120   2HG   ARG  17          HG1       ARG  17  -5.005  -2.588   3.798
  121   1HD   ARG  17          HD2       ARG  17  -7.091  -3.251   5.874
  122   2HD   ARG  17          HD1       ARG  17  -6.707  -1.644   5.260
  123    HE   ARG  17           HE       ARG  17  -7.409  -3.386   3.138
  124   1HH1  ARG  17          HH11      ARG  17  -8.798  -1.559   5.767
  125   2HH1  ARG  17          HH12      ARG  17 -10.336  -1.375   4.992
  126   1HH2  ARG  17          HH21      ARG  17  -9.431  -3.145   2.118
  127   2HH2  ARG  17          HH22      ARG  17 -10.695  -2.276   2.920
  128    H    LEU  18           HN       LEU  18  -4.813  -7.767   4.143
  129    HA   LEU  18           HA       LEU  18  -7.447  -8.684   4.359
  130   1HB   LEU  18          HB2       LEU  18  -6.712 -10.282   2.962
  131   2HB   LEU  18          HB1       LEU  18  -5.173  -9.455   3.010
  132    HG   LEU  18           HG       LEU  18  -4.602 -10.949   4.983
  133   1HD1  LEU  18          HD11      LEU  18  -6.042 -13.210   4.385
  134   2HD1  LEU  18          HD12      LEU  18  -7.260 -11.936   4.314
  135   3HD1  LEU  18          HD13      LEU  18  -6.303 -12.161   5.779
  136   1HD2  LEU  18          HD21      LEU  18  -3.343 -11.843   3.388
  137   2HD2  LEU  18          HD22      LEU  18  -4.527 -11.412   2.155
  138   3HD2  LEU  18          HD23      LEU  18  -4.666 -12.946   3.012
  139    H    GLY  19           HN       GLY  19  -4.808  -8.802   6.565
  140   1HA   GLY  19          HA2       GLY  19  -6.251 -10.733   8.245
  141   2HA   GLY  19          HA1       GLY  19  -4.542 -10.356   8.384
  142    H    GLY  20           HN       GLY  20  -6.730  -7.725   7.909
  143   1HA   GLY  20          HA2       GLY  20  -7.441  -6.045   9.304
  144   2HA   GLY  20          HA1       GLY  20  -7.378  -7.215  10.615
  145    H    GLY  21           HN       GLY  21  -5.045  -5.539   8.517
  146   1HA   GLY  21          HA2       GLY  21  -3.533  -4.829  10.942
  147   2HA   GLY  21          HA1       GLY  21  -2.743  -5.343   9.458
  148    H    SER  22           HN       SER  22  -3.423  -2.761  11.251
  149    HA   SER  22           HA       SER  22  -4.461  -0.721   9.839
  150   1HB   SER  22          HB2       SER  22  -1.865   0.020  11.008
  151   2HB   SER  22          HB1       SER  22  -3.479   0.638  11.354
  152    HG   SER  22           HG       SER  22  -3.834  -1.076  12.715
  153    H    ARG  23           HN       ARG  23  -3.607   0.965   8.494
  154    HA   ARG  23           HA       ARG  23  -2.289   0.000   6.218
  155   1HB   ARG  23          HB2       ARG  23  -3.472   2.491   7.126
  156   2HB   ARG  23          HB1       ARG  23  -2.051   2.763   6.134
  157   1HG   ARG  23          HG2       ARG  23  -3.216   2.360   4.297
  158   2HG   ARG  23          HG1       ARG  23  -3.662   0.762   4.899
  159   1HD   ARG  23          HD2       ARG  23  -5.107   3.369   5.319
  160   2HD   ARG  23          HD1       ARG  23  -5.682   1.939   4.464
  161    HE   ARG  23           HE       ARG  23  -5.187   1.101   7.031
  162   1HH1  ARG  23          HH11      ARG  23  -7.204   3.526   5.537
  163   2HH1  ARG  23          HH12      ARG  23  -8.422   3.450   6.766
  164   1HH2  ARG  23          HH21      ARG  23  -6.787   1.000   8.648
  165   2HH2  ARG  23          HH22      ARG  23  -8.185   2.017   8.533
  166    H    GLU  24           HN       GLU  24  -1.173   1.785   9.003
  167    HA   GLU  24           HA       GLU  24   1.416   2.365   7.985
  168   1HB   GLU  24          HB2       GLU  24   0.898   2.168  10.920
  169   2HB   GLU  24          HB1       GLU  24   1.839   3.357  10.028
  170   1HG   GLU  24          HG2       GLU  24  -0.429   4.089   9.051
  171   2HG   GLU  24          HG1       GLU  24  -1.121   3.195  10.404
  172    H    ARG  25           HN       ARG  25   0.092  -0.267   9.924
  173    HA   ARG  25           HA       ARG  25   2.449  -1.462  10.772
  174   1HB   ARG  25          HB2       ARG  25  -0.065  -2.060  11.219
  175   2HB   ARG  25          HB1       ARG  25   0.152  -3.152   9.858
  176   1HG   ARG  25          HG2       ARG  25   2.058  -4.187  11.053
  177   2HG   ARG  25          HG1       ARG  25   1.701  -3.155  12.439
  178   1HD   ARG  25          HD2       ARG  25  -0.734  -4.226  11.982
  179   2HD   ARG  25          HD1       ARG  25   0.299  -5.547  11.439
  180    HE   ARG  25           HE       ARG  25   0.837  -5.956  13.619
  181   1HH1  ARG  25          HH11      ARG  25  -0.460  -2.724  13.391
  182   2HH1  ARG  25          HH12      ARG  25  -0.473  -2.475  15.104
  183   1HH2  ARG  25          HH21      ARG  25   0.819  -5.629  15.873
  184   2HH2  ARG  25          HH22      ARG  25   0.252  -4.123  16.513
  185    H    CYS  26           HN       CYS  26   0.646  -1.998   7.769
  186    HA   CYS  26           HA       CYS  26   2.532  -3.861   6.716
  187   1HB   CYS  26          HB2       CYS  26   0.975  -2.449   4.688
  188   2HB   CYS  26          HB1       CYS  26   1.064  -4.163   5.044
  189    H    ALA  27           HN       ALA  27   2.036  -0.396   6.437
  190    HA   ALA  27           HA       ALA  27   3.761   0.217   4.360
  191   1HB   ALA  27          HB1       ALA  27   3.381   1.847   6.870
  192   2HB   ALA  27          HB2       ALA  27   2.266   1.830   5.504
  193   3HB   ALA  27          HB3       ALA  27   3.909   2.436   5.292
  194    H    SER  28           HN       SER  28   4.498  -0.220   7.804
  195    HA   SER  28           HA       SER  28   7.251   0.369   7.599
  196   1HB   SER  28          HB2       SER  28   7.446  -0.655   9.813
  197   2HB   SER  28          HB1       SER  28   6.017   0.375   9.745
  198    HG   SER  28           HG       SER  28   4.992  -1.336  10.384
  199    H    LEU  29           HN       LEU  29   5.362  -2.486   7.006
  200    HA   LEU  29           HA       LEU  29   7.496  -4.364   7.045
  201   1HB   LEU  29          HB2       LEU  29   4.810  -4.581   6.996
  202   2HB   LEU  29          HB1       LEU  29   5.156  -4.871   5.304
  203    HG   LEU  29           HG       LEU  29   4.977  -6.952   6.622
  204   1HD1  LEU  29          HD11      LEU  29   6.577  -8.010   5.415
  205   2HD1  LEU  29          HD12      LEU  29   7.834  -6.856   5.858
  206   3HD1  LEU  29          HD13      LEU  29   6.651  -6.438   4.617
  207   1HD2  LEU  29          HD21      LEU  29   6.450  -7.515   8.339
  208   2HD2  LEU  29          HD22      LEU  29   6.025  -5.838   8.681
  209   3HD2  LEU  29          HD23      LEU  29   7.574  -6.219   7.929
  210    H    SER  30           HN       SER  30   5.631  -3.089   4.283
  211    HA   SER  30           HA       SER  30   7.851  -3.747   2.514
  212   1HB   SER  30          HB2       SER  30   4.950  -3.275   2.174
  213   2HB   SER  30          HB1       SER  30   5.979  -2.733   0.849
  214    HG   SER  30           HG       SER  30   6.825  -4.838   0.731
  215    H    GLY  31           HN       GLY  31   5.620  -0.965   2.587
  216   1HA   GLY  31          HA2       GLY  31   6.829   1.187   3.266
  217   2HA   GLY  31          HA1       GLY  31   7.929   0.751   1.970
  218    H    CYS  32           HN       CYS  32   4.408   0.455   2.009
  219    HA   CYS  32           HA       CYS  32   4.199   1.736  -0.535
  220   1HB   CYS  32          HB2       CYS  32   2.090   0.832   1.435
  221   2HB   CYS  32          HB1       CYS  32   1.758   1.408  -0.188
  222    H    LYS  33           HN       LYS  33   2.035   3.314  -0.498
  223    HA   LYS  33           HA       LYS  33   2.519   5.395   1.509
  224   1HB   LYS  33          HB2       LYS  33   3.103   5.549  -1.332
  225   2HB   LYS  33          HB1       LYS  33   1.972   6.800  -0.834
  226   1HG   LYS  33          HG2       LYS  33   4.677   6.277   0.379
  227   2HG   LYS  33          HG1       LYS  33   4.263   7.593  -0.720
  228   1HD   LYS  33          HD2       LYS  33   3.887   8.779   1.145
  229   2HD   LYS  33          HD1       LYS  33   2.377   7.871   1.240
  230   1HE   LYS  33          HE2       LYS  33   3.084   6.624   2.981
  231   2HE   LYS  33          HE1       LYS  33   4.736   6.526   2.373
  232   1HZ   LYS  33          HZ1       LYS  33   5.322   8.481   3.385
  233   2HZ   LYS  33          HZ2       LYS  33   4.212   7.877   4.509
  234   3HZ   LYS  33          HZ3       LYS  33   3.742   9.084   3.422
  235    H    ILE  34           HN       ILE  34   0.760   6.818   1.867
  236    HA   ILE  34           HA       ILE  34  -1.817   5.636   1.157
  237    HB   ILE  34           HB       ILE  34  -1.384   7.852   3.145
  238   1HG1  ILE  34          HG12      ILE  34   0.064   6.034   3.838
  239   2HG1  ILE  34          HG11      ILE  34  -1.342   6.084   4.895
  240   1HG2  ILE  34          HG21      ILE  34  -3.567   5.842   2.663
  241   2HG2  ILE  34          HG22      ILE  34  -3.664   7.600   2.571
  242   3HG2  ILE  34          HG23      ILE  34  -3.458   6.809   4.133
  243   1HD1  ILE  34          HD11      ILE  34  -1.794   3.976   4.426
  244   2HD1  ILE  34          HD12      ILE  34  -0.342   3.907   3.428
  245   3HD1  ILE  34          HD13      ILE  34  -1.888   4.347   2.704
  246    H    ILE  35           HN       ILE  35  -3.017   6.512  -0.391
  247    HA   ILE  35           HA       ILE  35  -2.838   9.409  -0.849
  248    HB   ILE  35           HB       ILE  35  -3.269   7.778  -3.276
  249   1HG1  ILE  35          HG12      ILE  35  -0.609   7.872  -1.840
  250   2HG1  ILE  35          HG11      ILE  35  -1.495   6.447  -2.370
  251   1HG2  ILE  35          HG21      ILE  35  -2.917  10.397  -2.793
  252   2HG2  ILE  35          HG22      ILE  35  -2.510   9.632  -4.329
  253   3HG2  ILE  35          HG23      ILE  35  -1.251   9.930  -3.130
  254   1HD1  ILE  35          HD11      ILE  35   0.463   6.963  -3.768
  255   2HD1  ILE  35          HD12      ILE  35  -0.288   8.495  -4.212
  256   3HD1  ILE  35          HD13      ILE  35  -1.050   6.973  -4.673
  257    H    SER  36           HN       SER  36  -4.655   9.224  -3.154
  258    HA   SER  36           HA       SER  36  -7.103   8.139  -2.012
  259   1HB   SER  36          HB2       SER  36  -6.947  11.029  -2.892
  260   2HB   SER  36          HB1       SER  36  -8.320  10.210  -2.148
  261    HG   SER  36           HG       SER  36  -6.220  11.421  -0.973
  262    H    ALA  37           HN       ALA  37  -8.734   7.762  -3.536
  263    HA   ALA  37           HA       ALA  37  -9.673   7.417  -5.590
  264   1HB   ALA  37          HB1       ALA  37  -9.372   8.945  -7.225
  265   2HB   ALA  37          HB2       ALA  37  -7.613   8.853  -7.139
  266   3HB   ALA  37          HB3       ALA  37  -8.505   9.813  -5.959
  267    H    SER  38           HN       SER  38  -6.793   6.324  -4.540
  268    HA   SER  38           HA       SER  38  -5.649   4.416  -4.990
  269   1HB   SER  38          HB2       SER  38  -8.001   4.071  -6.520
  270   2HB   SER  38          HB1       SER  38  -6.654   3.640  -7.571
  271    HG   SER  38           HG       SER  38  -7.130   2.619  -4.962
  272    H    THR  39           HN       THR  39  -6.296   6.218  -8.009
  273    HA   THR  39           HA       THR  39  -4.129   5.641  -9.506
  274    HB   THR  39           HB       THR  39  -4.926   8.514  -9.164
  275    HG1  THR  39           HG1      THR  39  -6.892   7.651  -9.277
  276   1HG2  THR  39          HG21      THR  39  -4.599   7.034 -11.738
  277   2HG2  THR  39          HG22      THR  39  -3.207   7.706 -10.887
  278   3HG2  THR  39          HG23      THR  39  -4.509   8.767 -11.427
  279    H    CYS  40           HN       CYS  40  -1.995   5.773  -9.344
  280    HA   CYS  40           HA       CYS  40  -0.839   7.067  -7.025
  281   1HB   CYS  40          HB2       CYS  40   0.290   5.246  -9.149
  282   2HB   CYS  40          HB1       CYS  40   1.289   5.981  -7.897
  283    HA   PRO  41           HA       PRO  41   0.064  10.804  -9.279
  284   1HB   PRO  41          HB2       PRO  41   1.793  11.858  -7.427
  285   2HB   PRO  41          HB1       PRO  41   0.034  11.946  -7.309
  286   1HG   PRO  41          HG2       PRO  41   1.927  10.045  -5.985
  287   2HG   PRO  41          HG1       PRO  41   0.505  10.862  -5.313
  288   1HD   PRO  41          HD2       PRO  41   0.427   8.291  -6.080
  289   2HD   PRO  41          HD1       PRO  41  -0.968   9.369  -6.284
  290    H    SER  42           HN       SER  42   3.031  10.070  -7.480
  291    HA   SER  42           HA       SER  42   4.881  10.886  -9.247
  292   1HB   SER  42          HB2       SER  42   4.870   8.753  -7.188
  293   2HB   SER  42          HB1       SER  42   6.211   8.733  -8.331
  294    HG   SER  42           HG       SER  42   6.413  11.051  -7.771
  295    H    ASP  43           HN       ASP  43   4.622   7.363  -9.055
  296    HA   ASP  43           HA       ASP  43   3.793   6.921 -11.702
  297   1HB   ASP  43          HB2       ASP  43   6.178   7.997 -11.911
  298   2HB   ASP  43          HB1       ASP  43   6.731   6.384 -11.471
  299    H    TYR  44           HN       TYR  44   3.436   5.854  -9.029
  300    HA   TYR  44           HA       TYR  44   4.727   3.287  -8.958
  301   1HB   TYR  44          HB2       TYR  44   2.441   4.415  -7.342
  302   2HB   TYR  44          HB1       TYR  44   3.177   2.853  -7.045
  303    HD1  TYR  44           HD1      TYR  44   5.694   5.092  -8.093
  304    HD2  TYR  44           HD2      TYR  44   3.303   4.085  -4.718
  305    HE1  TYR  44           HE1      TYR  44   7.338   6.163  -6.614
  306    HE2  TYR  44           HE2      TYR  44   4.943   5.154  -3.233
  307    HH   TYR  44           HH       TYR  44   8.024   5.930  -4.147
  308    HA   PRO  45           HA       PRO  45   2.015   1.023 -11.565
  309   1HB   PRO  45          HB2       PRO  45   2.207  -1.242  -9.684
  310   2HB   PRO  45          HB1       PRO  45   2.695  -1.141 -11.378
  311   1HG   PRO  45          HG2       PRO  45   4.507  -1.190  -9.409
  312   2HG   PRO  45          HG1       PRO  45   4.751  -0.213 -10.868
  313   1HD   PRO  45          HD2       PRO  45   3.868   0.644  -8.139
  314   2HD   PRO  45          HD1       PRO  45   4.992   1.438  -9.262
  315    H    LYS  46           HN       LYS  46   1.264   1.088  -8.124
  316    HA   LYS  46           HA       LYS  46  -1.313  -0.064  -8.378
  317   1HB   LYS  46          HB2       LYS  46  -0.140  -0.023  -6.247
  318   2HB   LYS  46          HB1       LYS  46  -0.206   1.728  -6.243
  319   1HG   LYS  46          HG2       LYS  46  -1.879   0.553  -4.780
  320   2HG   LYS  46          HG1       LYS  46  -2.533   1.754  -5.894
  321   1HD   LYS  46          HD2       LYS  46  -3.039  -0.132  -7.473
  322   2HD   LYS  46          HD1       LYS  46  -2.585  -1.247  -6.183
  323   1HE   LYS  46          HE2       LYS  46  -4.786  -1.157  -5.702
  324   2HE   LYS  46          HE1       LYS  46  -4.327   0.323  -4.862
  325   1HZ   LYS  46          HZ1       LYS  46  -5.020   1.622  -6.705
  326   2HZ   LYS  46          HZ2       LYS  46  -6.275   0.540  -6.373
  327   3HZ   LYS  46          HZ3       LYS  46  -5.243   0.259  -7.682
  Start of MODEL    5
    1   1H    LYS   1          HT1       LYS   1  -8.418   4.930  -5.201
    2   2H    LYS   1          HT2       LYS   1  -7.177   5.834  -4.435
    3   3H    LYS   1          HT3       LYS   1  -8.281   4.921  -3.492
    4    HA   LYS   1           HA       LYS   1  -7.406   2.926  -4.156
    5   1HB   LYS   1          HB2       LYS   1  -6.756   4.474  -6.499
    6   2HB   LYS   1          HB1       LYS   1  -5.334   3.591  -5.960
    7   1HG   LYS   1          HG2       LYS   1  -7.852   2.058  -6.064
    8   2HG   LYS   1          HG1       LYS   1  -7.178   2.571  -7.613
    9   1HD   LYS   1          HD2       LYS   1  -5.707   1.024  -5.480
   10   2HD   LYS   1          HD1       LYS   1  -6.377   0.345  -6.965
   11   1HE   LYS   1          HE2       LYS   1  -4.886   2.303  -8.016
   12   2HE   LYS   1          HE1       LYS   1  -3.959   2.002  -6.549
   13   1HZ   LYS   1          HZ1       LYS   1  -4.382   0.275  -8.867
   14   2HZ   LYS   1          HZ2       LYS   1  -4.286  -0.479  -7.357
   15   3HZ   LYS   1          HZ3       LYS   1  -3.005   0.477  -7.905
   16    H    SER   2           HN       SER   2  -4.775   2.377  -4.365
   17    HA   SER   2           HA       SER   2  -3.541   3.965  -2.249
   18   1HB   SER   2          HB2       SER   2  -4.091   1.174  -2.356
   19   2HB   SER   2          HB1       SER   2  -2.348   1.414  -2.305
   20    HG   SER   2           HG       SER   2  -4.155   1.699  -0.337
   21    H    CYS   3           HN       CYS   3  -1.084   3.504  -2.182
   22    HA   CYS   3           HA       CYS   3  -0.005   3.444  -4.911
   23   1HB   CYS   3          HB2       CYS   3  -0.397   5.809  -3.653
   24   2HB   CYS   3          HB1       CYS   3   1.230   5.428  -3.102
   25    H    CYS   4           HN       CYS   4   1.213   1.619  -4.796
   26    HA   CYS   4           HA       CYS   4   3.321   1.538  -2.737
   27   1HB   CYS   4          HB2       CYS   4   1.472  -0.117  -2.297
   28   2HB   CYS   4          HB1       CYS   4   1.927  -0.905  -3.800
   29    HA   PRO   5           HA       PRO   5   6.333   1.351  -5.869
   30   1HB   PRO   5          HB2       PRO   5   7.519  -1.072  -4.841
   31   2HB   PRO   5          HB1       PRO   5   8.139   0.576  -4.762
   32   1HG   PRO   5          HG2       PRO   5   6.632  -0.956  -2.751
   33   2HG   PRO   5          HG1       PRO   5   7.684   0.452  -2.536
   34   1HD   PRO   5          HD2       PRO   5   5.016   0.626  -2.265
   35   2HD   PRO   5          HD1       PRO   5   5.969   1.952  -2.954
   36    H    ASN   6           HN       ASN   6   5.691  -2.071  -5.081
   37    HA   ASN   6           HA       ASN   6   4.470  -2.487  -7.671
   38   1HB   ASN   6          HB2       ASN   6   7.097  -3.835  -7.015
   39   2HB   ASN   6          HB1       ASN   6   6.105  -4.145  -8.435
   40   1HD2  ASN   6          HD21      ASN   6   8.482  -2.164  -7.015
   41   2HD2  ASN   6          HD22      ASN   6   8.682  -1.061  -8.330
   42    H    THR   7           HN       THR   7   4.406  -5.082  -7.981
   43    HA   THR   7           HA       THR   7   2.521  -6.063  -6.263
   44    HB   THR   7           HB       THR   7   2.875  -8.215  -7.214
   45    HG1  THR   7           HG1      THR   7   4.830  -8.697  -8.317
   46   1HG2  THR   7          HG21      THR   7   3.981  -6.793  -9.523
   47   2HG2  THR   7          HG22      THR   7   2.536  -6.069  -8.818
   48   3HG2  THR   7          HG23      THR   7   2.506  -7.745  -9.367
   49    H    THR   8           HN       THR   8   6.031  -6.331  -5.952
   50    HA   THR   8           HA       THR   8   6.170  -8.181  -3.881
   51    HB   THR   8           HB       THR   8   8.232  -6.597  -3.230
   52    HG1  THR   8           HG1      THR   8   7.377  -5.025  -4.821
   53   1HG2  THR   8          HG21      THR   8   8.247  -8.914  -4.288
   54   2HG2  THR   8          HG22      THR   8   9.623  -7.858  -4.607
   55   3HG2  THR   8          HG23      THR   8   8.372  -8.070  -5.831
   56    H    GLY   9           HN       GLY   9   5.686  -4.682  -3.765
   57   1HA   GLY   9          HA2       GLY   9   5.477  -4.690  -0.868
   58   2HA   GLY   9          HA1       GLY   9   5.292  -3.295  -1.927
   59    H    ARG  10           HN       ARG  10   3.427  -4.503  -3.693
   60    HA   ARG  10           HA       ARG  10   0.992  -3.812  -2.543
   61   1HB   ARG  10          HB2       ARG  10   1.886  -4.676  -5.043
   62   2HB   ARG  10          HB1       ARG  10   0.686  -5.869  -4.561
   63   1HG   ARG  10          HG2       ARG  10  -0.671  -4.372  -5.575
   64   2HG   ARG  10          HG1       ARG  10  -0.680  -3.694  -3.943
   65   1HD   ARG  10          HD2       ARG  10   0.040  -1.791  -4.824
   66   2HD   ARG  10          HD1       ARG  10   1.565  -2.601  -5.162
   67    HE   ARG  10           HE       ARG  10  -0.576  -2.856  -7.106
   68   1HH1  ARG  10          HH11      ARG  10   2.461  -1.380  -6.222
   69   2HH1  ARG  10          HH12      ARG  10   2.845  -0.909  -7.843
   70   1HH2  ARG  10          HH21      ARG  10  -0.069  -2.233  -9.239
   71   2HH2  ARG  10          HH22      ARG  10   1.410  -1.390  -9.553
   72    H    ASN  11           HN       ASN  11   2.680  -6.876  -2.767
   73    HA   ASN  11           HA       ASN  11   0.659  -8.582  -1.891
   74   1HB   ASN  11          HB2       ASN  11   3.658  -8.690  -1.839
   75   2HB   ASN  11          HB1       ASN  11   2.701  -9.970  -1.118
   76   1HD2  ASN  11          HD21      ASN  11   4.420  -9.404  -3.685
   77   2HD2  ASN  11          HD22      ASN  11   3.518 -10.222  -4.910
   78    H    ILE  12           HN       ILE  12   3.290  -7.085   0.025
   79    HA   ILE  12           HA       ILE  12   2.389  -8.119   2.469
   80    HB   ILE  12           HB       ILE  12   4.023  -5.641   1.946
   81   1HG1  ILE  12          HG12      ILE  12   5.709  -7.446   3.046
   82   2HG1  ILE  12          HG11      ILE  12   4.609  -8.528   2.196
   83   1HG2  ILE  12          HG21      ILE  12   4.754  -6.223   4.405
   84   2HG2  ILE  12          HG22      ILE  12   3.140  -6.930   4.481
   85   3HG2  ILE  12          HG23      ILE  12   3.336  -5.221   4.092
   86   1HD1  ILE  12          HD11      ILE  12   6.740  -6.959   1.163
   87   2HD1  ILE  12          HD12      ILE  12   5.225  -6.445   0.421
   88   3HD1  ILE  12          HD13      ILE  12   5.720  -8.136   0.338
   89    H    TYR  13           HN       TYR  13   1.801  -4.910   1.022
   90    HA   TYR  13           HA       TYR  13   0.215  -4.026   3.172
   91   1HB   TYR  13          HB2       TYR  13   1.343  -2.786   1.110
   92   2HB   TYR  13          HB1       TYR  13  -0.275  -2.965   0.449
   93    HD1  TYR  13           HD1      TYR  13  -2.163  -2.384   2.353
   94    HD2  TYR  13           HD2      TYR  13   1.767  -0.774   2.129
   95    HE1  TYR  13           HE1      TYR  13  -2.891  -0.440   3.669
   96    HE2  TYR  13           HE2      TYR  13   1.049   1.175   3.443
   97    HH   TYR  13           HH       TYR  13  -2.258   1.820   4.115
   98    H    ASN  14           HN       ASN  14  -0.562  -5.705   0.169
   99    HA   ASN  14           HA       ASN  14  -3.364  -5.475   0.428
  100   1HB   ASN  14          HB2       ASN  14  -1.519  -7.164  -1.209
  101   2HB   ASN  14          HB1       ASN  14  -3.222  -7.567  -1.138
  102   1HD2  ASN  14          HD21      ASN  14  -1.399  -4.510  -1.340
  103   2HD2  ASN  14          HD22      ASN  14  -2.255  -3.901  -2.714
  104    H    THR  15           HN       THR  15  -1.105  -8.182   1.197
  105    HA   THR  15           HA       THR  15  -3.210  -9.760   2.294
  106    HB   THR  15           HB       THR  15  -1.274 -10.919   1.544
  107    HG1  THR  15           HG1      THR  15  -1.318 -12.273   3.142
  108   1HG2  THR  15          HG21      THR  15   0.810 -10.229   1.808
  109   2HG2  THR  15          HG22      THR  15   0.649 -10.319   3.562
  110   3HG2  THR  15          HG23      THR  15   0.210  -8.839   2.712
  111    H    CYS  16           HN       CYS  16  -0.849  -7.537   3.670
  112    HA   CYS  16           HA       CYS  16  -1.275  -7.970   6.371
  113   1HB   CYS  16          HB2       CYS  16   0.433  -6.450   5.813
  114   2HB   CYS  16          HB1       CYS  16  -0.617  -5.515   4.760
  115    H    ARG  17           HN       ARG  17  -2.948  -5.684   4.217
  116    HA   ARG  17           HA       ARG  17  -4.927  -4.893   6.049
  117   1HB   ARG  17          HB2       ARG  17  -4.429  -4.636   3.174
  118   2HB   ARG  17          HB1       ARG  17  -6.139  -4.698   3.577
  119   1HG   ARG  17          HG2       ARG  17  -4.429  -2.883   5.176
  120   2HG   ARG  17          HG1       ARG  17  -4.772  -2.428   3.507
  121   1HD   ARG  17          HD2       ARG  17  -7.086  -3.350   5.079
  122   2HD   ARG  17          HD1       ARG  17  -6.368  -1.828   5.604
  123    HE   ARG  17           HE       ARG  17  -6.846  -1.960   2.774
  124   1HH1  ARG  17          HH11      ARG  17  -8.252  -1.205   5.878
  125   2HH1  ARG  17          HH12      ARG  17  -9.451  -0.143   5.216
  126   1HH2  ARG  17          HH21      ARG  17  -8.419  -0.565   1.903
  127   2HH2  ARG  17          HH22      ARG  17  -9.545   0.219   2.959
  128    H    LEU  18           HN       LEU  18  -4.683  -7.606   3.825
  129    HA   LEU  18           HA       LEU  18  -7.349  -8.462   3.960
  130   1HB   LEU  18          HB2       LEU  18  -6.612 -10.006   2.500
  131   2HB   LEU  18          HB1       LEU  18  -5.049  -9.245   2.639
  132    HG   LEU  18           HG       LEU  18  -4.542 -10.847   4.502
  133   1HD1  LEU  18          HD11      LEU  18  -6.270 -11.995   5.330
  134   2HD1  LEU  18          HD12      LEU  18  -6.166 -12.993   3.879
  135   3HD1  LEU  18          HD13      LEU  18  -7.282 -11.629   3.933
  136   1HD2  LEU  18          HD21      LEU  18  -4.918 -12.731   2.378
  137   2HD2  LEU  18          HD22      LEU  18  -3.434 -11.953   2.926
  138   3HD2  LEU  18          HD23      LEU  18  -4.442 -11.170   1.711
  139    H    GLY  19           HN       GLY  19  -4.759  -8.656   6.209
  140   1HA   GLY  19          HA2       GLY  19  -6.277 -10.582   7.831
  141   2HA   GLY  19          HA1       GLY  19  -4.554 -10.278   7.990
  142    H    GLY  20           HN       GLY  20  -6.613  -7.544   7.531
  143   1HA   GLY  20          HA2       GLY  20  -7.283  -5.866   8.950
  144   2HA   GLY  20          HA1       GLY  20  -7.256  -7.052  10.247
  145    H    GLY  21           HN       GLY  21  -4.902  -5.383   8.169
  146   1HA   GLY  21          HA2       GLY  21  -3.310  -4.838  10.583
  147   2HA   GLY  21          HA1       GLY  21  -2.588  -5.234   9.031
  148    H    SER  22           HN       SER  22  -3.133  -2.805  11.046
  149    HA   SER  22           HA       SER  22  -4.225  -0.644   9.874
  150   1HB   SER  22          HB2       SER  22  -1.577   0.039  10.907
  151   2HB   SER  22          HB1       SER  22  -3.172   0.543  11.463
  152    HG   SER  22           HG       SER  22  -3.319  -1.265  12.703
  153    H    ARG  23           HN       ARG  23  -3.524   1.085   8.593
  154    HA   ARG  23           HA       ARG  23  -2.350   0.345   6.170
  155   1HB   ARG  23          HB2       ARG  23  -3.365   2.248   5.585
  156   2HB   ARG  23          HB1       ARG  23  -3.627   2.634   7.275
  157   1HG   ARG  23          HG2       ARG  23  -1.445   3.742   7.360
  158   2HG   ARG  23          HG1       ARG  23  -1.192   3.362   5.656
  159   1HD   ARG  23          HD2       ARG  23  -3.430   4.592   5.285
  160   2HD   ARG  23          HD1       ARG  23  -3.161   5.249   6.899
  161    HE   ARG  23           HE       ARG  23  -0.892   5.569   5.186
  162   1HH1  ARG  23          HH11      ARG  23  -3.990   6.922   6.051
  163   2HH1  ARG  23          HH12      ARG  23  -3.575   8.522   5.538
  164   1HH2  ARG  23          HH21      ARG  23  -0.344   7.674   4.511
  165   2HH2  ARG  23          HH22      ARG  23  -1.505   8.950   4.664
  166    H    GLU  24           HN       GLU  24  -1.051   2.044   8.946
  167    HA   GLU  24           HA       GLU  24   1.496   2.554   7.784
  168   1HB   GLU  24          HB2       GLU  24   1.113   2.419  10.744
  169   2HB   GLU  24          HB1       GLU  24   2.056   3.557   9.791
  170   1HG   GLU  24          HG2       GLU  24  -0.216   4.365   8.900
  171   2HG   GLU  24          HG1       GLU  24  -0.892   3.507  10.284
  172    H    ARG  25           HN       ARG  25   0.201  -0.070   9.726
  173    HA   ARG  25           HA       ARG  25   2.572  -1.277  10.528
  174   1HB   ARG  25          HB2       ARG  25   0.171  -1.904  11.146
  175   2HB   ARG  25          HB1       ARG  25   0.138  -2.824   9.648
  176   1HG   ARG  25          HG2       ARG  25   2.396  -3.796  10.712
  177   2HG   ARG  25          HG1       ARG  25   1.524  -3.382  12.189
  178   1HD   ARG  25          HD2       ARG  25  -0.459  -4.606  10.993
  179   2HD   ARG  25          HD1       ARG  25   0.834  -5.358  10.061
  180    HE   ARG  25           HE       ARG  25   1.381  -5.519  12.834
  181   1HH1  ARG  25          HH11      ARG  25  -0.642  -6.909  10.354
  182   2HH1  ARG  25          HH12      ARG  25  -0.809  -8.428  11.168
  183   1HH2  ARG  25          HH21      ARG  25   1.163  -7.517  13.906
  184   2HH2  ARG  25          HH22      ARG  25   0.215  -8.773  13.184
  185    H    CYS  26           HN       CYS  26   0.667  -1.883   7.600
  186    HA   CYS  26           HA       CYS  26   2.593  -3.662   6.477
  187   1HB   CYS  26          HB2       CYS  26   0.873  -2.388   4.499
  188   2HB   CYS  26          HB1       CYS  26   1.051  -4.084   4.909
  189    H    ALA  27           HN       ALA  27   1.891  -0.227   6.127
  190    HA   ALA  27           HA       ALA  27   3.566   0.319   3.955
  191   1HB   ALA  27          HB1       ALA  27   1.840   1.825   5.161
  192   2HB   ALA  27          HB2       ALA  27   3.270   2.566   4.442
  193   3HB   ALA  27          HB3       ALA  27   3.203   2.286   6.181
  194    H    SER  28           HN       SER  28   4.252   0.141   7.414
  195    HA   SER  28           HA       SER  28   6.935   1.044   7.211
  196   1HB   SER  28          HB2       SER  28   5.756   1.168   9.336
  197   2HB   SER  28          HB1       SER  28   5.558  -0.583   9.360
  198    HG   SER  28           HG       SER  28   7.490  -0.748  10.152
  199    H    LEU  29           HN       LEU  29   5.358  -2.045   6.898
  200    HA   LEU  29           HA       LEU  29   7.686  -3.660   7.120
  201   1HB   LEU  29          HB2       LEU  29   5.012  -4.154   7.062
  202   2HB   LEU  29          HB1       LEU  29   5.475  -4.661   5.450
  203    HG   LEU  29           HG       LEU  29   6.942  -5.675   7.866
  204   1HD1  LEU  29          HD11      LEU  29   4.297  -6.554   6.782
  205   2HD1  LEU  29          HD12      LEU  29   4.809  -6.349   8.457
  206   3HD1  LEU  29          HD13      LEU  29   5.398  -7.720   7.516
  207   1HD2  LEU  29          HD21      LEU  29   6.467  -7.306   5.455
  208   2HD2  LEU  29          HD22      LEU  29   7.914  -7.139   6.449
  209   3HD2  LEU  29          HD23      LEU  29   7.518  -5.906   5.252
  210    H    SER  30           HN       SER  30   5.733  -2.805   4.249
  211    HA   SER  30           HA       SER  30   7.946  -3.557   2.526
  212   1HB   SER  30          HB2       SER  30   5.054  -3.111   2.188
  213   2HB   SER  30          HB1       SER  30   6.046  -2.575   0.832
  214    HG   SER  30           HG       SER  30   6.984  -4.689   0.834
  215    H    GLY  31           HN       GLY  31   5.817  -0.680   2.649
  216   1HA   GLY  31          HA2       GLY  31   7.064   1.461   3.104
  217   2HA   GLY  31          HA1       GLY  31   8.174   0.915   1.860
  218    H    CYS  32           HN       CYS  32   4.684   0.540   1.659
  219    HA   CYS  32           HA       CYS  32   4.639   1.883  -0.865
  220   1HB   CYS  32          HB2       CYS  32   2.198   1.116   0.720
  221   2HB   CYS  32          HB1       CYS  32   2.400   1.179  -1.020
  222    H    LYS  33           HN       LYS  33   2.001   3.080  -0.520
  223    HA   LYS  33           HA       LYS  33   2.222   5.173   1.424
  224   1HB   LYS  33          HB2       LYS  33   3.450   5.548  -1.108
  225   2HB   LYS  33          HB1       LYS  33   2.003   6.546  -1.082
  226   1HG   LYS  33          HG2       LYS  33   4.188   6.590   0.988
  227   2HG   LYS  33          HG1       LYS  33   3.983   7.760  -0.317
  228   1HD   LYS  33          HD2       LYS  33   2.015   7.212   1.902
  229   2HD   LYS  33          HD1       LYS  33   3.075   8.617   1.777
  230   1HE   LYS  33          HE2       LYS  33   1.709   8.477  -0.661
  231   2HE   LYS  33          HE1       LYS  33   0.500   8.152   0.579
  232   1HZ   LYS  33          HZ1       LYS  33   0.963  10.571  -0.094
  233   2HZ   LYS  33          HZ2       LYS  33   2.353  10.428   0.859
  234   3HZ   LYS  33          HZ3       LYS  33   0.826  10.208   1.552
  235    H    ILE  34           HN       ILE  34   0.228   5.934   1.906
  236    HA   ILE  34           HA       ILE  34  -1.983   5.003   0.230
  237    HB   ILE  34           HB       ILE  34  -2.284   6.166   2.984
  238   1HG1  ILE  34          HG12      ILE  34  -0.705   4.388   3.294
  239   2HG1  ILE  34          HG11      ILE  34  -2.280   3.782   3.796
  240   1HG2  ILE  34          HG21      ILE  34  -3.986   4.001   1.878
  241   2HG2  ILE  34          HG22      ILE  34  -4.175   5.623   1.215
  242   3HG2  ILE  34          HG23      ILE  34  -4.408   5.344   2.940
  243   1HD1  ILE  34          HD11      ILE  34  -0.571   2.464   2.175
  244   2HD1  ILE  34          HD12      ILE  34  -1.599   3.265   0.991
  245   3HD1  ILE  34          HD13      ILE  34  -2.315   2.208   2.204
  246    H    ILE  35           HN       ILE  35  -3.259   6.343  -0.854
  247    HA   ILE  35           HA       ILE  35  -2.883   9.236  -0.443
  248    HB   ILE  35           HB       ILE  35  -4.143   8.403  -2.964
  249   1HG1  ILE  35          HG12      ILE  35  -1.214   7.795  -2.506
  250   2HG1  ILE  35          HG11      ILE  35  -2.479   6.579  -2.642
  251   1HG2  ILE  35          HG21      ILE  35  -3.015  10.668  -1.996
  252   2HG2  ILE  35          HG22      ILE  35  -3.253  10.326  -3.710
  253   3HG2  ILE  35          HG23      ILE  35  -1.689  10.015  -2.958
  254   1HD1  ILE  35          HD11      ILE  35  -2.447   8.439  -4.874
  255   2HD1  ILE  35          HD12      ILE  35  -2.467   6.676  -4.861
  256   3HD1  ILE  35          HD13      ILE  35  -0.940   7.542  -4.686
  257    H    SER  36           HN       SER  36  -4.957  10.321  -1.708
  258    HA   SER  36           HA       SER  36  -7.390   9.081  -0.662
  259   1HB   SER  36          HB2       SER  36  -8.129  11.270   0.263
  260   2HB   SER  36          HB1       SER  36  -6.709  10.622   1.081
  261    HG   SER  36           HG       SER  36  -5.689  12.358   0.522
  262    H    ALA  37           HN       ALA  37  -5.848  11.245  -2.887
  263    HA   ALA  37           HA       ALA  37  -8.359  11.864  -4.227
  264   1HB   ALA  37          HB1       ALA  37  -7.006  13.757  -4.090
  265   2HB   ALA  37          HB2       ALA  37  -6.781  13.198  -5.747
  266   3HB   ALA  37          HB3       ALA  37  -5.550  12.864  -4.529
  267    H    SER  38           HN       SER  38  -6.888   9.153  -4.198
  268    HA   SER  38           HA       SER  38  -6.754   7.386  -5.620
  269   1HB   SER  38          HB2       SER  38  -8.632   9.104  -6.854
  270   2HB   SER  38          HB1       SER  38  -7.551   8.544  -8.130
  271    HG   SER  38           HG       SER  38  -9.470   7.188  -6.775
  272    H    THR  39           HN       THR  39  -6.028  10.232  -7.660
  273    HA   THR  39           HA       THR  39  -4.062   9.165  -9.231
  274    HB   THR  39           HB       THR  39  -4.774  11.348  -9.746
  275    HG1  THR  39           HG1      THR  39  -2.711  11.411 -10.313
  276   1HG2  THR  39          HG21      THR  39  -5.575  12.407  -7.895
  277   2HG2  THR  39          HG22      THR  39  -4.040  13.251  -8.103
  278   3HG2  THR  39          HG23      THR  39  -4.186  11.966  -6.902
  279    H    CYS  40           HN       CYS  40  -1.980   8.572  -9.030
  280    HA   CYS  40           HA       CYS  40  -0.847   8.555  -6.356
  281   1HB   CYS  40          HB2       CYS  40  -0.500   6.987  -8.811
  282   2HB   CYS  40          HB1       CYS  40   1.005   7.317  -7.961
  283    HA   PRO  41           HA       PRO  41   1.635  12.173  -7.064
  284   1HB   PRO  41          HB2       PRO  41   3.543  11.606  -5.142
  285   2HB   PRO  41          HB1       PRO  41   2.002  12.408  -4.829
  286   1HG   PRO  41          HG2       PRO  41   2.766   9.550  -4.439
  287   2HG   PRO  41          HG1       PRO  41   1.747  10.589  -3.428
  288   1HD   PRO  41          HD2       PRO  41   0.696   8.742  -5.073
  289   2HD   PRO  41          HD1       PRO  41  -0.108  10.298  -4.778
  290    H    SER  42           HN       SER  42   3.770   9.492  -6.099
  291    HA   SER  42           HA       SER  42   5.769  10.226  -7.978
  292   1HB   SER  42          HB2       SER  42   6.633   9.161  -6.096
  293   2HB   SER  42          HB1       SER  42   5.378   7.924  -6.100
  294    HG   SER  42           HG       SER  42   7.710   8.107  -7.645
  295    H    ASP  43           HN       ASP  43   4.643   6.874  -7.842
  296    HA   ASP  43           HA       ASP  43   3.229   6.782 -10.233
  297   1HB   ASP  43          HB2       ASP  43   6.123   6.948 -10.577
  298   2HB   ASP  43          HB1       ASP  43   5.425   5.535 -11.362
  299    H    TYR  44           HN       TYR  44   3.292   5.472  -7.640
  300    HA   TYR  44           HA       TYR  44   3.579   2.694  -8.551
  301   1HB   TYR  44          HB2       TYR  44   3.520   2.717  -5.724
  302   2HB   TYR  44          HB1       TYR  44   4.833   2.222  -6.775
  303    HD1  TYR  44           HD1      TYR  44   3.508   4.860  -4.629
  304    HD2  TYR  44           HD2      TYR  44   6.703   3.730  -7.199
  305    HE1  TYR  44           HE1      TYR  44   4.889   6.664  -3.694
  306    HE2  TYR  44           HE2      TYR  44   8.093   5.534  -6.274
  307    HH   TYR  44           HH       TYR  44   8.092   6.837  -3.928
  308    HA   PRO  45           HA       PRO  45  -0.909   3.434  -7.648
  309   1HB   PRO  45          HB2       PRO  45  -1.274   1.568  -9.886
  310   2HB   PRO  45          HB1       PRO  45  -1.929   3.191  -9.663
  311   1HG   PRO  45          HG2       PRO  45  -0.016   2.665 -11.481
  312   2HG   PRO  45          HG1       PRO  45  -0.091   4.209 -10.611
  313   1HD   PRO  45          HD2       PRO  45   1.676   1.839 -10.121
  314   2HD   PRO  45          HD1       PRO  45   2.075   3.570 -10.082
  315    H    LYS  46           HN       LYS  46  -1.336   2.277  -5.845
  316    HA   LYS  46           HA       LYS  46  -1.124  -0.645  -5.977
  317   1HB   LYS  46          HB2       LYS  46   0.238   0.072  -4.218
  318   2HB   LYS  46          HB1       LYS  46  -0.931   1.262  -3.687
  319   1HG   LYS  46          HG2       LYS  46  -2.433  -0.682  -3.073
  320   2HG   LYS  46          HG1       LYS  46  -1.029  -1.715  -3.334
  321   1HD   LYS  46          HD2       LYS  46  -0.068  -1.089  -1.406
  322   2HD   LYS  46          HD1       LYS  46  -0.503   0.607  -1.632
  323   1HE   LYS  46          HE2       LYS  46  -2.931  -0.418  -1.155
  324   2HE   LYS  46          HE1       LYS  46  -1.948  -1.558  -0.238
  325   1HZ   LYS  46          HZ1       LYS  46  -0.978   0.295   0.965
  326   2HZ   LYS  46          HZ2       LYS  46  -2.660   0.303   1.128
  327   3HZ   LYS  46          HZ3       LYS  46  -1.909   1.394   0.078
  Start of MODEL    6
    1   1H    LYS   1          HT1       LYS   1  -6.313   2.084  -4.635
    2   2H    LYS   1          HT2       LYS   1  -6.636   3.758  -4.448
    3   3H    LYS   1          HT3       LYS   1  -7.893   2.610  -4.230
    4    HA   LYS   1           HA       LYS   1  -7.103   3.439  -2.150
    5   1HB   LYS   1          HB2       LYS   1  -6.731   1.283  -1.119
    6   2HB   LYS   1          HB1       LYS   1  -7.981   1.182  -2.349
    7   1HG   LYS   1          HG2       LYS   1  -6.823  -0.280  -3.572
    8   2HG   LYS   1          HG1       LYS   1  -5.309   0.604  -3.355
    9   1HD   LYS   1          HD2       LYS   1  -5.200  -0.313  -1.037
   10   2HD   LYS   1          HD1       LYS   1  -6.595  -1.310  -1.436
   11   1HE   LYS   1          HE2       LYS   1  -4.015  -1.338  -2.984
   12   2HE   LYS   1          HE1       LYS   1  -4.360  -2.441  -1.653
   13   1HZ   LYS   1          HZ1       LYS   1  -5.484  -2.371  -4.351
   14   2HZ   LYS   1          HZ2       LYS   1  -6.505  -2.867  -3.097
   15   3HZ   LYS   1          HZ3       LYS   1  -5.062  -3.698  -3.391
   16    H    SER   2           HN       SER   2  -4.986   1.452  -1.110
   17    HA   SER   2           HA       SER   2  -2.972   3.125  -0.591
   18   1HB   SER   2          HB2       SER   2  -1.550   1.159  -0.168
   19   2HB   SER   2          HB1       SER   2  -3.183   0.931   0.455
   20    HG   SER   2           HG       SER   2  -2.419   0.028  -2.111
   21    H    CYS   3           HN       CYS   3  -0.655   3.054  -1.322
   22    HA   CYS   3           HA       CYS   3  -0.479   2.741  -4.250
   23   1HB   CYS   3          HB2       CYS   3  -0.711   5.125  -3.656
   24   2HB   CYS   3          HB1       CYS   3   0.710   5.000  -2.627
   25    H    CYS   4           HN       CYS   4   0.812   1.012  -4.491
   26    HA   CYS   4           HA       CYS   4   3.268   0.869  -2.873
   27   1HB   CYS   4          HB2       CYS   4   1.587  -1.235  -4.201
   28   2HB   CYS   4          HB1       CYS   4   3.273  -1.555  -3.815
   29    HA   PRO   5           HA       PRO   5   5.685   1.817  -6.456
   30   1HB   PRO   5          HB2       PRO   5   7.990   0.496  -5.801
   31   2HB   PRO   5          HB1       PRO   5   7.519   2.050  -5.103
   32   1HG   PRO   5          HG2       PRO   5   7.213  -0.704  -3.975
   33   2HG   PRO   5          HG1       PRO   5   7.730   0.786  -3.164
   34   1HD   PRO   5          HD2       PRO   5   5.230  -0.172  -2.908
   35   2HD   PRO   5          HD1       PRO   5   5.564   1.570  -2.951
   36    H    ASN   6           HN       ASN   6   5.217  -1.489  -5.410
   37    HA   ASN   6           HA       ASN   6   4.931  -2.391  -8.106
   38   1HB   ASN   6          HB2       ASN   6   7.454  -2.953  -6.614
   39   2HB   ASN   6          HB1       ASN   6   6.778  -4.233  -7.616
   40   1HD2  ASN   6          HD21      ASN   6   8.872  -1.717  -7.584
   41   2HD2  ASN   6          HD22      ASN   6   8.940  -1.372  -9.276
   42    H    THR   7           HN       THR   7   4.696  -4.891  -8.107
   43    HA   THR   7           HA       THR   7   2.574  -5.580  -6.450
   44    HB   THR   7           HB       THR   7   2.809  -6.804  -8.450
   45    HG1  THR   7           HG1      THR   7   2.151  -8.478  -7.400
   46   1HG2  THR   7          HG21      THR   7   4.943  -8.471  -8.388
   47   2HG2  THR   7          HG22      THR   7   5.627  -6.999  -7.699
   48   3HG2  THR   7          HG23      THR   7   4.871  -6.957  -9.292
   49    H    THR   8           HN       THR   8   6.017  -5.951  -5.977
   50    HA   THR   8           HA       THR   8   6.042  -7.841  -3.930
   51    HB   THR   8           HB       THR   8   8.118  -6.326  -3.193
   52    HG1  THR   8           HG1      THR   8   7.345  -4.689  -4.758
   53   1HG2  THR   8          HG21      THR   8   8.087  -8.614  -4.345
   54   2HG2  THR   8          HG22      THR   8   9.515  -7.595  -4.539
   55   3HG2  THR   8          HG23      THR   8   8.326  -7.704  -5.837
   56    H    GLY   9           HN       GLY   9   5.262  -4.433  -3.873
   57   1HA   GLY   9          HA2       GLY   9   5.187  -4.363  -0.962
   58   2HA   GLY   9          HA1       GLY   9   4.849  -3.020  -2.047
   59    H    ARG  10           HN       ARG  10   2.984  -4.344  -3.699
   60    HA   ARG  10           HA       ARG  10   0.588  -3.844  -2.371
   61   1HB   ARG  10          HB2       ARG  10   0.452  -3.801  -4.706
   62   2HB   ARG  10          HB1       ARG  10   1.315  -5.318  -4.883
   63   1HG   ARG  10          HG2       ARG  10  -0.707  -6.152  -5.340
   64   2HG   ARG  10          HG1       ARG  10  -0.927  -6.148  -3.592
   65   1HD   ARG  10          HD2       ARG  10  -2.792  -4.996  -4.145
   66   2HD   ARG  10          HD1       ARG  10  -1.670  -3.638  -4.117
   67    HE   ARG  10           HE       ARG  10  -2.103  -3.367  -6.328
   68   1HH1  ARG  10          HH11      ARG  10  -2.651  -6.722  -5.537
   69   2HH1  ARG  10          HH12      ARG  10  -3.159  -7.145  -7.137
   70   1HH2  ARG  10          HH21      ARG  10  -2.770  -3.922  -8.433
   71   2HH2  ARG  10          HH22      ARG  10  -3.227  -5.556  -8.781
   72    H    ASN  11           HN       ASN  11   2.483  -6.769  -2.717
   73    HA   ASN  11           HA       ASN  11   0.617  -8.638  -1.820
   74   1HB   ASN  11          HB2       ASN  11   3.616  -8.510  -1.843
   75   2HB   ASN  11          HB1       ASN  11   2.785  -9.863  -1.096
   76   1HD2  ASN  11          HD21      ASN  11   4.293  -8.992  -3.784
   77   2HD2  ASN  11          HD22      ASN  11   3.458  -9.950  -4.953
   78    H    ILE  12           HN       ILE  12   3.266  -7.149   0.085
   79    HA   ILE  12           HA       ILE  12   2.401  -8.185   2.530
   80    HB   ILE  12           HB       ILE  12   3.971  -5.666   1.994
   81   1HG1  ILE  12          HG12      ILE  12   5.746  -7.398   3.019
   82   2HG1  ILE  12          HG11      ILE  12   4.641  -8.545   2.266
   83   1HG2  ILE  12          HG21      ILE  12   3.118  -6.960   4.525
   84   2HG2  ILE  12          HG22      ILE  12   3.371  -5.254   4.155
   85   3HG2  ILE  12          HG23      ILE  12   4.754  -6.308   4.448
   86   1HD1  ILE  12          HD11      ILE  12   5.472  -8.118   0.267
   87   2HD1  ILE  12          HD12      ILE  12   6.711  -7.140   1.055
   88   3HD1  ILE  12          HD13      ILE  12   5.228  -6.384   0.472
   89    H    TYR  13           HN       TYR  13   1.702  -5.029   1.064
   90    HA   TYR  13           HA       TYR  13   0.168  -4.030   3.171
   91   1HB   TYR  13          HB2       TYR  13   1.088  -2.995   0.906
   92   2HB   TYR  13          HB1       TYR  13  -0.542  -3.358   0.365
   93    HD1  TYR  13           HD1      TYR  13  -2.477  -2.241   1.461
   94    HD2  TYR  13           HD2      TYR  13   1.538  -1.207   2.405
   95    HE1  TYR  13           HE1      TYR  13  -3.263  -0.150   2.488
   96    HE2  TYR  13           HE2      TYR  13   0.764   0.885   3.436
   97    HH   TYR  13           HH       TYR  13  -2.137   2.217   2.927
   98    H    ASN  14           HN       ASN  14  -0.740  -5.908   0.314
   99    HA   ASN  14           HA       ASN  14  -3.511  -5.886   0.798
  100   1HB   ASN  14          HB2       ASN  14  -1.669  -7.489  -0.926
  101   2HB   ASN  14          HB1       ASN  14  -3.338  -7.993  -0.737
  102   1HD2  ASN  14          HD21      ASN  14  -1.878  -4.763  -0.956
  103   2HD2  ASN  14          HD22      ASN  14  -2.800  -4.255  -2.324
  104    H    THR  15           HN       THR  15  -1.099  -8.523   1.342
  105    HA   THR  15           HA       THR  15  -2.967 -10.193   2.637
  106    HB   THR  15           HB       THR  15  -1.026 -11.282   1.915
  107    HG1  THR  15           HG1      THR  15  -0.647 -12.390   3.668
  108   1HG2  THR  15          HG21      THR  15   0.356  -8.927   2.765
  109   2HG2  THR  15          HG22      THR  15   0.914 -10.240   1.728
  110   3HG2  THR  15          HG23      THR  15   1.105 -10.356   3.477
  111    H    CYS  16           HN       CYS  16  -0.775  -7.720   3.838
  112    HA   CYS  16           HA       CYS  16  -1.025  -8.074   6.568
  113   1HB   CYS  16          HB2       CYS  16   0.492  -6.425   5.883
  114   2HB   CYS  16          HB1       CYS  16  -0.672  -5.663   4.811
  115    H    ARG  17           HN       ARG  17  -3.025  -6.043   4.432
  116    HA   ARG  17           HA       ARG  17  -4.954  -5.341   6.346
  117   1HB   ARG  17          HB2       ARG  17  -4.659  -5.207   3.436
  118   2HB   ARG  17          HB1       ARG  17  -6.329  -5.399   3.951
  119   1HG   ARG  17          HG2       ARG  17  -4.732  -3.357   5.369
  120   2HG   ARG  17          HG1       ARG  17  -5.146  -3.023   3.687
  121   1HD   ARG  17          HD2       ARG  17  -7.145  -3.821   5.796
  122   2HD   ARG  17          HD1       ARG  17  -6.791  -2.152   5.353
  123    HE   ARG  17           HE       ARG  17  -8.450  -3.972   3.939
  124   1HH1  ARG  17          HH11      ARG  17  -6.206  -1.341   3.479
  125   2HH1  ARG  17          HH12      ARG  17  -6.901  -0.846   1.973
  126   1HH2  ARG  17          HH21      ARG  17  -9.367  -3.323   1.958
  127   2HH2  ARG  17          HH22      ARG  17  -8.697  -1.970   1.109
  128    H    LEU  18           HN       LEU  18  -4.592  -8.149   4.277
  129    HA   LEU  18           HA       LEU  18  -7.155  -9.233   4.576
  130   1HB   LEU  18          HB2       LEU  18  -6.329 -10.819   3.217
  131   2HB   LEU  18          HB1       LEU  18  -4.845  -9.897   3.222
  132    HG   LEU  18           HG       LEU  18  -4.147 -11.285   5.219
  133   1HD1  LEU  18          HD11      LEU  18  -5.491 -13.644   4.733
  134   2HD1  LEU  18          HD12      LEU  18  -6.767 -12.428   4.691
  135   3HD1  LEU  18          HD13      LEU  18  -5.736 -12.574   6.114
  136   1HD2  LEU  18          HD21      LEU  18  -4.204 -13.350   3.283
  137   2HD2  LEU  18          HD22      LEU  18  -2.890 -12.239   3.660
  138   3HD2  LEU  18          HD23      LEU  18  -4.072 -11.816   2.423
  139    H    GLY  19           HN       GLY  19  -4.502  -9.040   6.750
  140   1HA   GLY  19          HA2       GLY  19  -5.767 -11.006   8.530
  141   2HA   GLY  19          HA1       GLY  19  -4.090 -10.496   8.626
  142    H    GLY  20           HN       GLY  20  -6.493  -8.074   8.072
  143   1HA   GLY  20          HA2       GLY  20  -7.344  -6.413   9.412
  144   2HA   GLY  20          HA1       GLY  20  -7.104  -7.491  10.778
  145    H    GLY  21           HN       GLY  21  -5.054  -5.689   8.494
  146   1HA   GLY  21          HA2       GLY  21  -3.568  -4.644  10.810
  147   2HA   GLY  21          HA1       GLY  21  -2.747  -5.214   9.363
  148    H    SER  22           HN       SER  22  -3.630  -2.545  10.918
  149    HA   SER  22           HA       SER  22  -4.902  -0.765   9.349
  150   1HB   SER  22          HB2       SER  22  -2.383   0.369  10.328
  151   2HB   SER  22          HB1       SER  22  -4.045   0.810  10.710
  152    HG   SER  22           HG       SER  22  -4.106  -0.973  12.141
  153    H    ARG  23           HN       ARG  23  -4.287   0.811   7.796
  154    HA   ARG  23           HA       ARG  23  -2.894  -0.248   5.604
  155   1HB   ARG  23          HB2       ARG  23  -4.381   2.157   6.248
  156   2HB   ARG  23          HB1       ARG  23  -3.006   2.505   5.214
  157   1HG   ARG  23          HG2       ARG  23  -3.918   1.478   3.431
  158   2HG   ARG  23          HG1       ARG  23  -4.629   0.191   4.406
  159   1HD   ARG  23          HD2       ARG  23  -5.953   2.590   5.095
  160   2HD   ARG  23          HD1       ARG  23  -5.865   2.534   3.335
  161    HE   ARG  23           HE       ARG  23  -7.332   0.773   3.343
  162   1HH1  ARG  23          HH11      ARG  23  -6.146   1.284   6.586
  163   2HH1  ARG  23          HH12      ARG  23  -7.272   0.185   7.306
  164   1HH2  ARG  23          HH21      ARG  23  -8.816  -0.671   4.289
  165   2HH2  ARG  23          HH22      ARG  23  -8.788  -0.926   6.002
  166    H    GLU  24           HN       GLU  24  -1.996   2.030   8.097
  167    HA   GLU  24           HA       GLU  24   0.509   2.750   6.964
  168   1HB   GLU  24          HB2       GLU  24   0.001   2.943   9.901
  169   2HB   GLU  24          HB1       GLU  24   0.810   4.079   8.830
  170   1HG   GLU  24          HG2       GLU  24  -1.517   4.398   7.774
  171   2HG   GLU  24          HG1       GLU  24  -2.117   3.646   9.250
  172    H    ARG  25           HN       ARG  25  -0.496   0.286   9.281
  173    HA   ARG  25           HA       ARG  25   1.985  -0.458  10.275
  174   1HB   ARG  25          HB2       ARG  25  -0.164  -1.314  11.129
  175   2HB   ARG  25          HB1       ARG  25  -0.359  -2.266   9.663
  176   1HG   ARG  25          HG2       ARG  25   0.491  -3.868  11.021
  177   2HG   ARG  25          HG1       ARG  25   2.005  -3.204  10.401
  178   1HD   ARG  25          HD2       ARG  25   2.560  -2.259  12.384
  179   2HD   ARG  25          HD1       ARG  25   0.886  -1.900  12.804
  180    HE   ARG  25           HE       ARG  25   2.382  -4.150  13.631
  181   1HH1  ARG  25          HH11      ARG  25  -0.823  -3.239  12.596
  182   2HH1  ARG  25          HH12      ARG  25  -1.603  -4.513  13.472
  183   1HH2  ARG  25          HH21      ARG  25   1.358  -5.826  14.784
  184   2HH2  ARG  25          HH22      ARG  25  -0.365  -5.982  14.714
  185    H    CYS  26           HN       CYS  26   0.311  -1.636   7.385
  186    HA   CYS  26           HA       CYS  26   2.411  -3.405   6.620
  187   1HB   CYS  26          HB2       CYS  26   0.729  -2.461   4.419
  188   2HB   CYS  26          HB1       CYS  26   1.035  -4.093   4.981
  189    H    ALA  27           HN       ALA  27   1.557  -0.090   5.844
  190    HA   ALA  27           HA       ALA  27   3.254   0.376   3.701
  191   1HB   ALA  27          HB1       ALA  27   2.743   2.570   3.963
  192   2HB   ALA  27          HB2       ALA  27   3.018   2.540   5.705
  193   3HB   ALA  27          HB3       ALA  27   1.515   1.902   5.039
  194    H    SER  28           HN       SER  28   3.931   0.650   7.179
  195    HA   SER  28           HA       SER  28   6.634   1.444   6.832
  196   1HB   SER  28          HB2       SER  28   6.856   1.001   9.243
  197   2HB   SER  28          HB1       SER  28   5.392   1.923   8.900
  198    HG   SER  28           HG       SER  28   5.674  -0.749   9.696
  199    H    LEU  29           HN       LEU  29   4.990  -1.617   7.004
  200    HA   LEU  29           HA       LEU  29   7.267  -3.228   7.539
  201   1HB   LEU  29          HB2       LEU  29   4.554  -3.639   7.432
  202   2HB   LEU  29          HB1       LEU  29   5.114  -4.490   6.005
  203    HG   LEU  29           HG       LEU  29   6.839  -5.557   7.672
  204   1HD1  LEU  29          HD11      LEU  29   6.345  -4.245   9.607
  205   2HD1  LEU  29          HD12      LEU  29   5.778  -5.889   9.904
  206   3HD1  LEU  29          HD13      LEU  29   4.626  -4.621   9.488
  207   1HD2  LEU  29          HD21      LEU  29   5.017  -7.269   8.262
  208   2HD2  LEU  29          HD22      LEU  29   5.368  -6.978   6.558
  209   3HD2  LEU  29          HD23      LEU  29   3.946  -6.247   7.303
  210    H    SER  30           HN       SER  30   5.444  -2.649   4.519
  211    HA   SER  30           HA       SER  30   7.573  -3.868   2.972
  212   1HB   SER  30          HB2       SER  30   4.849  -3.700   2.612
  213   2HB   SER  30          HB1       SER  30   5.456  -2.499   1.473
  214    HG   SER  30           HG       SER  30   6.804  -4.127   0.600
  215    H    GLY  31           HN       GLY  31   5.973  -0.682   3.093
  216   1HA   GLY  31          HA2       GLY  31   7.392   1.303   3.173
  217   2HA   GLY  31          HA1       GLY  31   8.494   0.478   2.082
  218    H    CYS  32           HN       CYS  32   5.044   0.316   1.608
  219    HA   CYS  32           HA       CYS  32   5.262   1.342  -1.026
  220   1HB   CYS  32          HB2       CYS  32   2.869   0.685   0.702
  221   2HB   CYS  32          HB1       CYS  32   2.756   1.156  -0.983
  222    H    LYS  33           HN       LYS  33   2.472   2.771  -0.336
  223    HA   LYS  33           HA       LYS  33   3.396   5.190   0.914
  224   1HB   LYS  33          HB2       LYS  33   4.213   5.493  -1.378
  225   2HB   LYS  33          HB1       LYS  33   2.598   5.188  -2.003
  226   1HG   LYS  33          HG2       LYS  33   3.048   7.551  -2.012
  227   2HG   LYS  33          HG1       LYS  33   1.787   7.192  -0.832
  228   1HD   LYS  33          HD2       LYS  33   4.429   7.068   0.350
  229   2HD   LYS  33          HD1       LYS  33   4.124   8.638  -0.393
  230   1HE   LYS  33          HE2       LYS  33   1.772   7.962   0.978
  231   2HE   LYS  33          HE1       LYS  33   3.099   7.549   2.062
  232   1HZ   LYS  33          HZ1       LYS  33   2.274   9.865   2.276
  233   2HZ   LYS  33          HZ2       LYS  33   2.837  10.177   0.712
  234   3HZ   LYS  33          HZ3       LYS  33   3.928   9.759   1.934
  235    H    ILE  34           HN       ILE  34   1.767   6.036   2.027
  236    HA   ILE  34           HA       ILE  34  -0.916   5.013   1.577
  237    HB   ILE  34           HB       ILE  34   0.068   5.076   3.871
  238   1HG1  ILE  34          HG12      ILE  34  -1.995   6.239   4.901
  239   2HG1  ILE  34          HG11      ILE  34  -2.491   6.523   3.235
  240   1HG2  ILE  34          HG21      ILE  34   1.085   7.424   3.370
  241   2HG2  ILE  34          HG22      ILE  34   0.558   7.017   5.004
  242   3HG2  ILE  34          HG23      ILE  34  -0.467   8.009   3.967
  243   1HD1  ILE  34          HD11      ILE  34  -3.440   4.480   4.368
  244   2HD1  ILE  34          HD12      ILE  34  -1.819   3.791   4.272
  245   3HD1  ILE  34          HD13      ILE  34  -2.684   4.222   2.796
  246    H    ILE  35           HN       ILE  35  -2.306   6.074   0.345
  247    HA   ILE  35           HA       ILE  35  -1.975   8.986   0.033
  248    HB   ILE  35           HB       ILE  35  -3.735   7.696  -1.913
  249   1HG1  ILE  35          HG12      ILE  35  -1.589   6.891  -3.193
  250   2HG1  ILE  35          HG11      ILE  35  -0.911   6.748  -1.574
  251   1HG2  ILE  35          HG21      ILE  35  -1.263   9.198  -2.605
  252   2HG2  ILE  35          HG22      ILE  35  -2.577  10.051  -1.793
  253   3HG2  ILE  35          HG23      ILE  35  -2.865   9.255  -3.341
  254   1HD1  ILE  35          HD11      ILE  35  -3.490   5.533  -1.620
  255   2HD1  ILE  35          HD12      ILE  35  -1.916   4.803  -1.299
  256   3HD1  ILE  35          HD13      ILE  35  -2.521   4.909  -2.953
  257    H    SER  36           HN       SER  36  -4.393   9.626  -1.081
  258    HA   SER  36           HA       SER  36  -6.536   8.671   0.607
  259   1HB   SER  36          HB2       SER  36  -5.590  10.301   2.113
  260   2HB   SER  36          HB1       SER  36  -5.501  11.506   0.829
  261    HG   SER  36           HG       SER  36  -7.320  11.909   2.065
  262    H    ALA  37           HN       ALA  37  -5.819   8.892  -2.255
  263    HA   ALA  37           HA       ALA  37  -8.362   9.652  -3.249
  264   1HB   ALA  37          HB1       ALA  37  -7.521  11.904  -2.983
  265   2HB   ALA  37          HB2       ALA  37  -7.636  11.509  -4.698
  266   3HB   ALA  37          HB3       ALA  37  -6.066  11.496  -3.893
  267    H    SER  38           HN       SER  38  -5.050   9.778  -4.526
  268    HA   SER  38           HA       SER  38  -4.941   7.303  -5.723
  269   1HB   SER  38          HB2       SER  38  -6.691   9.124  -7.161
  270   2HB   SER  38          HB1       SER  38  -5.358   8.574  -8.174
  271    HG   SER  38           HG       SER  38  -7.382   7.079  -6.925
  272    H    THR  39           HN       THR  39  -4.185  10.715  -6.041
  273    HA   THR  39           HA       THR  39  -1.994  10.614  -7.730
  274    HB   THR  39           HB       THR  39  -1.944  12.421  -5.346
  275    HG1  THR  39           HG1      THR  39  -3.837  13.165  -5.783
  276   1HG2  THR  39          HG21      THR  39  -0.256  13.014  -6.803
  277   2HG2  THR  39          HG22      THR  39  -1.573  14.092  -7.271
  278   3HG2  THR  39          HG23      THR  39  -1.224  12.654  -8.233
  279    H    CYS  40           HN       CYS  40  -0.057   9.706  -7.600
  280    HA   CYS  40           HA       CYS  40   0.937   8.889  -4.950
  281   1HB   CYS  40          HB2       CYS  40   1.260   7.648  -7.675
  282   2HB   CYS  40          HB1       CYS  40   2.339   7.245  -6.342
  283    HA   PRO  41           HA       PRO  41   4.506  11.419  -5.142
  284   1HB   PRO  41          HB2       PRO  41   6.520   9.545  -4.715
  285   2HB   PRO  41          HB1       PRO  41   5.598  10.366  -3.454
  286   1HG   PRO  41          HG2       PRO  41   5.218   7.645  -4.620
  287   2HG   PRO  41          HG1       PRO  41   5.028   8.187  -2.942
  288   1HD   PRO  41          HD2       PRO  41   2.904   7.746  -4.507
  289   2HD   PRO  41          HD1       PRO  41   2.925   9.088  -3.342
  290    H    SER  42           HN       SER  42   5.954   8.424  -6.380
  291    HA   SER  42           HA       SER  42   7.245   9.805  -8.502
  292   1HB   SER  42          HB2       SER  42   8.293   7.843  -7.542
  293   2HB   SER  42          HB1       SER  42   6.909   6.843  -7.978
  294    HG   SER  42           HG       SER  42   7.713   6.633  -9.901
  295    H    ASP  43           HN       ASP  43   5.293   6.893  -9.038
  296    HA   ASP  43           HA       ASP  43   3.227   8.051 -10.511
  297   1HB   ASP  43          HB2       ASP  43   5.503   8.402 -11.922
  298   2HB   ASP  43          HB1       ASP  43   5.020   6.818 -12.520
  299    H    TYR  44           HN       TYR  44   3.646   5.898  -8.679
  300    HA   TYR  44           HA       TYR  44   2.871   3.599 -10.336
  301   1HB   TYR  44          HB2       TYR  44   3.509   2.244  -8.262
  302   2HB   TYR  44          HB1       TYR  44   4.823   2.953  -9.191
  303    HD1  TYR  44           HD1      TYR  44   3.020   2.989  -6.022
  304    HD2  TYR  44           HD2      TYR  44   6.095   4.852  -8.296
  305    HE1  TYR  44           HE1      TYR  44   3.866   4.067  -3.982
  306    HE2  TYR  44           HE2      TYR  44   6.950   5.936  -6.259
  307    HH   TYR  44           HH       TYR  44   6.362   5.015  -3.301
  308    HA   PRO  45           HA       PRO  45  -0.888   4.822  -7.933
  309   1HB   PRO  45          HB2       PRO  45  -2.627   4.715  -9.986
  310   2HB   PRO  45          HB1       PRO  45  -1.621   6.136  -9.682
  311   1HG   PRO  45          HG2       PRO  45  -1.229   3.928 -11.662
  312   2HG   PRO  45          HG1       PRO  45  -1.014   5.675 -11.877
  313   1HD   PRO  45          HD2       PRO  45   1.053   3.951 -11.430
  314   2HD   PRO  45          HD1       PRO  45   1.081   5.656 -10.943
  315    H    LYS  46           HN       LYS  46  -0.877   2.868  -6.799
  316    HA   LYS  46           HA       LYS  46  -1.725   0.442  -8.145
  317   1HB   LYS  46          HB2       LYS  46   0.065   0.303  -6.503
  318   2HB   LYS  46          HB1       LYS  46  -1.003   0.957  -5.277
  319   1HG   LYS  46          HG2       LYS  46  -2.199  -1.347  -6.490
  320   2HG   LYS  46          HG1       LYS  46  -0.576  -1.727  -5.911
  321   1HD   LYS  46          HD2       LYS  46  -2.395  -0.186  -4.128
  322   2HD   LYS  46          HD1       LYS  46  -2.684  -1.916  -4.331
  323   1HE   LYS  46          HE2       LYS  46  -0.112  -2.085  -3.871
  324   2HE   LYS  46          HE1       LYS  46  -0.346  -0.505  -3.125
  325   1HZ   LYS  46          HZ1       LYS  46  -0.845  -1.720  -1.328
  326   2HZ   LYS  46          HZ2       LYS  46  -1.182  -3.119  -2.217
  327   3HZ   LYS  46          HZ3       LYS  46  -2.358  -1.916  -2.058
  Start of MODEL    7
    1   1H    LYS   1          HT1       LYS   1  -7.879   4.805  -2.609
    2   2H    LYS   1          HT2       LYS   1  -8.159   4.401  -0.964
    3   3H    LYS   1          HT3       LYS   1  -9.094   3.665  -2.203
    4    HA   LYS   1           HA       LYS   1  -7.516   2.124  -1.455
    5   1HB   LYS   1          HB2       LYS   1  -7.903   2.939  -4.057
    6   2HB   LYS   1          HB1       LYS   1  -6.150   2.919  -3.929
    7   1HG   LYS   1          HG2       LYS   1  -6.260   0.589  -3.133
    8   2HG   LYS   1          HG1       LYS   1  -8.010   0.622  -3.353
    9   1HD   LYS   1          HD2       LYS   1  -7.324  -0.335  -5.334
   10   2HD   LYS   1          HD1       LYS   1  -7.398   1.369  -5.783
   11   1HE   LYS   1          HE2       LYS   1  -5.218   1.417  -6.235
   12   2HE   LYS   1          HE1       LYS   1  -4.820   0.706  -4.672
   13   1HZ   LYS   1          HZ1       LYS   1  -5.790  -0.938  -6.932
   14   2HZ   LYS   1          HZ2       LYS   1  -4.979  -1.446  -5.538
   15   3HZ   LYS   1          HZ3       LYS   1  -4.149  -0.581  -6.731
   16    H    SER   2           HN       SER   2  -4.911   1.898  -2.477
   17    HA   SER   2           HA       SER   2  -3.367   4.018  -1.247
   18   1HB   SER   2          HB2       SER   2  -3.874   1.543   0.037
   19   2HB   SER   2          HB1       SER   2  -2.178   1.568  -0.438
   20    HG   SER   2           HG       SER   2  -1.931   3.500   0.684
   21    H    CYS   3           HN       CYS   3  -0.965   3.589  -1.567
   22    HA   CYS   3           HA       CYS   3  -0.570   2.459  -4.259
   23   1HB   CYS   3          HB2       CYS   3   0.869   4.718  -2.855
   24   2HB   CYS   3          HB1       CYS   3   1.415   4.009  -4.367
   25    H    CYS   4           HN       CYS   4   1.415   1.269  -4.618
   26    HA   CYS   4           HA       CYS   4   2.861   0.545  -2.180
   27   1HB   CYS   4          HB2       CYS   4   1.040  -1.205  -3.684
   28   2HB   CYS   4          HB1       CYS   4   2.608  -1.915  -3.311
   29    HA   PRO   5           HA       PRO   5   5.571   1.752  -5.884
   30   1HB   PRO   5          HB2       PRO   5   7.154   1.906  -3.353
   31   2HB   PRO   5          HB1       PRO   5   7.250   2.920  -4.799
   32   1HG   PRO   5          HG2       PRO   5   5.891   3.698  -2.624
   33   2HG   PRO   5          HG1       PRO   5   5.351   4.102  -4.262
   34   1HD   PRO   5          HD2       PRO   5   4.166   2.252  -2.323
   35   2HD   PRO   5          HD1       PRO   5   3.446   2.970  -3.766
   36    H    ASN   6           HN       ASN   6   5.026  -1.087  -4.956
   37    HA   ASN   6           HA       ASN   6   7.157  -2.355  -6.192
   38   1HB   ASN   6          HB2       ASN   6   7.545  -1.851  -3.310
   39   2HB   ASN   6          HB1       ASN   6   7.790  -3.524  -3.799
   40   1HD2  ASN   6          HD21      ASN   6   9.301  -0.675  -3.323
   41   2HD2  ASN   6          HD22      ASN   6  10.663  -0.878  -4.367
   42    H    THR   7           HN       THR   7   6.261  -4.208  -6.910
   43    HA   THR   7           HA       THR   7   3.740  -5.092  -6.174
   44    HB   THR   7           HB       THR   7   4.486  -5.959  -8.200
   45    HG1  THR   7           HG1      THR   7   3.494  -7.640  -7.153
   46   1HG2  THR   7          HG21      THR   7   6.581  -7.448  -8.282
   47   2HG2  THR   7          HG22      THR   7   7.034  -6.626  -6.790
   48   3HG2  THR   7          HG23      THR   7   6.782  -5.696  -8.267
   49    H    THR   8           HN       THR   8   6.897  -5.924  -4.902
   50    HA   THR   8           HA       THR   8   6.122  -8.043  -3.222
   51    HB   THR   8           HB       THR   8   8.190  -7.292  -1.879
   52    HG1  THR   8           HG1      THR   8   8.134  -5.117  -2.665
   53   1HG2  THR   8          HG21      THR   8   8.165  -9.008  -3.754
   54   2HG2  THR   8          HG22      THR   8   9.708  -8.248  -3.368
   55   3HG2  THR   8          HG23      THR   8   8.794  -7.718  -4.780
   56    H    GLY   9           HN       GLY   9   5.912  -4.563  -2.949
   57   1HA   GLY   9          HA2       GLY   9   5.214  -4.614  -0.142
   58   2HA   GLY   9          HA1       GLY   9   5.171  -3.213  -1.209
   59    H    ARG  10           HN       ARG  10   3.632  -4.454  -3.253
   60    HA   ARG  10           HA       ARG  10   1.027  -3.858  -2.412
   61   1HB   ARG  10          HB2       ARG  10   2.253  -4.352  -4.827
   62   2HB   ARG  10          HB1       ARG  10   1.184  -5.737  -4.646
   63   1HG   ARG  10          HG2       ARG  10   0.014  -3.114  -4.040
   64   2HG   ARG  10          HG1       ARG  10   0.444  -3.412  -5.725
   65   1HD   ARG  10          HD2       ARG  10  -0.774  -5.756  -5.003
   66   2HD   ARG  10          HD1       ARG  10  -1.705  -4.550  -4.112
   67    HE   ARG  10           HE       ARG  10  -1.327  -3.658  -6.721
   68   1HH1  ARG  10          HH11      ARG  10  -3.064  -6.133  -4.986
   69   2HH1  ARG  10          HH12      ARG  10  -4.344  -6.230  -6.147
   70   1HH2  ARG  10          HH21      ARG  10  -3.015  -3.781  -8.257
   71   2HH2  ARG  10          HH22      ARG  10  -4.317  -4.895  -8.005
   72    H    ASN  11           HN       ASN  11   2.852  -6.841  -2.519
   73    HA   ASN  11           HA       ASN  11   0.681  -8.585  -2.006
   74   1HB   ASN  11          HB2       ASN  11   3.668  -8.794  -1.698
   75   2HB   ASN  11          HB1       ASN  11   2.600 -10.099  -1.220
   76   1HD2  ASN  11          HD21      ASN  11   4.584  -9.263  -3.546
   77   2HD2  ASN  11          HD22      ASN  11   3.808  -9.952  -4.926
   78    H    ILE  12           HN       ILE  12   3.332  -7.642   0.209
   79    HA   ILE  12           HA       ILE  12   2.084  -8.607   2.498
   80    HB   ILE  12           HB       ILE  12   4.089  -6.373   2.232
   81   1HG1  ILE  12          HG12      ILE  12   5.360  -8.442   3.443
   82   2HG1  ILE  12          HG11      ILE  12   4.213  -9.316   2.432
   83   1HG2  ILE  12          HG21      ILE  12   4.482  -7.104   4.734
   84   2HG2  ILE  12          HG22      ILE  12   2.776  -7.540   4.634
   85   3HG2  ILE  12          HG23      ILE  12   3.281  -5.881   4.318
   86   1HD1  ILE  12          HD11      ILE  12   5.675  -7.139   1.119
   87   2HD1  ILE  12          HD12      ILE  12   5.256  -8.746   0.532
   88   3HD1  ILE  12          HD13      ILE  12   6.635  -8.532   1.611
   89    H    TYR  13           HN       TYR  13   1.897  -5.380   1.052
   90    HA   TYR  13           HA       TYR  13   0.408  -4.210   3.117
   91   1HB   TYR  13          HB2       TYR  13   1.585  -3.181   1.030
   92   2HB   TYR  13          HB1       TYR  13   0.029  -3.437   0.251
   93    HD1  TYR  13           HD1      TYR  13   1.972  -1.230   2.225
   94    HD2  TYR  13           HD2      TYR  13  -2.034  -2.443   1.472
   95    HE1  TYR  13           HE1      TYR  13   1.158   0.889   3.161
   96    HE2  TYR  13           HE2      TYR  13  -2.858  -0.325   2.409
   97    HH   TYR  13           HH       TYR  13  -1.670   2.160   2.655
   98    H    ASN  14           HN       ASN  14  -0.609  -5.811   0.126
   99    HA   ASN  14           HA       ASN  14  -3.365  -5.465   0.535
  100   1HB   ASN  14          HB2       ASN  14  -1.688  -7.225  -1.210
  101   2HB   ASN  14          HB1       ASN  14  -3.421  -7.477  -1.116
  102   1HD2  ASN  14          HD21      ASN  14  -1.535  -4.467  -1.056
  103   2HD2  ASN  14          HD22      ASN  14  -2.285  -3.771  -2.445
  104    H    THR  15           HN       THR  15  -1.310  -8.403   1.021
  105    HA   THR  15           HA       THR  15  -3.422  -9.883   2.176
  106    HB   THR  15           HB       THR  15  -1.624 -11.190   1.468
  107    HG1  THR  15           HG1      THR  15  -1.238 -12.363   3.226
  108   1HG2  THR  15          HG21      THR  15   0.592 -10.640   3.045
  109   2HG2  THR  15          HG22      THR  15   0.033  -9.067   2.480
  110   3HG2  THR  15          HG23      THR  15   0.413 -10.338   1.317
  111    H    CYS  16           HN       CYS  16  -0.976  -7.769   3.579
  112    HA   CYS  16           HA       CYS  16  -1.372  -8.227   6.276
  113   1HB   CYS  16          HB2       CYS  16   0.362  -6.745   5.722
  114   2HB   CYS  16          HB1       CYS  16  -0.670  -5.780   4.680
  115    H    ARG  17           HN       ARG  17  -3.049  -5.890   4.177
  116    HA   ARG  17           HA       ARG  17  -4.938  -5.040   6.078
  117   1HB   ARG  17          HB2       ARG  17  -4.542  -4.807   3.187
  118   2HB   ARG  17          HB1       ARG  17  -6.238  -4.833   3.649
  119   1HG   ARG  17          HG2       ARG  17  -4.445  -3.048   5.186
  120   2HG   ARG  17          HG1       ARG  17  -4.821  -2.592   3.523
  121   1HD   ARG  17          HD2       ARG  17  -7.057  -3.431   5.294
  122   2HD   ARG  17          HD1       ARG  17  -6.341  -1.841   5.556
  123    HE   ARG  17           HE       ARG  17  -6.906  -2.184   2.818
  124   1HH1  ARG  17          HH11      ARG  17  -8.525  -1.694   5.871
  125   2HH1  ARG  17          HH12      ARG  17  -9.891  -0.901   5.162
  126   1HH2  ARG  17          HH21      ARG  17  -8.703  -1.140   1.884
  127   2HH2  ARG  17          HH22      ARG  17  -9.993  -0.586   2.899
  128    H    LEU  18           HN       LEU  18  -4.852  -7.767   3.864
  129    HA   LEU  18           HA       LEU  18  -7.528  -8.565   4.089
  130   1HB   LEU  18          HB2       LEU  18  -6.873 -10.159   2.647
  131   2HB   LEU  18          HB1       LEU  18  -5.297  -9.409   2.704
  132    HG   LEU  18           HG       LEU  18  -4.778 -10.977   4.627
  133   1HD1  LEU  18          HD11      LEU  18  -7.500 -11.784   4.025
  134   2HD1  LEU  18          HD12      LEU  18  -6.496 -12.154   5.427
  135   3HD1  LEU  18          HD13      LEU  18  -6.372 -13.139   3.970
  136   1HD2  LEU  18          HD21      LEU  18  -5.033 -12.900   2.562
  137   2HD2  LEU  18          HD22      LEU  18  -3.608 -11.974   3.028
  138   3HD2  LEU  18          HD23      LEU  18  -4.710 -11.339   1.808
  139    H    GLY  19           HN       GLY  19  -4.916  -8.746   6.302
  140   1HA   GLY  19          HA2       GLY  19  -6.395 -10.678   7.954
  141   2HA   GLY  19          HA1       GLY  19  -4.675 -10.352   8.091
  142    H    GLY  20           HN       GLY  20  -6.817  -7.672   7.656
  143   1HA   GLY  20          HA2       GLY  20  -7.537  -6.025   9.089
  144   2HA   GLY  20          HA1       GLY  20  -7.370  -7.182  10.398
  145    H    GLY  21           HN       GLY  21  -5.214  -5.423   8.178
  146   1HA   GLY  21          HA2       GLY  21  -3.640  -4.590  10.519
  147   2HA   GLY  21          HA1       GLY  21  -2.864  -5.183   9.055
  148    H    SER  22           HN       SER  22  -3.473  -2.484  10.670
  149    HA   SER  22           HA       SER  22  -4.633  -0.588   9.133
  150   1HB   SER  22          HB2       SER  22  -2.063   0.390  10.105
  151   2HB   SER  22          HB1       SER  22  -3.698   0.871  10.556
  152    HG   SER  22           HG       SER  22  -2.058  -1.123  11.653
  153    H    ARG  23           HN       ARG  23  -3.923   0.929   7.582
  154    HA   ARG  23           HA       ARG  23  -2.561  -0.220   5.407
  155   1HB   ARG  23          HB2       ARG  23  -3.978   2.229   5.992
  156   2HB   ARG  23          HB1       ARG  23  -2.548   2.550   5.023
  157   1HG   ARG  23          HG2       ARG  23  -3.563   1.820   3.196
  158   2HG   ARG  23          HG1       ARG  23  -3.923   0.275   3.967
  159   1HD   ARG  23          HD2       ARG  23  -6.035   0.892   4.528
  160   2HD   ARG  23          HD1       ARG  23  -5.593   2.582   4.765
  161    HE   ARG  23           HE       ARG  23  -6.211   2.990   2.609
  162   1HH1  ARG  23          HH11      ARG  23  -5.638  -0.434   2.958
  163   2HH1  ARG  23          HH12      ARG  23  -6.189  -0.816   1.361
  164   1HH2  ARG  23          HH21      ARG  23  -6.936   2.490   0.509
  165   2HH2  ARG  23          HH22      ARG  23  -6.925   0.844  -0.029
  166    H    GLU  24           HN       GLU  24  -1.594   2.053   7.882
  167    HA   GLU  24           HA       GLU  24   0.949   2.644   6.765
  168   1HB   GLU  24          HB2       GLU  24   0.413   2.911   9.693
  169   2HB   GLU  24          HB1       GLU  24   1.291   3.987   8.614
  170   1HG   GLU  24          HG2       GLU  24  -1.003   4.397   7.517
  171   2HG   GLU  24          HG1       GLU  24  -1.660   3.700   8.996
  172    H    ARG  25           HN       ARG  25  -0.172   0.233   9.096
  173    HA   ARG  25           HA       ARG  25   2.311  -0.553  10.090
  174   1HB   ARG  25          HB2       ARG  25   0.103  -1.293  10.979
  175   2HB   ARG  25          HB1       ARG  25  -0.070  -2.344   9.581
  176   1HG   ARG  25          HG2       ARG  25   0.793  -3.881  10.969
  177   2HG   ARG  25          HG1       ARG  25   2.329  -3.160  10.481
  178   1HD   ARG  25          HD2       ARG  25   2.455  -3.230  12.810
  179   2HD   ARG  25          HD1       ARG  25   1.987  -1.567  12.460
  180    HE   ARG  25           HE       ARG  25  -0.386  -2.805  12.827
  181   1HH1  ARG  25          HH11      ARG  25   2.538  -2.657  14.725
  182   2HH1  ARG  25          HH12      ARG  25   1.712  -2.820  16.237
  183   1HH2  ARG  25          HH21      ARG  25  -1.473  -3.019  14.817
  184   2HH2  ARG  25          HH22      ARG  25  -0.564  -3.026  16.291
  185    H    CYS  26           HN       CYS  26   0.522  -1.808   7.297
  186    HA   CYS  26           HA       CYS  26   2.584  -3.630   6.544
  187   1HB   CYS  26          HB2       CYS  26   0.864  -2.763   4.345
  188   2HB   CYS  26          HB1       CYS  26   1.145  -4.370   4.984
  189    H    ALA  27           HN       ALA  27   1.766  -0.328   5.763
  190    HA   ALA  27           HA       ALA  27   3.360   0.105   3.532
  191   1HB   ALA  27          HB1       ALA  27   1.715   1.670   4.911
  192   2HB   ALA  27          HB2       ALA  27   2.952   2.328   3.841
  193   3HB   ALA  27          HB3       ALA  27   3.238   2.253   5.580
  194    H    SER  28           HN       SER  28   4.228   0.632   6.958
  195    HA   SER  28           HA       SER  28   6.955   1.177   6.374
  196   1HB   SER  28          HB2       SER  28   5.510   0.490   8.935
  197   2HB   SER  28          HB1       SER  28   7.240   0.829   8.877
  198    HG   SER  28           HG       SER  28   5.836   2.664   9.354
  199    H    LEU  29           HN       LEU  29   5.121  -1.698   6.774
  200    HA   LEU  29           HA       LEU  29   7.213  -3.432   7.584
  201   1HB   LEU  29          HB2       LEU  29   4.449  -3.609   7.165
  202   2HB   LEU  29          HB1       LEU  29   5.160  -4.769   6.060
  203    HG   LEU  29           HG       LEU  29   6.084  -4.785   8.892
  204   1HD1  LEU  29          HD11      LEU  29   3.375  -5.613   7.937
  205   2HD1  LEU  29          HD12      LEU  29   3.831  -4.763   9.414
  206   3HD1  LEU  29          HD13      LEU  29   4.168  -6.486   9.247
  207   1HD2  LEU  29          HD21      LEU  29   7.018  -6.225   7.036
  208   2HD2  LEU  29          HD22      LEU  29   5.464  -7.059   7.024
  209   3HD2  LEU  29          HD23      LEU  29   6.464  -7.080   8.477
  210    H    SER  30           HN       SER  30   5.780  -2.737   4.381
  211    HA   SER  30           HA       SER  30   7.958  -4.278   3.185
  212   1HB   SER  30          HB2       SER  30   5.261  -4.299   2.630
  213   2HB   SER  30          HB1       SER  30   5.932  -3.325   1.321
  214    HG   SER  30           HG       SER  30   7.223  -5.003   0.728
  215    H    GLY  31           HN       GLY  31   6.149  -1.522   1.871
  216   1HA   GLY  31          HA2       GLY  31   7.888   0.529   2.031
  217   2HA   GLY  31          HA1       GLY  31   8.584  -0.451   0.750
  218    H    CYS  32           HN       CYS  32   5.197   0.100   1.498
  219    HA   CYS  32           HA       CYS  32   4.625   0.802  -1.257
  220   1HB   CYS  32          HB2       CYS  32   2.927   0.484   1.236
  221   2HB   CYS  32          HB1       CYS  32   2.272   0.866  -0.344
  222    H    LYS  33           HN       LYS  33   2.484   2.609  -0.856
  223    HA   LYS  33           HA       LYS  33   3.643   4.932   0.474
  224   1HB   LYS  33          HB2       LYS  33   4.021   4.634  -2.197
  225   2HB   LYS  33          HB1       LYS  33   2.491   5.498  -2.183
  226   1HG   LYS  33          HG2       LYS  33   4.874   6.455  -0.638
  227   2HG   LYS  33          HG1       LYS  33   4.606   6.885  -2.328
  228   1HD   LYS  33          HD2       LYS  33   3.410   8.599  -1.529
  229   2HD   LYS  33          HD1       LYS  33   2.165   7.398  -1.183
  230   1HE   LYS  33          HE2       LYS  33   2.396   7.696   1.005
  231   2HE   LYS  33          HE1       LYS  33   4.137   7.439   0.913
  232   1HZ   LYS  33          HZ1       LYS  33   2.835  10.020   0.251
  233   2HZ   LYS  33          HZ2       LYS  33   4.487   9.724   0.463
  234   3HZ   LYS  33          HZ3       LYS  33   3.439   9.651   1.788
  235    H    ILE  34           HN       ILE  34   2.155   5.886   1.670
  236    HA   ILE  34           HA       ILE  34  -0.660   5.305   1.157
  237    HB   ILE  34           HB       ILE  34   0.345   4.879   3.422
  238   1HG1  ILE  34          HG12      ILE  34  -1.602   6.315   4.560
  239   2HG1  ILE  34          HG11      ILE  34  -2.088   6.493   2.876
  240   1HG2  ILE  34          HG21      ILE  34   0.105   7.772   4.043
  241   2HG2  ILE  34          HG22      ILE  34   1.571   7.210   3.240
  242   3HG2  ILE  34          HG23      ILE  34   1.103   6.529   4.798
  243   1HD1  ILE  34          HD11      ILE  34  -2.658   4.314   2.670
  244   2HD1  ILE  34          HD12      ILE  34  -2.923   4.494   4.404
  245   3HD1  ILE  34          HD13      ILE  34  -1.430   3.768   3.811
  246    H    ILE  35           HN       ILE  35  -1.809   6.754   0.061
  247    HA   ILE  35           HA       ILE  35  -0.876   9.440  -0.313
  248    HB   ILE  35           HB       ILE  35  -3.062   9.688  -1.560
  249   1HG1  ILE  35          HG12      ILE  35  -3.783   7.419  -0.188
  250   2HG1  ILE  35          HG11      ILE  35  -4.615   8.062  -1.597
  251   1HG2  ILE  35          HG21      ILE  35  -2.268   8.444  -3.484
  252   2HG2  ILE  35          HG22      ILE  35  -1.211   7.488  -2.446
  253   3HG2  ILE  35          HG23      ILE  35  -0.922   9.216  -2.644
  254   1HD1  ILE  35          HD11      ILE  35  -3.269   6.590  -3.032
  255   2HD1  ILE  35          HD12      ILE  35  -4.230   5.699  -1.853
  256   3HD1  ILE  35          HD13      ILE  35  -2.501   5.920  -1.592
  257    H    SER  36           HN       SER  36  -2.915  11.104  -0.281
  258    HA   SER  36           HA       SER  36  -4.006  10.976   2.454
  259   1HB   SER  36          HB2       SER  36  -2.582  13.165   1.026
  260   2HB   SER  36          HB1       SER  36  -3.928  13.627   2.068
  261    HG   SER  36           HG       SER  36  -1.849  11.918   2.940
  262    H    ALA  37           HN       ALA  37  -5.068  10.305  -0.320
  263    HA   ALA  37           HA       ALA  37  -7.728  10.984   0.061
  264   1HB   ALA  37          HB1       ALA  37  -7.606  13.198  -0.442
  265   2HB   ALA  37          HB2       ALA  37  -7.757  12.570  -2.083
  266   3HB   ALA  37          HB3       ALA  37  -6.170  13.001  -1.446
  267    H    SER  38           HN       SER  38  -5.298  10.651  -2.484
  268    HA   SER  38           HA       SER  38  -5.936   8.156  -3.368
  269   1HB   SER  38          HB2       SER  38  -7.940  10.088  -4.220
  270   2HB   SER  38          HB1       SER  38  -7.188   9.276  -5.592
  271    HG   SER  38           HG       SER  38  -8.762   7.909  -5.029
  272    H    THR  39           HN       THR  39  -5.052  11.409  -4.307
  273    HA   THR  39           HA       THR  39  -3.709  10.838  -6.695
  274    HB   THR  39           HB       THR  39  -2.662  12.962  -4.881
  275    HG1  THR  39           HG1      THR  39  -5.175  13.151  -6.174
  276   1HG2  THR  39          HG21      THR  39  -2.305  14.188  -6.769
  277   2HG2  THR  39          HG22      THR  39  -3.622  13.417  -7.654
  278   3HG2  THR  39          HG23      THR  39  -2.104  12.556  -7.405
  279    H    CYS  40           HN       CYS  40  -1.958   9.678  -7.073
  280    HA   CYS  40           HA       CYS  40  -0.178   8.994  -4.857
  281   1HB   CYS  40          HB2       CYS  40  -1.261   7.339  -6.608
  282   2HB   CYS  40          HB1       CYS  40   0.107   7.830  -7.598
  283    HA   PRO  41           HA       PRO  41   3.068  11.860  -5.730
  284   1HB   PRO  41          HB2       PRO  41   4.709   9.346  -5.764
  285   2HB   PRO  41          HB1       PRO  41   5.051  10.895  -4.991
  286   1HG   PRO  41          HG2       PRO  41   4.089   8.810  -3.610
  287   2HG   PRO  41          HG1       PRO  41   3.628  10.477  -3.229
  288   1HD   PRO  41          HD2       PRO  41   2.035   8.323  -4.436
  289   2HD   PRO  41          HD1       PRO  41   1.495   9.802  -3.624
  290    H    SER  42           HN       SER  42   4.819   9.316  -7.333
  291    HA   SER  42           HA       SER  42   4.927  10.797  -9.753
  292   1HB   SER  42          HB2       SER  42   5.872   8.029  -8.998
  293   2HB   SER  42          HB1       SER  42   6.111   8.710 -10.607
  294    HG   SER  42           HG       SER  42   7.916   9.100  -9.291
  295    H    ASP  43           HN       ASP  43   3.891   7.420  -9.338
  296    HA   ASP  43           HA       ASP  43   1.322   7.666 -10.367
  297   1HB   ASP  43          HB2       ASP  43   3.439   7.624 -12.405
  298   2HB   ASP  43          HB1       ASP  43   2.192   6.406 -12.652
  299    H    TYR  44           HN       TYR  44   2.537   6.215  -8.346
  300    HA   TYR  44           HA       TYR  44   2.515   3.445  -9.317
  301   1HB   TYR  44          HB2       TYR  44   4.382   4.575  -7.773
  302   2HB   TYR  44          HB1       TYR  44   3.259   4.090  -6.510
  303    HD1  TYR  44           HD1      TYR  44   2.468   1.600  -6.618
  304    HD2  TYR  44           HD2      TYR  44   5.975   3.088  -8.511
  305    HE1  TYR  44           HE1      TYR  44   3.415  -0.667  -6.652
  306    HE2  TYR  44           HE2      TYR  44   6.927   0.820  -8.540
  307    HH   TYR  44           HH       TYR  44   5.168  -1.933  -7.147
  308    HA   PRO  45           HA       PRO  45  -1.744   4.085  -7.492
  309   1HB   PRO  45          HB2       PRO  45  -2.617   1.817  -8.903
  310   2HB   PRO  45          HB1       PRO  45  -2.872   3.502  -9.364
  311   1HG   PRO  45          HG2       PRO  45  -0.813   1.568 -10.306
  312   2HG   PRO  45          HG1       PRO  45  -1.638   2.860 -11.197
  313   1HD   PRO  45          HD2       PRO  45   0.897   3.127 -10.387
  314   2HD   PRO  45          HD1       PRO  45  -0.224   4.505 -10.364
  315    H    LYS  46           HN       LYS  46   0.225   1.187  -7.896
  316    HA   LYS  46           HA       LYS  46  -0.011   0.443  -5.192
  317   1HB   LYS  46          HB2       LYS  46  -1.996  -0.588  -7.033
  318   2HB   LYS  46          HB1       LYS  46  -1.064  -1.869  -6.280
  319   1HG   LYS  46          HG2       LYS  46  -1.627  -0.259  -4.151
  320   2HG   LYS  46          HG1       LYS  46  -3.080  -0.095  -5.137
  321   1HD   LYS  46          HD2       LYS  46  -3.081  -2.639  -5.270
  322   2HD   LYS  46          HD1       LYS  46  -1.880  -2.594  -3.978
  323   1HE   LYS  46          HE2       LYS  46  -3.375  -1.867  -2.419
  324   2HE   LYS  46          HE1       LYS  46  -4.362  -1.014  -3.605
  325   1HZ   LYS  46          HZ1       LYS  46  -5.694  -2.783  -3.071
  326   2HZ   LYS  46          HZ2       LYS  46  -4.403  -3.854  -2.854
  327   3HZ   LYS  46          HZ3       LYS  46  -4.879  -3.411  -4.415
  Start of MODEL    8
    1   1H    LYS   1          HT1       LYS   1  -7.609   1.947  -0.381
    2   2H    LYS   1          HT2       LYS   1  -7.351   0.318   0.093
    3   3H    LYS   1          HT3       LYS   1  -8.499   0.687  -1.127
    4    HA   LYS   1           HA       LYS   1  -6.538  -0.196  -2.090
    5   1HB   LYS   1          HB2       LYS   1  -7.886   2.098  -2.785
    6   2HB   LYS   1          HB1       LYS   1  -6.210   2.628  -2.826
    7   1HG   LYS   1          HG2       LYS   1  -5.946   0.360  -4.195
    8   2HG   LYS   1          HG1       LYS   1  -7.639   0.701  -4.557
    9   1HD   LYS   1          HD2       LYS   1  -6.714   1.904  -6.242
   10   2HD   LYS   1          HD1       LYS   1  -6.604   3.135  -4.982
   11   1HE   LYS   1          HE2       LYS   1  -4.506   2.814  -6.297
   12   2HE   LYS   1          HE1       LYS   1  -4.317   2.595  -4.558
   13   1HZ   LYS   1          HZ1       LYS   1  -3.397   0.875  -6.353
   14   2HZ   LYS   1          HZ2       LYS   1  -4.926   0.201  -6.091
   15   3HZ   LYS   1          HZ3       LYS   1  -3.862   0.415  -4.792
   16    H    SER   2           HN       SER   2  -4.403   1.357  -2.990
   17    HA   SER   2           HA       SER   2  -2.885   2.557  -0.954
   18   1HB   SER   2          HB2       SER   2  -1.333   0.850  -0.344
   19   2HB   SER   2          HB1       SER   2  -2.940   0.158  -0.129
   20    HG   SER   2           HG       SER   2  -0.998  -0.834  -1.546
   21    H    CYS   3           HN       CYS   3  -0.592   2.867  -1.604
   22    HA   CYS   3           HA       CYS   3  -0.315   2.777  -4.539
   23   1HB   CYS   3          HB2       CYS   3  -0.632   5.066  -3.381
   24   2HB   CYS   3          HB1       CYS   3   1.012   4.843  -2.800
   25    H    CYS   4           HN       CYS   4   0.804   0.795  -4.470
   26    HA   CYS   4           HA       CYS   4   3.368   0.791  -3.054
   27   1HB   CYS   4          HB2       CYS   4   1.740  -1.413  -4.316
   28   2HB   CYS   4          HB1       CYS   4   3.380  -1.657  -3.723
   29    HA   PRO   5           HA       PRO   5   5.601   1.547  -6.795
   30   1HB   PRO   5          HB2       PRO   5   8.014   0.523  -6.102
   31   2HB   PRO   5          HB1       PRO   5   7.400   2.050  -5.457
   32   1HG   PRO   5          HG2       PRO   5   7.392  -0.672  -4.211
   33   2HG   PRO   5          HG1       PRO   5   7.788   0.893  -3.477
   34   1HD   PRO   5          HD2       PRO   5   5.383  -0.304  -3.144
   35   2HD   PRO   5          HD1       PRO   5   5.571   1.460  -3.189
   36    H    ASN   6           HN       ASN   6   5.510  -1.685  -5.412
   37    HA   ASN   6           HA       ASN   6   5.306  -2.831  -8.052
   38   1HB   ASN   6          HB2       ASN   6   7.178  -4.506  -7.506
   39   2HB   ASN   6          HB1       ASN   6   7.656  -2.893  -8.025
   40   1HD2  ASN   6          HD21      ASN   6   9.686  -3.491  -6.999
   41   2HD2  ASN   6          HD22      ASN   6   9.868  -3.245  -5.299
   42    H    THR   7           HN       THR   7   5.282  -5.368  -7.773
   43    HA   THR   7           HA       THR   7   3.057  -5.978  -6.188
   44    HB   THR   7           HB       THR   7   3.403  -7.367  -8.045
   45    HG1  THR   7           HG1      THR   7   3.137  -9.249  -7.109
   46   1HG2  THR   7          HG21      THR   7   5.480  -8.873  -8.131
   47   2HG2  THR   7          HG22      THR   7   6.208  -7.675  -7.061
   48   3HG2  THR   7          HG23      THR   7   5.628  -7.197  -8.656
   49    H    THR   8           HN       THR   8   6.483  -6.140  -5.503
   50    HA   THR   8           HA       THR   8   6.393  -7.845  -3.275
   51    HB   THR   8           HB       THR   8   8.483  -6.536  -2.569
   52    HG1  THR   8           HG1      THR   8   7.829  -4.676  -3.896
   53   1HG2  THR   8          HG21      THR   8   8.395  -8.654  -4.013
   54   2HG2  THR   8          HG22      THR   8   9.866  -7.682  -4.029
   55   3HG2  THR   8          HG23      THR   8   8.719  -7.566  -5.363
   56    H    GLY   9           HN       GLY   9   5.232  -4.660  -3.681
   57   1HA   GLY   9          HA2       GLY   9   5.165  -4.226  -0.771
   58   2HA   GLY   9          HA1       GLY   9   4.944  -2.979  -1.991
   59    H    ARG  10           HN       ARG  10   3.157  -4.414  -3.649
   60    HA   ARG  10           HA       ARG  10   0.699  -3.752  -2.486
   61   1HB   ARG  10          HB2       ARG  10   1.040  -3.805  -4.900
   62   2HB   ARG  10          HB1       ARG  10   1.333  -5.538  -4.843
   63   1HG   ARG  10          HG2       ARG  10  -0.820  -5.664  -5.419
   64   2HG   ARG  10          HG1       ARG  10  -1.098  -5.422  -3.694
   65   1HD   ARG  10          HD2       ARG  10  -2.395  -3.717  -4.372
   66   2HD   ARG  10          HD1       ARG  10  -0.864  -2.859  -4.549
   67    HE   ARG  10           HE       ARG  10  -1.218  -2.830  -6.796
   68   1HH1  ARG  10          HH11      ARG  10  -3.117  -5.421  -5.432
   69   2HH1  ARG  10          HH12      ARG  10  -3.886  -5.816  -6.933
   70   1HH2  ARG  10          HH21      ARG  10  -2.229  -3.348  -8.771
   71   2HH2  ARG  10          HH22      ARG  10  -3.381  -4.640  -8.829
   72    H    ASN  11           HN       ASN  11   2.441  -6.809  -2.747
   73    HA   ASN  11           HA       ASN  11   0.389  -8.509  -1.897
   74   1HB   ASN  11          HB2       ASN  11   2.333 -10.000  -1.236
   75   2HB   ASN  11          HB1       ASN  11   2.287  -9.488  -2.906
   76   1HD2  ASN  11          HD21      ASN  11   4.604 -10.364  -2.258
   77   2HD2  ASN  11          HD22      ASN  11   5.742  -9.108  -1.925
   78    H    ILE  12           HN       ILE  12   3.181  -7.379   0.030
   79    HA   ILE  12           HA       ILE  12   2.209  -8.283   2.474
   80    HB   ILE  12           HB       ILE  12   4.039  -5.972   1.857
   81   1HG1  ILE  12          HG12      ILE  12   5.452  -7.810   3.295
   82   2HG1  ILE  12          HG11      ILE  12   4.322  -8.848   2.431
   83   1HG2  ILE  12          HG21      ILE  12   2.986  -6.891   4.501
   84   2HG2  ILE  12          HG22      ILE  12   3.226  -5.250   3.900
   85   3HG2  ILE  12          HG23      ILE  12   4.615  -6.225   4.377
   86   1HD1  ILE  12          HD11      ILE  12   5.132  -7.303   0.413
   87   2HD1  ILE  12          HD12      ILE  12   5.947  -8.794   0.880
   88   3HD1  ILE  12          HD13      ILE  12   6.571  -7.238   1.428
   89    H    TYR  13           HN       TYR  13   1.677  -5.155   0.910
   90    HA   TYR  13           HA       TYR  13   0.202  -3.991   2.987
   91   1HB   TYR  13          HB2       TYR  13   1.183  -3.109   0.669
   92   2HB   TYR  13          HB1       TYR  13  -0.473  -3.382   0.162
   93    HD1  TYR  13           HD1      TYR  13  -2.302  -2.058   1.152
   94    HD2  TYR  13           HD2      TYR  13   1.763  -1.332   2.163
   95    HE1  TYR  13           HE1      TYR  13  -2.932   0.123   2.093
   96    HE2  TYR  13           HE2      TYR  13   1.146   0.851   3.109
   97    HH   TYR  13           HH       TYR  13  -0.604   2.490   2.962
   98    H    ASN  14           HN       ASN  14  -0.762  -5.920   0.189
   99    HA   ASN  14           HA       ASN  14  -3.537  -5.788   0.609
  100   1HB   ASN  14          HB2       ASN  14  -1.689  -7.479  -0.999
  101   2HB   ASN  14          HB1       ASN  14  -3.330  -8.055  -0.758
  102   1HD2  ASN  14          HD21      ASN  14  -2.001  -4.803  -1.220
  103   2HD2  ASN  14          HD22      ASN  14  -2.957  -4.422  -2.609
  104    H    THR  15           HN       THR  15  -1.284  -8.522   1.263
  105    HA   THR  15           HA       THR  15  -3.179 -10.052   2.645
  106    HB   THR  15           HB       THR  15  -1.314 -11.280   2.052
  107    HG1  THR  15           HG1      THR  15  -1.120 -12.189   3.911
  108   1HG2  THR  15          HG21      THR  15   0.972 -10.349   3.237
  109   2HG2  THR  15          HG22      THR  15   0.189  -8.873   2.674
  110   3HG2  THR  15          HG23      THR  15   0.543 -10.173   1.536
  111    H    CYS  16           HN       CYS  16  -0.877  -7.630   3.794
  112    HA   CYS  16           HA       CYS  16  -1.190  -7.852   6.523
  113   1HB   CYS  16          HB2       CYS  16   0.390  -6.280   5.796
  114   2HB   CYS  16          HB1       CYS  16  -0.738  -5.519   4.686
  115    H    ARG  17           HN       ARG  17  -3.095  -5.827   4.294
  116    HA   ARG  17           HA       ARG  17  -5.012  -4.979   6.155
  117   1HB   ARG  17          HB2       ARG  17  -4.695  -4.982   3.249
  118   2HB   ARG  17          HB1       ARG  17  -6.375  -5.109   3.751
  119   1HG   ARG  17          HG2       ARG  17  -5.533  -3.114   5.362
  120   2HG   ARG  17          HG1       ARG  17  -4.501  -2.854   3.954
  121   1HD   ARG  17          HD2       ARG  17  -6.217  -2.176   2.669
  122   2HD   ARG  17          HD1       ARG  17  -7.314  -3.391   3.323
  123    HE   ARG  17           HE       ARG  17  -7.176  -0.680   4.084
  124   1HH1  ARG  17          HH11      ARG  17  -7.580  -3.863   5.455
  125   2HH1  ARG  17          HH12      ARG  17  -8.499  -3.299   6.810
  126   1HH2  ARG  17          HH21      ARG  17  -8.382   0.063   5.866
  127   2HH2  ARG  17          HH22      ARG  17  -8.954  -1.069   7.044
  128    H    LEU  18           HN       LEU  18  -4.751  -7.891   4.218
  129    HA   LEU  18           HA       LEU  18  -7.350  -8.867   4.552
  130   1HB   LEU  18          HB2       LEU  18  -6.583 -10.570   3.305
  131   2HB   LEU  18          HB1       LEU  18  -5.077  -9.685   3.240
  132    HG   LEU  18           HG       LEU  18  -4.431 -10.964   5.349
  133   1HD1  LEU  18          HD11      LEU  18  -6.089 -12.168   6.249
  134   2HD1  LEU  18          HD12      LEU  18  -5.753 -13.333   4.968
  135   3HD1  LEU  18          HD13      LEU  18  -7.036 -12.141   4.761
  136   1HD2  LEU  18          HD21      LEU  18  -4.495 -11.835   2.554
  137   2HD2  LEU  18          HD22      LEU  18  -4.231 -13.134   3.717
  138   3HD2  LEU  18          HD23      LEU  18  -3.145 -11.745   3.685
  139    H    GLY  19           HN       GLY  19  -4.687  -8.708   6.725
  140   1HA   GLY  19          HA2       GLY  19  -6.054 -10.520   8.590
  141   2HA   GLY  19          HA1       GLY  19  -4.354 -10.088   8.670
  142    H    GLY  20           HN       GLY  20  -6.632  -7.577   7.998
  143   1HA   GLY  20          HA2       GLY  20  -7.382  -5.805   9.252
  144   2HA   GLY  20          HA1       GLY  20  -7.239  -6.843  10.663
  145    H    GLY  21           HN       GLY  21  -5.033  -5.277   8.354
  146   1HA   GLY  21          HA2       GLY  21  -3.486  -4.292  10.657
  147   2HA   GLY  21          HA1       GLY  21  -2.718  -4.901   9.198
  148    H    SER  22           HN       SER  22  -3.441  -2.199  10.778
  149    HA   SER  22           HA       SER  22  -4.620  -0.338   9.236
  150   1HB   SER  22          HB2       SER  22  -2.030   0.643  10.199
  151   2HB   SER  22          HB1       SER  22  -3.663   1.175  10.600
  152    HG   SER  22           HG       SER  22  -3.647  -0.069  12.302
  153    H    ARG  23           HN       ARG  23  -3.938   1.215   7.693
  154    HA   ARG  23           HA       ARG  23  -2.646   0.112   5.465
  155   1HB   ARG  23          HB2       ARG  23  -3.971   2.587   6.171
  156   2HB   ARG  23          HB1       ARG  23  -2.571   2.888   5.156
  157   1HG   ARG  23          HG2       ARG  23  -4.647   2.627   3.870
  158   2HG   ARG  23          HG1       ARG  23  -3.435   1.416   3.453
  159   1HD   ARG  23          HD2       ARG  23  -5.443   0.218   3.611
  160   2HD   ARG  23          HD1       ARG  23  -4.610  -0.097   5.133
  161    HE   ARG  23           HE       ARG  23  -6.358   0.879   6.211
  162   1HH1  ARG  23          HH11      ARG  23  -6.316   2.059   2.927
  163   2HH1  ARG  23          HH12      ARG  23  -7.777   2.971   3.103
  164   1HH2  ARG  23          HH21      ARG  23  -8.281   2.078   6.445
  165   2HH2  ARG  23          HH22      ARG  23  -8.893   2.982   5.101
  166    H    GLU  24           HN       GLU  24  -1.557   2.298   7.970
  167    HA   GLU  24           HA       GLU  24   0.976   2.845   6.802
  168   1HB   GLU  24          HB2       GLU  24   0.525   3.062   9.747
  169   2HB   GLU  24          HB1       GLU  24   1.398   4.142   8.669
  170   1HG   GLU  24          HG2       GLU  24  -0.914   4.633   7.648
  171   2HG   GLU  24          HG1       GLU  24  -1.547   3.915   9.128
  172    H    ARG  25           HN       ARG  25  -0.179   0.424   9.081
  173    HA   ARG  25           HA       ARG  25   2.256  -0.495  10.055
  174   1HB   ARG  25          HB2       ARG  25   0.077  -1.225  10.933
  175   2HB   ARG  25          HB1       ARG  25  -0.227  -2.109   9.445
  176   1HG   ARG  25          HG2       ARG  25   0.471  -3.661  11.115
  177   2HG   ARG  25          HG1       ARG  25   1.770  -3.503   9.929
  178   1HD   ARG  25          HD2       ARG  25   2.832  -3.459  12.029
  179   2HD   ARG  25          HD1       ARG  25   2.787  -1.780  11.493
  180    HE   ARG  25           HE       ARG  25   1.408  -1.288  13.253
  181   1HH1  ARG  25          HH11      ARG  25   1.524  -4.752  12.841
  182   2HH1  ARG  25          HH12      ARG  25   0.663  -5.080  14.306
  183   1HH2  ARG  25          HH21      ARG  25   0.276  -1.719  15.181
  184   2HH2  ARG  25          HH22      ARG  25  -0.045  -3.359  15.635
  185    H    CYS  26           HN       CYS  26   0.462  -1.561   7.189
  186    HA   CYS  26           HA       CYS  26   2.468  -3.415   6.370
  187   1HB   CYS  26          HB2       CYS  26   0.804  -2.428   4.186
  188   2HB   CYS  26          HB1       CYS  26   1.002  -4.061   4.798
  189    H    ALA  27           HN       ALA  27   1.709  -0.069   5.595
  190    HA   ALA  27           HA       ALA  27   3.411   0.320   3.436
  191   1HB   ALA  27          HB1       ALA  27   1.727   1.919   4.787
  192   2HB   ALA  27          HB2       ALA  27   2.948   2.527   3.668
  193   3HB   ALA  27          HB3       ALA  27   3.266   2.523   5.403
  194    H    SER  28           HN       SER  28   4.099   0.655   6.909
  195    HA   SER  28           HA       SER  28   6.850   1.267   6.528
  196   1HB   SER  28          HB2       SER  28   7.042   0.842   8.969
  197   2HB   SER  28          HB1       SER  28   5.709   1.931   8.581
  198    HG   SER  28           HG       SER  28   5.633  -0.753   9.414
  199    H    LEU  29           HN       LEU  29   4.985  -1.626   6.644
  200    HA   LEU  29           HA       LEU  29   7.050  -3.448   7.331
  201   1HB   LEU  29          HB2       LEU  29   4.353  -3.611   7.099
  202   2HB   LEU  29          HB1       LEU  29   4.848  -4.407   5.618
  203    HG   LEU  29           HG       LEU  29   4.447  -5.960   7.519
  204   1HD1  LEU  29          HD11      LEU  29   6.833  -7.026   7.309
  205   2HD1  LEU  29          HD12      LEU  29   7.048  -5.778   6.082
  206   3HD1  LEU  29          HD13      LEU  29   5.748  -6.958   5.921
  207   1HD2  LEU  29          HD21      LEU  29   7.027  -5.050   8.712
  208   2HD2  LEU  29          HD22      LEU  29   5.709  -5.966   9.444
  209   3HD2  LEU  29          HD23      LEU  29   5.524  -4.237   9.150
  210    H    SER  30           HN       SER  30   5.461  -2.827   4.187
  211    HA   SER  30           HA       SER  30   7.694  -4.110   2.834
  212   1HB   SER  30          HB2       SER  30   4.966  -4.004   2.317
  213   2HB   SER  30          HB1       SER  30   5.676  -2.966   1.082
  214    HG   SER  30           HG       SER  30   5.509  -5.380   0.728
  215    H    GLY  31           HN       GLY  31   6.147  -0.941   3.033
  216   1HA   GLY  31          HA2       GLY  31   7.631   1.004   2.993
  217   2HA   GLY  31          HA1       GLY  31   8.548   0.190   1.734
  218    H    CYS  32           HN       CYS  32   5.079   0.072   1.690
  219    HA   CYS  32           HA       CYS  32   4.993   1.300  -0.886
  220   1HB   CYS  32          HB2       CYS  32   2.848   0.335   1.008
  221   2HB   CYS  32          HB1       CYS  32   2.502   1.008  -0.576
  222    H    LYS  33           HN       LYS  33   2.907   2.878  -1.081
  223    HA   LYS  33           HA       LYS  33   3.321   5.052   0.858
  224   1HB   LYS  33          HB2       LYS  33   4.417   5.415  -1.402
  225   2HB   LYS  33          HB1       LYS  33   2.797   5.470  -2.083
  226   1HG   LYS  33          HG2       LYS  33   3.814   7.697  -1.625
  227   2HG   LYS  33          HG1       LYS  33   2.253   7.427  -0.848
  228   1HD   LYS  33          HD2       LYS  33   3.919   8.523   0.630
  229   2HD   LYS  33          HD1       LYS  33   3.322   6.989   1.264
  230   1HE   LYS  33          HE2       LYS  33   5.370   6.116   1.286
  231   2HE   LYS  33          HE1       LYS  33   5.660   6.596  -0.384
  232   1HZ   LYS  33          HZ1       LYS  33   6.365   8.746   0.338
  233   2HZ   LYS  33          HZ2       LYS  33   7.225   7.591   1.224
  234   3HZ   LYS  33          HZ3       LYS  33   5.936   8.418   1.942
  235    H    ILE  34           HN       ILE  34   1.528   6.160   1.524
  236    HA   ILE  34           HA       ILE  34  -1.010   4.882   1.009
  237    HB   ILE  34           HB       ILE  34  -0.124   5.807   3.273
  238   1HG1  ILE  34          HG12      ILE  34  -2.497   6.296   3.972
  239   2HG1  ILE  34          HG11      ILE  34  -2.946   6.183   2.272
  240   1HG2  ILE  34          HG21      ILE  34  -1.481   8.298   2.269
  241   2HG2  ILE  34          HG22      ILE  34   0.268   8.101   2.349
  242   3HG2  ILE  34          HG23      ILE  34  -0.692   8.051   3.826
  243   1HD1  ILE  34          HD11      ILE  34  -2.301   3.888   2.187
  244   2HD1  ILE  34          HD12      ILE  34  -3.352   4.116   3.584
  245   3HD1  ILE  34          HD13      ILE  34  -1.608   3.973   3.807
  246    H    ILE  35           HN       ILE  35  -2.700   5.678  -0.137
  247    HA   ILE  35           HA       ILE  35  -2.267   7.508  -2.193
  248    HB   ILE  35           HB       ILE  35  -5.027   7.098  -1.100
  249   1HG1  ILE  35          HG12      ILE  35  -4.164   4.865  -1.034
  250   2HG1  ILE  35          HG11      ILE  35  -5.118   4.999  -2.506
  251   1HG2  ILE  35          HG21      ILE  35  -5.338   8.341  -2.943
  252   2HG2  ILE  35          HG22      ILE  35  -5.167   6.798  -3.778
  253   3HG2  ILE  35          HG23      ILE  35  -3.785   7.885  -3.642
  254   1HD1  ILE  35          HD11      ILE  35  -2.261   4.498  -2.151
  255   2HD1  ILE  35          HD12      ILE  35  -2.652   5.669  -3.411
  256   3HD1  ILE  35          HD13      ILE  35  -3.344   4.048  -3.469
  257    H    SER  36           HN       SER  36  -3.361   9.570  -2.569
  258    HA   SER  36           HA       SER  36  -4.260  11.107  -0.312
  259   1HB   SER  36          HB2       SER  36  -1.660  11.092  -0.286
  260   2HB   SER  36          HB1       SER  36  -1.801  12.187  -1.661
  261    HG   SER  36           HG       SER  36  -1.679  13.244   0.412
  262    H    ALA  37           HN       ALA  37  -4.970  10.292  -3.146
  263    HA   ALA  37           HA       ALA  37  -6.455  12.516  -3.880
  264   1HB   ALA  37          HB1       ALA  37  -3.807  13.002  -4.465
  265   2HB   ALA  37          HB2       ALA  37  -5.195  13.826  -5.178
  266   3HB   ALA  37          HB3       ALA  37  -4.465  12.450  -6.005
  267    H    SER  38           HN       SER  38  -6.614   9.636  -3.769
  268    HA   SER  38           HA       SER  38  -7.677   7.970  -4.897
  269   1HB   SER  38          HB2       SER  38  -8.439  10.346  -6.310
  270   2HB   SER  38          HB1       SER  38  -8.173   9.051  -7.477
  271    HG   SER  38           HG       SER  38 -10.159   9.357  -5.620
  272    H    THR  39           HN       THR  39  -5.873   9.764  -7.408
  273    HA   THR  39           HA       THR  39  -5.012   7.489  -8.787
  274    HB   THR  39           HB       THR  39  -4.791   9.394 -10.059
  275    HG1  THR  39           HG1      THR  39  -2.149   9.438  -9.116
  276   1HG2  THR  39          HG21      THR  39  -4.895  11.362  -9.045
  277   2HG2  THR  39          HG22      THR  39  -3.141  11.258  -8.889
  278   3HG2  THR  39          HG23      THR  39  -4.177  10.731  -7.563
  279    H    CYS  40           HN       CYS  40  -2.632   9.589  -7.182
  280    HA   CYS  40           HA       CYS  40  -1.673   7.813  -5.290
  281   1HB   CYS  40          HB2       CYS  40  -0.878   7.131  -8.006
  282   2HB   CYS  40          HB1       CYS  40   0.513   7.420  -6.968
  283    HA   PRO  41           HA       PRO  41   0.496  11.540  -4.309
  284   1HB   PRO  41          HB2       PRO  41   2.471  10.447  -2.719
  285   2HB   PRO  41          HB1       PRO  41   0.838  10.836  -2.171
  286   1HG   PRO  41          HG2       PRO  41   1.982   8.206  -3.005
  287   2HG   PRO  41          HG1       PRO  41   0.852   8.574  -1.691
  288   1HD   PRO  41          HD2       PRO  41   0.025   7.500  -4.013
  289   2HD   PRO  41          HD1       PRO  41  -0.969   8.662  -3.111
  290    H    SER  42           HN       SER  42   3.046   9.066  -4.355
  291    HA   SER  42           HA       SER  42   4.832  10.761  -5.772
  292   1HB   SER  42          HB2       SER  42   4.903   8.019  -4.658
  293   2HB   SER  42          HB1       SER  42   5.999   8.329  -6.005
  294    HG   SER  42           HG       SER  42   6.854  10.074  -4.824
  295    H    ASP  43           HN       ASP  43   4.210   7.449  -6.850
  296    HA   ASP  43           HA       ASP  43   2.843   8.035  -9.217
  297   1HB   ASP  43          HB2       ASP  43   4.955   9.244  -9.767
  298   2HB   ASP  43          HB1       ASP  43   5.821   7.717  -9.640
  299    H    TYR  44           HN       TYR  44   2.865   6.029  -7.196
  300    HA   TYR  44           HA       TYR  44   3.727   3.650  -8.681
  301   1HB   TYR  44          HB2       TYR  44   2.787   3.453  -5.860
  302   2HB   TYR  44          HB1       TYR  44   4.018   2.526  -6.698
  303    HD1  TYR  44           HD1      TYR  44   3.580   4.712  -4.116
  304    HD2  TYR  44           HD2      TYR  44   6.048   4.201  -7.542
  305    HE1  TYR  44           HE1      TYR  44   5.324   6.080  -3.053
  306    HE2  TYR  44           HE2      TYR  44   7.801   5.567  -6.489
  307    HH   TYR  44           HH       TYR  44   8.487   6.209  -4.162
  308    HA   PRO  45           HA       PRO  45  -0.909   3.756  -9.100
  309   1HB   PRO  45          HB2       PRO  45  -0.939   2.960 -11.700
  310   2HB   PRO  45          HB1       PRO  45  -0.793   4.653 -11.212
  311   1HG   PRO  45          HG2       PRO  45   1.345   2.733 -12.050
  312   2HG   PRO  45          HG1       PRO  45   1.127   4.433 -12.504
  313   1HD   PRO  45          HD2       PRO  45   2.898   3.660 -10.615
  314   2HD   PRO  45          HD1       PRO  45   2.035   5.209 -10.530
  315    H    LYS  46           HN       LYS  46  -0.016   1.831  -7.611
  316    HA   LYS  46           HA       LYS  46  -1.329  -0.507  -8.534
  317   1HB   LYS  46          HB2       LYS  46   1.314  -0.317  -9.373
  318   2HB   LYS  46          HB1       LYS  46   1.390  -1.363  -7.962
  319   1HG   LYS  46          HG2       LYS  46   1.135  -2.687  -9.959
  320   2HG   LYS  46          HG1       LYS  46  -0.318  -2.815  -8.967
  321   1HD   LYS  46          HD2       LYS  46  -1.473  -1.237 -10.387
  322   2HD   LYS  46          HD1       LYS  46  -0.006  -0.963 -11.328
  323   1HE   LYS  46          HE2       LYS  46  -1.417  -3.616 -11.083
  324   2HE   LYS  46          HE1       LYS  46  -1.623  -2.492 -12.427
  325   1HZ   LYS  46          HZ1       LYS  46   0.015  -3.734 -13.308
  326   2HZ   LYS  46          HZ2       LYS  46   0.598  -4.258 -11.810
  327   3HZ   LYS  46          HZ3       LYS  46   1.019  -2.727 -12.391
  Start of MODEL    9
    1   1H    LYS   1          HT1       LYS   1  -6.534   3.670  -6.037
    2   2H    LYS   1          HT2       LYS   1  -5.752   5.080  -6.622
    3   3H    LYS   1          HT3       LYS   1  -7.359   5.173  -6.028
    4    HA   LYS   1           HA       LYS   1  -5.740   6.039  -4.478
    5   1HB   LYS   1          HB2       LYS   1  -6.552   4.665  -2.554
    6   2HB   LYS   1          HB1       LYS   1  -7.831   5.180  -3.642
    7   1HG   LYS   1          HG2       LYS   1  -8.167   2.880  -2.952
    8   2HG   LYS   1          HG1       LYS   1  -7.836   2.959  -4.684
    9   1HD   LYS   1          HD2       LYS   1  -5.734   2.034  -4.457
   10   2HD   LYS   1          HD1       LYS   1  -5.581   2.545  -2.777
   11   1HE   LYS   1          HE2       LYS   1  -6.364   0.615  -2.039
   12   2HE   LYS   1          HE1       LYS   1  -7.772   0.713  -3.096
   13   1HZ   LYS   1          HZ1       LYS   1  -6.379  -0.160  -4.909
   14   2HZ   LYS   1          HZ2       LYS   1  -6.493  -1.244  -3.616
   15   3HZ   LYS   1          HZ3       LYS   1  -5.088  -0.329  -3.830
   16    H    SER   2           HN       SER   2  -4.692   4.770  -2.395
   17    HA   SER   2           HA       SER   2  -2.750   3.908  -1.634
   18   1HB   SER   2          HB2       SER   2  -2.284   1.574  -2.358
   19   2HB   SER   2          HB1       SER   2  -3.954   1.840  -1.870
   20    HG   SER   2           HG       SER   2  -3.199   2.083  -4.571
   21    H    CYS   3           HN       CYS   3  -0.512   3.110  -2.195
   22    HA   CYS   3           HA       CYS   3   0.456   3.409  -4.850
   23   1HB   CYS   3          HB2       CYS   3  -0.069   5.817  -3.950
   24   2HB   CYS   3          HB1       CYS   3   1.465   5.618  -3.111
   25    H    CYS   4           HN       CYS   4   1.607   1.528  -4.490
   26    HA   CYS   4           HA       CYS   4   3.837   1.726  -2.558
   27   1HB   CYS   4          HB2       CYS   4   1.947  -0.239  -2.583
   28   2HB   CYS   4          HB1       CYS   4   3.177  -0.952  -3.612
   29    HA   PRO   5           HA       PRO   5   6.836   1.743  -5.756
   30   1HB   PRO   5          HB2       PRO   5   7.956  -0.734  -4.513
   31   2HB   PRO   5          HB1       PRO   5   8.787   0.742  -5.022
   32   1HG   PRO   5          HG2       PRO   5   8.278   0.338  -2.457
   33   2HG   PRO   5          HG1       PRO   5   8.051   1.948  -3.167
   34   1HD   PRO   5          HD2       PRO   5   6.018  -0.096  -2.413
   35   2HD   PRO   5          HD1       PRO   5   5.928   1.672  -2.297
   36    H    ASN   6           HN       ASN   6   5.247  -1.357  -5.114
   37    HA   ASN   6           HA       ASN   6   4.581  -1.783  -7.791
   38   1HB   ASN   6          HB2       ASN   6   6.154  -3.835  -8.118
   39   2HB   ASN   6          HB1       ASN   6   6.765  -2.218  -8.457
   40   1HD2  ASN   6          HD21      ASN   6   8.843  -3.305  -8.178
   41   2HD2  ASN   6          HD22      ASN   6   9.494  -3.452  -6.585
   42    H    THR   7           HN       THR   7   4.256  -4.346  -8.151
   43    HA   THR   7           HA       THR   7   2.174  -5.117  -6.513
   44    HB   THR   7           HB       THR   7   2.265  -7.255  -7.578
   45    HG1  THR   7           HG1      THR   7   4.116  -7.970  -8.644
   46   1HG2  THR   7          HG21      THR   7   2.036  -6.665  -9.743
   47   2HG2  THR   7          HG22      THR   7   3.535  -5.737  -9.767
   48   3HG2  THR   7          HG23      THR   7   2.081  -5.046  -9.047
   49    H    THR   8           HN       THR   8   5.603  -5.962  -6.264
   50    HA   THR   8           HA       THR   8   5.525  -7.901  -4.312
   51    HB   THR   8           HB       THR   8   7.736  -6.615  -3.528
   52    HG1  THR   8           HG1      THR   8   7.075  -4.807  -4.936
   53   1HG2  THR   8          HG21      THR   8   7.645  -8.799  -4.704
   54   2HG2  THR   8          HG22      THR   8   9.007  -7.781  -5.172
   55   3HG2  THR   8          HG23      THR   8   7.605  -7.920  -6.232
   56    H    GLY   9           HN       GLY   9   5.007  -4.465  -4.011
   57   1HA   GLY   9          HA2       GLY   9   5.026  -4.543  -1.106
   58   2HA   GLY   9          HA1       GLY   9   4.696  -3.139  -2.115
   59    H    ARG  10           HN       ARG  10   2.698  -4.167  -3.743
   60    HA   ARG  10           HA       ARG  10   0.377  -3.689  -2.326
   61   1HB   ARG  10          HB2       ARG  10   0.987  -5.087  -4.894
   62   2HB   ARG  10          HB1       ARG  10  -0.627  -5.270  -4.225
   63   1HG   ARG  10          HG2       ARG  10   0.677  -2.617  -4.780
   64   2HG   ARG  10          HG1       ARG  10  -0.404  -3.451  -5.897
   65   1HD   ARG  10          HD2       ARG  10  -1.578  -3.293  -3.272
   66   2HD   ARG  10          HD1       ARG  10  -1.097  -1.702  -3.838
   67    HE   ARG  10           HE       ARG  10  -2.404  -2.739  -5.958
   68   1HH1  ARG  10          HH11      ARG  10  -3.220  -2.255  -2.605
   69   2HH1  ARG  10          HH12      ARG  10  -4.921  -2.148  -2.905
   70   1HH2  ARG  10          HH21      ARG  10  -4.636  -2.588  -6.362
   71   2HH2  ARG  10          HH22      ARG  10  -5.727  -2.334  -5.042
   72    H    ASN  11           HN       ASN  11   2.150  -6.674  -2.783
   73    HA   ASN  11           HA       ASN  11   0.247  -8.491  -1.838
   74   1HB   ASN  11          HB2       ASN  11   3.241  -8.486  -2.038
   75   2HB   ASN  11          HB1       ASN  11   2.405  -9.818  -1.260
   76   1HD2  ASN  11          HD21      ASN  11   3.788  -8.983  -4.015
   77   2HD2  ASN  11          HD22      ASN  11   2.838  -9.877  -5.149
   78    H    ILE  12           HN       ILE  12   2.952  -6.938  -0.076
   79    HA   ILE  12           HA       ILE  12   2.278  -8.082   2.403
   80    HB   ILE  12           HB       ILE  12   3.812  -5.552   1.802
   81   1HG1  ILE  12          HG12      ILE  12   5.627  -7.287   2.762
   82   2HG1  ILE  12          HG11      ILE  12   4.489  -8.432   2.056
   83   1HG2  ILE  12          HG21      ILE  12   2.986  -6.755   4.361
   84   2HG2  ILE  12          HG22      ILE  12   3.421  -5.090   3.975
   85   3HG2  ILE  12          HG23      ILE  12   4.684  -6.290   4.247
   86   1HD1  ILE  12          HD11      ILE  12   5.361  -8.064   0.067
   87   2HD1  ILE  12          HD12      ILE  12   6.490  -6.908   0.773
   88   3HD1  ILE  12          HD13      ILE  12   4.922  -6.360   0.178
   89    H    TYR  13           HN       TYR  13   1.470  -4.889   1.052
   90    HA   TYR  13           HA       TYR  13   0.025  -4.013   3.291
   91   1HB   TYR  13          HB2       TYR  13   0.871  -2.822   1.067
   92   2HB   TYR  13          HB1       TYR  13  -0.782  -3.143   0.567
   93    HD1  TYR  13           HD1      TYR  13  -2.670  -2.208   1.975
   94    HD2  TYR  13           HD2      TYR  13   1.386  -1.058   2.528
   95    HE1  TYR  13           HE1      TYR  13  -3.411  -0.210   3.204
   96    HE2  TYR  13           HE2      TYR  13   0.659   0.942   3.757
   97    HH   TYR  13           HH       TYR  13  -1.176   1.830   4.910
   98    H    ASN  14           HN       ASN  14  -0.963  -5.749   0.371
   99    HA   ASN  14           HA       ASN  14  -3.724  -5.747   0.903
  100   1HB   ASN  14          HB2       ASN  14  -1.907  -7.312  -0.881
  101   2HB   ASN  14          HB1       ASN  14  -3.567  -7.833  -0.671
  102   1HD2  ASN  14          HD21      ASN  14  -2.045  -4.633  -0.953
  103   2HD2  ASN  14          HD22      ASN  14  -3.024  -4.103  -2.271
  104    H    THR  15           HN       THR  15  -1.269  -8.332   1.381
  105    HA   THR  15           HA       THR  15  -3.093 -10.087   2.655
  106    HB   THR  15           HB       THR  15  -0.193 -10.193   3.330
  107    HG1  THR  15           HG1      THR  15   0.239  -9.981   1.280
  108   1HG2  THR  15          HG21      THR  15  -2.082 -12.332   2.398
  109   2HG2  THR  15          HG22      THR  15  -1.725 -11.965   4.086
  110   3HG2  THR  15          HG23      THR  15  -0.447 -12.553   3.020
  111    H    CYS  16           HN       CYS  16  -0.883  -7.618   3.846
  112    HA   CYS  16           HA       CYS  16  -0.988  -8.098   6.571
  113   1HB   CYS  16          HB2       CYS  16   0.522  -6.452   5.891
  114   2HB   CYS  16          HB1       CYS  16  -0.669  -5.629   4.900
  115    H    ARG  17           HN       ARG  17  -3.039  -5.836   4.710
  116    HA   ARG  17           HA       ARG  17  -4.834  -5.286   6.801
  117   1HB   ARG  17          HB2       ARG  17  -4.710  -4.834   3.917
  118   2HB   ARG  17          HB1       ARG  17  -6.353  -5.097   4.483
  119   1HG   ARG  17          HG2       ARG  17  -4.722  -3.224   6.071
  120   2HG   ARG  17          HG1       ARG  17  -5.158  -2.700   4.444
  121   1HD   ARG  17          HD2       ARG  17  -7.332  -3.899   6.030
  122   2HD   ARG  17          HD1       ARG  17  -6.723  -2.351   6.617
  123    HE   ARG  17           HE       ARG  17  -7.261  -2.330   3.808
  124   1HH1  ARG  17          HH11      ARG  17  -8.721  -2.024   6.962
  125   2HH1  ARG  17          HH12      ARG  17 -10.050  -1.071   6.392
  126   1HH2  ARG  17          HH21      ARG  17  -9.008  -1.077   3.056
  127   2HH2  ARG  17          HH22      ARG  17 -10.214  -0.534   4.174
  128    H    LEU  18           HN       LEU  18  -4.752  -7.780   4.340
  129    HA   LEU  18           HA       LEU  18  -7.254  -8.940   4.774
  130   1HB   LEU  18          HB2       LEU  18  -4.782  -9.581   3.398
  131   2HB   LEU  18          HB1       LEU  18  -5.541 -11.017   4.052
  132    HG   LEU  18           HG       LEU  18  -6.793  -9.036   2.155
  133   1HD1  LEU  18          HD11      LEU  18  -5.983 -11.911   1.754
  134   2HD1  LEU  18          HD12      LEU  18  -5.117 -10.506   1.133
  135   3HD1  LEU  18          HD13      LEU  18  -6.745 -10.863   0.558
  136   1HD2  LEU  18          HD21      LEU  18  -7.920 -11.242   3.781
  137   2HD2  LEU  18          HD22      LEU  18  -8.490 -11.084   2.119
  138   3HD2  LEU  18          HD23      LEU  18  -8.662  -9.735   3.242
  139    H    GLY  19           HN       GLY  19  -4.379  -9.026   6.653
  140   1HA   GLY  19          HA2       GLY  19  -5.419 -11.273   8.232
  141   2HA   GLY  19          HA1       GLY  19  -3.749 -10.734   8.227
  142    H    GLY  20           HN       GLY  20  -6.244  -8.340   8.321
  143   1HA   GLY  20          HA2       GLY  20  -6.966  -6.930   9.984
  144   2HA   GLY  20          HA1       GLY  20  -6.551  -8.192  11.134
  145    H    GLY  21           HN       GLY  21  -4.803  -6.000   8.937
  146   1HA   GLY  21          HA2       GLY  21  -3.147  -5.181  11.224
  147   2HA   GLY  21          HA1       GLY  21  -2.402  -5.642   9.701
  148    H    SER  22           HN       SER  22  -3.185  -3.091  11.488
  149    HA   SER  22           HA       SER  22  -4.537  -1.204  10.119
  150   1HB   SER  22          HB2       SER  22  -1.946  -0.179  11.068
  151   2HB   SER  22          HB1       SER  22  -3.584   0.288  11.525
  152    HG   SER  22           HG       SER  22  -3.575  -1.147  13.099
  153    H    ARG  23           HN       ARG  23  -3.952   0.520   8.673
  154    HA   ARG  23           HA       ARG  23  -2.689  -0.395   6.336
  155   1HB   ARG  23          HB2       ARG  23  -4.109   1.973   7.226
  156   2HB   ARG  23          HB1       ARG  23  -2.786   2.375   6.145
  157   1HG   ARG  23          HG2       ARG  23  -4.052   1.828   4.416
  158   2HG   ARG  23          HG1       ARG  23  -4.137   0.170   5.015
  159   1HD   ARG  23          HD2       ARG  23  -6.216   0.441   5.854
  160   2HD   ARG  23          HD1       ARG  23  -5.910   2.104   6.355
  161    HE   ARG  23           HE       ARG  23  -7.082   1.230   3.891
  162   1HH1  ARG  23          HH11      ARG  23  -5.242   3.779   5.407
  163   2HH1  ARG  23          HH12      ARG  23  -5.748   4.987   4.275
  164   1HH2  ARG  23          HH21      ARG  23  -7.748   2.817   2.400
  165   2HH2  ARG  23          HH22      ARG  23  -7.171   4.443   2.568
  166    H    GLU  24           HN       GLU  24  -1.619   1.608   8.983
  167    HA   GLU  24           HA       GLU  24   0.812   2.456   7.780
  168   1HB   GLU  24          HB2       GLU  24   0.513   2.289  10.746
  169   2HB   GLU  24          HB1       GLU  24   1.244   3.553   9.765
  170   1HG   GLU  24          HG2       GLU  24  -1.156   3.980   8.931
  171   2HG   GLU  24          HG1       GLU  24  -1.645   3.054  10.349
  172    H    ARG  25           HN       ARG  25  -0.067  -0.251   9.866
  173    HA   ARG  25           HA       ARG  25   2.465  -1.138  10.578
  174   1HB   ARG  25          HB2       ARG  25   0.382  -2.069  11.498
  175   2HB   ARG  25          HB1       ARG  25   0.029  -2.817   9.946
  176   1HG   ARG  25          HG2       ARG  25   2.642  -3.481  11.141
  177   2HG   ARG  25          HG1       ARG  25   1.216  -4.095  11.981
  178   1HD   ARG  25          HD2       ARG  25   0.427  -5.062   9.842
  179   2HD   ARG  25          HD1       ARG  25   1.925  -4.528   9.082
  180    HE   ARG  25           HE       ARG  25   2.988  -6.314  10.025
  181   1HH1  ARG  25          HH11      ARG  25  -0.018  -5.793  11.717
  182   2HH1  ARG  25          HH12      ARG  25   0.122  -7.234  12.667
  183   1HH2  ARG  25          HH21      ARG  25   3.176  -8.209  11.275
  184   2HH2  ARG  25          HH22      ARG  25   1.935  -8.605  12.418
  185    H    CYS  26           HN       CYS  26   0.566  -1.917   7.692
  186    HA   CYS  26           HA       CYS  26   2.554  -3.627   6.573
  187   1HB   CYS  26          HB2       CYS  26   0.791  -2.393   4.599
  188   2HB   CYS  26          HB1       CYS  26   1.035  -4.088   4.984
  189    H    ALA  27           HN       ALA  27   1.735  -0.224   6.248
  190    HA   ALA  27           HA       ALA  27   3.315   0.483   4.089
  191   1HB   ALA  27          HB1       ALA  27   3.415   2.739   5.114
  192   2HB   ALA  27          HB2       ALA  27   2.717   2.064   6.586
  193   3HB   ALA  27          HB3       ALA  27   1.789   2.057   5.088
  194    H    SER  28           HN       SER  28   4.229   0.327   7.526
  195    HA   SER  28           HA       SER  28   6.932   1.050   7.107
  196   1HB   SER  28          HB2       SER  28   5.787   1.199   9.310
  197   2HB   SER  28          HB1       SER  28   5.758  -0.561   9.386
  198    HG   SER  28           HG       SER  28   7.581  -0.100  10.428
  199    H    LEU  29           HN       LEU  29   5.164  -1.916   6.855
  200    HA   LEU  29           HA       LEU  29   7.364  -3.710   6.991
  201   1HB   LEU  29          HB2       LEU  29   4.682  -4.009   7.044
  202   2HB   LEU  29          HB1       LEU  29   4.996  -4.451   5.378
  203    HG   LEU  29           HG       LEU  29   4.913  -6.388   6.929
  204   1HD1  LEU  29          HD11      LEU  29   6.565  -5.963   4.812
  205   2HD1  LEU  29          HD12      LEU  29   6.366  -7.506   5.643
  206   3HD1  LEU  29          HD13      LEU  29   7.711  -6.446   6.064
  207   1HD2  LEU  29          HD21      LEU  29   7.599  -5.766   7.984
  208   2HD2  LEU  29          HD22      LEU  29   6.254  -6.626   8.732
  209   3HD2  LEU  29          HD23      LEU  29   6.253  -4.863   8.680
  210    H    SER  30           HN       SER  30   5.384  -2.713   4.192
  211    HA   SER  30           HA       SER  30   7.536  -3.525   2.406
  212   1HB   SER  30          HB2       SER  30   4.661  -3.341   2.217
  213   2HB   SER  30          HB1       SER  30   5.420  -2.476   0.882
  214    HG   SER  30           HG       SER  30   6.652  -4.402   0.495
  215    H    GLY  31           HN       GLY  31   5.493  -0.642   2.906
  216   1HA   GLY  31          HA2       GLY  31   6.725   1.503   3.128
  217   2HA   GLY  31          HA1       GLY  31   7.702   0.963   1.773
  218    H    CYS  32           HN       CYS  32   4.224   0.549   2.015
  219    HA   CYS  32           HA       CYS  32   3.814   1.756  -0.531
  220   1HB   CYS  32          HB2       CYS  32   1.810   0.885   1.559
  221   2HB   CYS  32          HB1       CYS  32   1.448   1.270  -0.115
  222    H    LYS  33           HN       LYS  33   1.762   3.270  -0.623
  223    HA   LYS  33           HA       LYS  33   1.821   5.332   1.419
  224   1HB   LYS  33          HB2       LYS  33   3.490   5.656  -0.673
  225   2HB   LYS  33          HB1       LYS  33   2.022   6.327  -1.368
  226   1HG   LYS  33          HG2       LYS  33   2.960   7.223   1.320
  227   2HG   LYS  33          HG1       LYS  33   3.677   7.885  -0.149
  228   1HD   LYS  33          HD2       LYS  33   1.993   9.358  -0.103
  229   2HD   LYS  33          HD1       LYS  33   0.990   8.025  -0.681
  230   1HE   LYS  33          HE2       LYS  33  -0.172   8.009   1.207
  231   2HE   LYS  33          HE1       LYS  33   1.295   7.874   2.172
  232   1HZ   LYS  33          HZ1       LYS  33   0.088   9.854   2.767
  233   2HZ   LYS  33          HZ2       LYS  33   0.084  10.391   1.163
  234   3HZ   LYS  33          HZ3       LYS  33   1.541  10.293   2.018
  235    H    ILE  34           HN       ILE  34  -0.178   6.111   1.753
  236    HA   ILE  34           HA       ILE  34  -2.301   5.211  -0.027
  237    HB   ILE  34           HB       ILE  34  -2.923   6.786   2.418
  238   1HG1  ILE  34          HG12      ILE  34  -1.188   5.367   3.298
  239   2HG1  ILE  34          HG11      ILE  34  -2.739   4.701   3.799
  240   1HG2  ILE  34          HG21      ILE  34  -4.885   6.104   1.538
  241   2HG2  ILE  34          HG22      ILE  34  -4.531   4.641   2.456
  242   3HG2  ILE  34          HG23      ILE  34  -4.165   4.710   0.733
  243   1HD1  ILE  34          HD11      ILE  34  -1.422   3.674   1.329
  244   2HD1  ILE  34          HD12      ILE  34  -2.544   2.869   2.425
  245   3HD1  ILE  34          HD13      ILE  34  -0.871   3.136   2.915
  246    H    ILE  35           HN       ILE  35  -1.736   6.700  -1.749
  247    HA   ILE  35           HA       ILE  35  -1.593   9.445  -1.576
  248    HB   ILE  35           HB       ILE  35  -2.652   9.365  -3.947
  249   1HG1  ILE  35          HG12      ILE  35  -1.813   6.663  -4.390
  250   2HG1  ILE  35          HG11      ILE  35  -3.053   6.675  -3.144
  251   1HG2  ILE  35          HG21      ILE  35  -0.027   8.435  -2.978
  252   2HG2  ILE  35          HG22      ILE  35  -0.434   9.778  -4.047
  253   3HG2  ILE  35          HG23      ILE  35  -0.399   8.130  -4.674
  254   1HD1  ILE  35          HD11      ILE  35  -3.385   8.083  -5.770
  255   2HD1  ILE  35          HD12      ILE  35  -4.622   7.681  -4.579
  256   3HD1  ILE  35          HD13      ILE  35  -3.848   6.400  -5.513
  257    H    SER  36           HN       SER  36  -4.538   7.593  -2.420
  258    HA   SER  36           HA       SER  36  -6.741   8.010  -2.048
  259   1HB   SER  36          HB2       SER  36  -7.379   9.031  -0.077
  260   2HB   SER  36          HB1       SER  36  -5.692   8.670   0.287
  261    HG   SER  36           HG       SER  36  -5.533  10.731   0.635
  262    H    ALA  37           HN       ALA  37  -4.864   9.748  -3.831
  263    HA   ALA  37           HA       ALA  37  -6.973  11.650  -4.575
  264   1HB   ALA  37          HB1       ALA  37  -5.189  12.825  -3.295
  265   2HB   ALA  37          HB2       ALA  37  -5.396  13.417  -4.943
  266   3HB   ALA  37          HB3       ALA  37  -4.042  12.356  -4.551
  267    H    SER  38           HN       SER  38  -5.757   8.991  -5.538
  268    HA   SER  38           HA       SER  38  -5.527   7.951  -7.540
  269   1HB   SER  38          HB2       SER  38  -6.901  10.416  -8.209
  270   2HB   SER  38          HB1       SER  38  -5.840   9.906  -9.521
  271    HG   SER  38           HG       SER  38  -6.867   7.843  -9.406
  272    H    THR  39           HN       THR  39  -4.290  11.255  -8.109
  273    HA   THR  39           HA       THR  39  -2.095  10.469  -9.654
  274    HB   THR  39           HB       THR  39  -1.906  12.900  -7.929
  275    HG1  THR  39           HG1      THR  39  -3.885  13.364  -8.477
  276   1HG2  THR  39          HG21      THR  39  -0.193  12.589  -9.595
  277   2HG2  THR  39          HG22      THR  39  -1.216  13.959 -10.028
  278   3HG2  THR  39          HG23      THR  39  -1.414  12.414 -10.855
  279    H    CYS  40           HN       CYS  40  -0.285   9.446  -9.136
  280    HA   CYS  40           HA       CYS  40   0.432   9.173  -6.316
  281   1HB   CYS  40          HB2       CYS  40   0.829   7.558  -8.753
  282   2HB   CYS  40          HB1       CYS  40   2.191   7.571  -7.639
  283    HA   PRO  41           HA       PRO  41   3.821  11.975  -6.407
  284   1HB   PRO  41          HB2       PRO  41   5.675  10.520  -4.951
  285   2HB   PRO  41          HB1       PRO  41   4.394  11.516  -4.256
  286   1HG   PRO  41          HG2       PRO  41   4.477   8.562  -4.690
  287   2HG   PRO  41          HG1       PRO  41   3.811   9.480  -3.327
  288   1HD   PRO  41          HD2       PRO  41   2.228   8.421  -5.218
  289   2HD   PRO  41          HD1       PRO  41   1.854   9.983  -4.460
  290    H    SER  42           HN       SER  42   5.452   8.813  -6.373
  291    HA   SER  42           HA       SER  42   7.347   9.640  -8.319
  292   1HB   SER  42          HB2       SER  42   7.024   7.447  -6.526
  293   2HB   SER  42          HB1       SER  42   7.330   6.798  -8.137
  294    HG   SER  42           HG       SER  42   8.989   8.216  -6.455
  295    H    ASP  43           HN       ASP  43   5.509   6.621  -8.686
  296    HA   ASP  43           HA       ASP  43   3.922   7.303 -10.845
  297   1HB   ASP  43          HB2       ASP  43   6.611   7.417 -11.602
  298   2HB   ASP  43          HB1       ASP  43   6.029   5.885 -12.248
  299    H    TYR  44           HN       TYR  44   3.921   5.489  -8.617
  300    HA   TYR  44           HA       TYR  44   3.565   2.960 -10.064
  301   1HB   TYR  44          HB2       TYR  44   3.917   1.932  -7.694
  302   2HB   TYR  44          HB1       TYR  44   5.311   2.403  -8.656
  303    HD1  TYR  44           HD1      TYR  44   3.226   3.291  -5.751
  304    HD2  TYR  44           HD2      TYR  44   6.749   4.187  -7.961
  305    HE1  TYR  44           HE1      TYR  44   4.023   4.696  -3.899
  306    HE2  TYR  44           HE2      TYR  44   7.556   5.593  -6.114
  307    HH   TYR  44           HH       TYR  44   6.104   5.583  -3.023
  308    HA   PRO  45           HA       PRO  45  -0.561   4.044  -8.425
  309   1HB   PRO  45          HB2       PRO  45  -1.972   3.274 -10.568
  310   2HB   PRO  45          HB1       PRO  45  -1.101   4.812 -10.540
  311   1HG   PRO  45          HG2       PRO  45  -0.326   2.218 -11.814
  312   2HG   PRO  45          HG1       PRO  45  -0.170   3.866 -12.447
  313   1HD   PRO  45          HD2       PRO  45   1.883   2.453 -11.285
  314   2HD   PRO  45          HD1       PRO  45   1.803   4.224 -11.349
  315    H    LYS  46           HN       LYS  46  -0.659   2.460  -6.847
  316    HA   LYS  46           HA       LYS  46  -1.092  -0.305  -7.651
  317   1HB   LYS  46          HB2       LYS  46  -0.423  -0.925  -5.551
  318   2HB   LYS  46          HB1       LYS  46   0.487   0.556  -5.762
  319   1HG   LYS  46          HG2       LYS  46  -1.253   1.762  -4.495
  320   2HG   LYS  46          HG1       LYS  46  -2.066   0.221  -4.213
  321   1HD   LYS  46          HD2       LYS  46   0.633  -0.131  -3.510
  322   2HD   LYS  46          HD1       LYS  46   0.122   1.391  -2.788
  323   1HE   LYS  46          HE2       LYS  46  -1.980  -0.400  -2.355
  324   2HE   LYS  46          HE1       LYS  46  -0.506  -1.312  -2.027
  325   1HZ   LYS  46          HZ1       LYS  46  -0.071  -0.107  -0.201
  326   2HZ   LYS  46          HZ2       LYS  46  -1.717   0.276  -0.248
  327   3HZ   LYS  46          HZ3       LYS  46  -0.580   1.350  -0.891
  Start of MODEL   10
    1   1H    LYS   1          HT1       LYS   1  -7.883   3.054  -0.869
    2   2H    LYS   1          HT2       LYS   1  -7.654   1.573  -0.032
    3   3H    LYS   1          HT3       LYS   1  -8.996   1.768  -1.084
    4    HA   LYS   1           HA       LYS   1  -7.517   0.506  -2.269
    5   1HB   LYS   1          HB2       LYS   1  -8.155   3.161  -2.992
    6   2HB   LYS   1          HB1       LYS   1  -6.495   2.900  -3.507
    7   1HG   LYS   1          HG2       LYS   1  -8.891   1.242  -4.262
    8   2HG   LYS   1          HG1       LYS   1  -8.004   2.357  -5.302
    9   1HD   LYS   1          HD2       LYS   1  -6.849  -0.124  -4.030
   10   2HD   LYS   1          HD1       LYS   1  -7.401  -0.003  -5.701
   11   1HE   LYS   1          HE2       LYS   1  -5.731   2.083  -5.651
   12   2HE   LYS   1          HE1       LYS   1  -4.967   1.086  -4.414
   13   1HZ   LYS   1          HZ1       LYS   1  -5.666   0.058  -7.106
   14   2HZ   LYS   1          HZ2       LYS   1  -4.671  -0.667  -5.947
   15   3HZ   LYS   1          HZ3       LYS   1  -4.157   0.733  -6.743
   16    H    SER   2           HN       SER   2  -5.760   3.421  -1.211
   17    HA   SER   2           HA       SER   2  -3.664   3.673  -0.343
   18   1HB   SER   2          HB2       SER   2  -2.584   1.923   0.682
   19   2HB   SER   2          HB1       SER   2  -4.190   1.211   0.534
   20    HG   SER   2           HG       SER   2  -1.935   0.279  -0.434
   21    H    CYS   3           HN       CYS   3  -1.353   3.456  -1.032
   22    HA   CYS   3           HA       CYS   3  -1.146   2.930  -3.920
   23   1HB   CYS   3          HB2       CYS   3  -1.292   5.349  -3.571
   24   2HB   CYS   3          HB1       CYS   3   0.037   5.282  -2.428
   25    H    CYS   4           HN       CYS   4   0.652   1.885  -4.595
   26    HA   CYS   4           HA       CYS   4   2.870   1.550  -2.711
   27   1HB   CYS   4          HB2       CYS   4   1.160  -0.414  -2.730
   28   2HB   CYS   4          HB1       CYS   4   1.893  -0.810  -4.281
   29    HA   PRO   5           HA       PRO   5   5.093   2.501  -6.397
   30   1HB   PRO   5          HB2       PRO   5   7.598   1.808  -5.595
   31   2HB   PRO   5          HB1       PRO   5   6.783   3.283  -5.068
   32   1HG   PRO   5          HG2       PRO   5   7.073   0.668  -3.646
   33   2HG   PRO   5          HG1       PRO   5   7.223   2.315  -3.004
   34   1HD   PRO   5          HD2       PRO   5   4.990   0.819  -2.677
   35   2HD   PRO   5          HD1       PRO   5   4.943   2.585  -2.819
   36    H    ASN   6           HN       ASN   6   5.049  -0.713  -5.042
   37    HA   ASN   6           HA       ASN   6   5.431  -1.811  -7.693
   38   1HB   ASN   6          HB2       ASN   6   7.339  -2.532  -5.460
   39   2HB   ASN   6          HB1       ASN   6   7.260  -3.325  -7.030
   40   1HD2  ASN   6          HD21      ASN   6   7.965  -2.214  -8.865
   41   2HD2  ASN   6          HD22      ASN   6   8.992  -0.830  -8.751
   42    H    THR   7           HN       THR   7   4.818  -4.006  -7.885
   43    HA   THR   7           HA       THR   7   2.614  -4.773  -6.370
   44    HB   THR   7           HB       THR   7   2.989  -5.634  -8.608
   45    HG1  THR   7           HG1      THR   7   1.755  -7.098  -7.709
   46   1HG2  THR   7          HG21      THR   7   4.663  -7.150  -9.225
   47   2HG2  THR   7          HG22      THR   7   5.168  -7.399  -7.554
   48   3HG2  THR   7          HG23      THR   7   5.496  -5.862  -8.355
   49    H    THR   8           HN       THR   8   6.022  -5.597  -6.024
   50    HA   THR   8           HA       THR   8   5.862  -7.695  -4.222
   51    HB   THR   8           HB       THR   8   8.059  -6.553  -3.293
   52    HG1  THR   8           HG1      THR   8   8.411  -4.712  -4.207
   53   1HG2  THR   8          HG21      THR   8   8.016  -8.568  -4.705
   54   2HG2  THR   8          HG22      THR   8   9.364  -7.493  -5.076
   55   3HG2  THR   8          HG23      THR   8   7.953  -7.535  -6.133
   56    H    GLY   9           HN       GLY   9   5.316  -4.290  -3.735
   57   1HA   GLY   9          HA2       GLY   9   5.231  -4.601  -0.832
   58   2HA   GLY   9          HA1       GLY   9   5.054  -3.093  -1.724
   59    H    ARG  10           HN       ARG  10   3.115  -3.959  -3.571
   60    HA   ARG  10           HA       ARG  10   0.734  -3.391  -2.295
   61   1HB   ARG  10          HB2       ARG  10   0.784  -3.225  -4.654
   62   2HB   ARG  10          HB1       ARG  10   1.356  -4.875  -4.841
   63   1HG   ARG  10          HG2       ARG  10  -0.745  -5.424  -5.281
   64   2HG   ARG  10          HG1       ARG  10  -1.081  -5.170  -3.569
   65   1HD   ARG  10          HD2       ARG  10  -2.638  -3.765  -4.440
   66   2HD   ARG  10          HD1       ARG  10  -1.271  -2.652  -4.374
   67    HE   ARG  10           HE       ARG  10  -1.202  -2.636  -6.661
   68   1HH1  ARG  10          HH11      ARG  10  -3.250  -5.255  -5.602
   69   2HH1  ARG  10          HH12      ARG  10  -3.844  -5.600  -7.191
   70   1HH2  ARG  10          HH21      ARG  10  -1.983  -3.087  -8.753
   71   2HH2  ARG  10          HH22      ARG  10  -3.125  -4.370  -8.981
   72    H    ASN  11           HN       ASN  11   2.321  -6.483  -2.839
   73    HA   ASN  11           HA       ASN  11   0.247  -8.177  -2.043
   74   1HB   ASN  11          HB2       ASN  11   3.177  -8.717  -1.597
   75   2HB   ASN  11          HB1       ASN  11   1.895  -9.867  -1.927
   76   1HD2  ASN  11          HD21      ASN  11   4.405  -9.492  -3.313
   77   2HD2  ASN  11          HD22      ASN  11   4.005  -9.140  -4.957
   78    H    ILE  12           HN       ILE  12   3.096  -7.174  -0.105
   79    HA   ILE  12           HA       ILE  12   2.162  -8.258   2.289
   80    HB   ILE  12           HB       ILE  12   3.983  -5.889   1.854
   81   1HG1  ILE  12          HG12      ILE  12   5.567  -7.834   2.801
   82   2HG1  ILE  12          HG11      ILE  12   4.337  -8.836   2.037
   83   1HG2  ILE  12          HG21      ILE  12   3.314  -7.375   4.388
   84   2HG2  ILE  12          HG22      ILE  12   3.105  -5.655   4.058
   85   3HG2  ILE  12          HG23      ILE  12   4.726  -6.334   4.207
   86   1HD1  ILE  12          HD11      ILE  12   5.327  -6.628   0.386
   87   2HD1  ILE  12          HD12      ILE  12   5.023  -8.315  -0.026
   88   3HD1  ILE  12          HD13      ILE  12   6.520  -7.862   0.787
   89    H    TYR  13           HN       TYR  13   1.687  -5.004   0.982
   90    HA   TYR  13           HA       TYR  13   0.306  -3.925   3.156
   91   1HB   TYR  13          HB2       TYR  13   1.212  -2.971   0.832
   92   2HB   TYR  13          HB1       TYR  13  -0.470  -3.178   0.391
   93    HD1  TYR  13           HD1      TYR  13   1.842  -1.436   2.668
   94    HD2  TYR  13           HD2      TYR  13  -2.144  -1.665   1.201
   95    HE1  TYR  13           HE1      TYR  13   1.343   0.735   3.703
   96    HE2  TYR  13           HE2      TYR  13  -2.654   0.507   2.233
   97    HH   TYR  13           HH       TYR  13  -0.237   2.574   3.451
   98    H    ASN  14           HN       ASN  14  -0.833  -5.603   0.259
   99    HA   ASN  14           HA       ASN  14  -3.575  -5.460   0.813
  100   1HB   ASN  14          HB2       ASN  14  -1.842  -7.076  -0.994
  101   2HB   ASN  14          HB1       ASN  14  -3.507  -7.578  -0.758
  102   1HD2  ASN  14          HD21      ASN  14  -1.849  -4.459  -1.132
  103   2HD2  ASN  14          HD22      ASN  14  -2.872  -3.874  -2.396
  104    H    THR  15           HN       THR  15  -1.369  -8.296   1.160
  105    HA   THR  15           HA       THR  15  -3.283  -9.869   2.482
  106    HB   THR  15           HB       THR  15  -1.481 -11.090   1.673
  107    HG1  THR  15           HG1      THR  15  -1.142 -12.232   3.391
  108   1HG2  THR  15          HG21      THR  15   0.844 -10.375   2.984
  109   2HG2  THR  15          HG22      THR  15   0.128  -8.838   2.499
  110   3HG2  THR  15          HG23      THR  15   0.454 -10.081   1.290
  111    H    CYS  16           HN       CYS  16  -0.841  -7.647   3.728
  112    HA   CYS  16           HA       CYS  16  -1.031  -8.097   6.438
  113   1HB   CYS  16          HB2       CYS  16   0.562  -6.506   5.757
  114   2HB   CYS  16          HB1       CYS  16  -0.608  -5.611   4.799
  115    H    ARG  17           HN       ARG  17  -2.961  -5.817   4.502
  116    HA   ARG  17           HA       ARG  17  -4.762  -5.098   6.527
  117   1HB   ARG  17          HB2       ARG  17  -4.569  -4.815   3.620
  118   2HB   ARG  17          HB1       ARG  17  -6.227  -4.913   4.195
  119   1HG   ARG  17          HG2       ARG  17  -4.432  -3.084   5.663
  120   2HG   ARG  17          HG1       ARG  17  -4.867  -2.621   4.016
  121   1HD   ARG  17          HD2       ARG  17  -6.539  -1.639   5.295
  122   2HD   ARG  17          HD1       ARG  17  -7.284  -3.141   4.747
  123    HE   ARG  17           HE       ARG  17  -6.005  -3.473   7.266
  124   1HH1  ARG  17          HH11      ARG  17  -8.878  -2.186   5.759
  125   2HH1  ARG  17          HH12      ARG  17  -9.856  -2.375   7.174
  126   1HH2  ARG  17          HH21      ARG  17  -7.290  -3.722   9.128
  127   2HH2  ARG  17          HH22      ARG  17  -8.955  -3.247   9.087
  128    H    LEU  18           HN       LEU  18  -4.700  -7.797   4.284
  129    HA   LEU  18           HA       LEU  18  -7.320  -8.712   4.641
  130   1HB   LEU  18          HB2       LEU  18  -6.674 -10.289   3.178
  131   2HB   LEU  18          HB1       LEU  18  -5.134  -9.464   3.144
  132    HG   LEU  18           HG       LEU  18  -4.446 -10.992   5.054
  133   1HD1  LEU  18          HD11      LEU  18  -7.143 -11.955   4.550
  134   2HD1  LEU  18          HD12      LEU  18  -6.081 -12.236   5.929
  135   3HD1  LEU  18          HD13      LEU  18  -5.936 -13.240   4.487
  136   1HD2  LEU  18          HD21      LEU  18  -4.537 -11.400   2.220
  137   2HD2  LEU  18          HD22      LEU  18  -4.638 -12.953   3.051
  138   3HD2  LEU  18          HD23      LEU  18  -3.288 -11.867   3.374
  139    H    GLY  19           HN       GLY  19  -4.578  -8.834   6.710
  140   1HA   GLY  19          HA2       GLY  19  -5.895 -10.831   8.415
  141   2HA   GLY  19          HA1       GLY  19  -4.192 -10.409   8.485
  142    H    GLY  20           HN       GLY  20  -6.486  -7.839   8.175
  143   1HA   GLY  20          HA2       GLY  20  -7.194  -6.224   9.648
  144   2HA   GLY  20          HA1       GLY  20  -6.999  -7.412  10.926
  145    H    GLY  21           HN       GLY  21  -4.862  -5.606   8.728
  146   1HA   GLY  21          HA2       GLY  21  -3.299  -4.780  11.079
  147   2HA   GLY  21          HA1       GLY  21  -2.517  -5.351   9.611
  148    H    SER  22           HN       SER  22  -3.178  -2.680  11.260
  149    HA   SER  22           HA       SER  22  -4.339  -0.771   9.749
  150   1HB   SER  22          HB2       SER  22  -1.749   0.160  10.765
  151   2HB   SER  22          HB1       SER  22  -3.381   0.701  11.161
  152    HG   SER  22           HG       SER  22  -1.883  -1.403  12.283
  153    H    ARG  23           HN       ARG  23  -3.598   0.811   8.241
  154    HA   ARG  23           HA       ARG  23  -2.240  -0.307   6.043
  155   1HB   ARG  23          HB2       ARG  23  -3.659   2.132   6.663
  156   2HB   ARG  23          HB1       ARG  23  -2.236   2.460   5.688
  157   1HG   ARG  23          HG2       ARG  23  -3.132   1.542   3.854
  158   2HG   ARG  23          HG1       ARG  23  -3.830   0.193   4.751
  159   1HD   ARG  23          HD2       ARG  23  -5.811   1.239   5.040
  160   2HD   ARG  23          HD1       ARG  23  -5.064   2.823   5.236
  161    HE   ARG  23           HE       ARG  23  -4.876   1.899   2.550
  162   1HH1  ARG  23          HH11      ARG  23  -7.063   3.348   4.851
  163   2HH1  ARG  23          HH12      ARG  23  -8.029   4.117   3.636
  164   1HH2  ARG  23          HH21      ARG  23  -6.145   2.910   0.953
  165   2HH2  ARG  23          HH22      ARG  23  -7.509   3.869   1.423
  166    H    GLU  24           HN       GLU  24  -1.239   1.721   8.676
  167    HA   GLU  24           HA       GLU  24   1.256   2.506   7.568
  168   1HB   GLU  24          HB2       GLU  24   0.845   2.351  10.521
  169   2HB   GLU  24          HB1       GLU  24   1.636   3.599   9.566
  170   1HG   GLU  24          HG2       GLU  24  -0.727   4.073   8.649
  171   2HG   GLU  24          HG1       GLU  24  -1.280   3.162  10.053
  172    H    ARG  25           HN       ARG  25   0.252  -0.152   9.686
  173    HA   ARG  25           HA       ARG  25   2.768  -1.091  10.411
  174   1HB   ARG  25          HB2       ARG  25   0.671  -1.942  11.373
  175   2HB   ARG  25          HB1       ARG  25   0.275  -2.709   9.842
  176   1HG   ARG  25          HG2       ARG  25   1.690  -4.431  10.180
  177   2HG   ARG  25          HG1       ARG  25   2.880  -3.432  11.017
  178   1HD   ARG  25          HD2       ARG  25   1.314  -3.365  12.971
  179   2HD   ARG  25          HD1       ARG  25   0.313  -4.549  12.132
  180    HE   ARG  25           HE       ARG  25   1.777  -6.161  12.797
  181   1HH1  ARG  25          HH11      ARG  25   3.422  -3.085  12.910
  182   2HH1  ARG  25          HH12      ARG  25   4.866  -3.742  13.604
  183   1HH2  ARG  25          HH21      ARG  25   3.676  -7.026  13.710
  184   2HH2  ARG  25          HH22      ARG  25   5.011  -5.978  14.057
  185    H    CYS  26           HN       CYS  26   0.797  -1.936   7.591
  186    HA   CYS  26           HA       CYS  26   2.762  -3.675   6.470
  187   1HB   CYS  26          HB2       CYS  26   0.958  -2.532   4.490
  188   2HB   CYS  26          HB1       CYS  26   1.183  -4.205   4.967
  189    H    ALA  27           HN       ALA  27   1.907  -0.287   6.067
  190    HA   ALA  27           HA       ALA  27   3.398   0.377   3.842
  191   1HB   ALA  27          HB1       ALA  27   1.851   1.850   5.258
  192   2HB   ALA  27          HB2       ALA  27   3.268   2.611   4.536
  193   3HB   ALA  27          HB3       ALA  27   3.276   2.176   6.244
  194    H    SER  28           HN       SER  28   4.467   0.182   7.225
  195    HA   SER  28           HA       SER  28   7.159   0.896   6.660
  196   1HB   SER  28          HB2       SER  28   7.616   0.080   8.957
  197   2HB   SER  28          HB1       SER  28   6.239   1.181   8.904
  198    HG   SER  28           HG       SER  28   4.935  -0.405   9.434
  199    H    LEU  29           HN       LEU  29   5.331  -2.042   6.581
  200    HA   LEU  29           HA       LEU  29   7.499  -3.874   6.661
  201   1HB   LEU  29          HB2       LEU  29   4.798  -4.093   6.820
  202   2HB   LEU  29          HB1       LEU  29   5.069  -4.649   5.181
  203    HG   LEU  29           HG       LEU  29   4.982  -6.474   6.866
  204   1HD1  LEU  29          HD11      LEU  29   7.532  -7.183   6.150
  205   2HD1  LEU  29          HD12      LEU  29   7.095  -6.003   4.916
  206   3HD1  LEU  29          HD13      LEU  29   6.084  -7.423   5.174
  207   1HD2  LEU  29          HD21      LEU  29   7.696  -5.662   7.799
  208   2HD2  LEU  29          HD22      LEU  29   6.505  -6.706   8.573
  209   3HD2  LEU  29          HD23      LEU  29   6.267  -4.959   8.556
  210    H    SER  30           HN       SER  30   5.427  -2.858   3.934
  211    HA   SER  30           HA       SER  30   7.483  -3.770   2.075
  212   1HB   SER  30          HB2       SER  30   5.548  -3.031   0.416
  213   2HB   SER  30          HB1       SER  30   5.483  -4.574   1.268
  214    HG   SER  30           HG       SER  30   4.060  -3.705   2.722
  215    H    GLY  31           HN       GLY  31   5.412  -0.888   2.485
  216   1HA   GLY  31          HA2       GLY  31   6.908   1.197   2.627
  217   2HA   GLY  31          HA1       GLY  31   7.460   0.661   1.050
  218    H    CYS  32           HN       CYS  32   4.278  -0.169   1.138
  219    HA   CYS  32           HA       CYS  32   3.544   1.945  -0.620
  220   1HB   CYS  32          HB2       CYS  32   1.391   0.293   0.571
  221   2HB   CYS  32          HB1       CYS  32   1.674   0.733  -1.099
  222    H    LYS  33           HN       LYS  33   1.973   3.550  -0.315
  223    HA   LYS  33           HA       LYS  33   1.139   4.096   2.437
  224   1HB   LYS  33          HB2       LYS  33   2.956   5.491   2.458
  225   2HB   LYS  33          HB1       LYS  33   2.942   5.718   0.722
  226   1HG   LYS  33          HG2       LYS  33   0.767   6.937   2.353
  227   2HG   LYS  33          HG1       LYS  33   2.364   7.680   2.346
  228   1HD   LYS  33          HD2       LYS  33   0.633   7.122  -0.062
  229   2HD   LYS  33          HD1       LYS  33   0.969   8.701   0.648
  230   1HE   LYS  33          HE2       LYS  33   2.774   8.885  -0.621
  231   2HE   LYS  33          HE1       LYS  33   3.454   7.444   0.129
  232   1HZ   LYS  33          HZ1       LYS  33   3.390   6.771  -2.023
  233   2HZ   LYS  33          HZ2       LYS  33   2.053   7.726  -2.420
  234   3HZ   LYS  33          HZ3       LYS  33   1.835   6.283  -1.566
  235    H    ILE  34           HN       ILE  34  -0.617   5.685   2.571
  236    HA   ILE  34           HA       ILE  34  -2.611   5.198   0.608
  237    HB   ILE  34           HB       ILE  34  -2.531   7.022   3.006
  238   1HG1  ILE  34          HG12      ILE  34  -4.082   5.430   3.958
  239   2HG1  ILE  34          HG11      ILE  34  -4.193   4.563   2.430
  240   1HG2  ILE  34          HG21      ILE  34  -4.547   6.860   0.833
  241   2HG2  ILE  34          HG22      ILE  34  -4.061   8.232   1.828
  242   3HG2  ILE  34          HG23      ILE  34  -5.132   6.999   2.493
  243   1HD1  ILE  34          HD11      ILE  34  -1.653   4.826   4.011
  244   2HD1  ILE  34          HD12      ILE  34  -1.964   3.773   2.630
  245   3HD1  ILE  34          HD13      ILE  34  -2.777   3.478   4.164
  246    H    ILE  35           HN       ILE  35  -3.316   6.386  -1.051
  247    HA   ILE  35           HA       ILE  35  -1.730   8.263  -2.319
  248    HB   ILE  35           HB       ILE  35  -4.125   8.998  -3.304
  249   1HG1  ILE  35          HG12      ILE  35  -5.043   7.258  -1.495
  250   2HG1  ILE  35          HG11      ILE  35  -5.827   7.499  -3.052
  251   1HG2  ILE  35          HG21      ILE  35  -2.181   8.016  -4.487
  252   2HG2  ILE  35          HG22      ILE  35  -3.743   7.462  -5.089
  253   3HG2  ILE  35          HG23      ILE  35  -2.779   6.417  -4.050
  254   1HD1  ILE  35          HD11      ILE  35  -5.115   5.477  -3.870
  255   2HD1  ILE  35          HD12      ILE  35  -5.356   5.103  -2.163
  256   3HD1  ILE  35          HD13      ILE  35  -3.731   5.399  -2.781
  257    H    SER  36           HN       SER  36  -4.951   9.204  -1.173
  258    HA   SER  36           HA       SER  36  -5.630  10.952   0.162
  259   1HB   SER  36          HB2       SER  36  -3.099  10.742   1.076
  260   2HB   SER  36          HB1       SER  36  -2.995  12.313   0.279
  261    HG   SER  36           HG       SER  36  -5.076  11.668   2.082
  262    H    ALA  37           HN       ALA  37  -5.596  10.841  -2.645
  263    HA   ALA  37           HA       ALA  37  -6.337  13.440  -3.328
  264   1HB   ALA  37          HB1       ALA  37  -4.045  14.092  -3.265
  265   2HB   ALA  37          HB2       ALA  37  -4.503  13.963  -4.963
  266   3HB   ALA  37          HB3       ALA  37  -3.557  12.682  -4.205
  267    H    SER  38           HN       SER  38  -4.440  11.039  -5.108
  268    HA   SER  38           HA       SER  38  -6.377   9.495  -6.214
  269   1HB   SER  38          HB2       SER  38  -6.444  12.175  -7.365
  270   2HB   SER  38          HB1       SER  38  -6.212  10.929  -8.590
  271    HG   SER  38           HG       SER  38  -8.333  10.871  -8.397
  272    H    THR  39           HN       THR  39  -3.911  11.520  -7.812
  273    HA   THR  39           HA       THR  39  -2.754   9.238  -9.117
  274    HB   THR  39           HB       THR  39  -2.734  11.350 -10.279
  275    HG1  THR  39           HG1      THR  39  -0.940  10.144 -10.748
  276   1HG2  THR  39          HG21      THR  39  -2.718  13.088  -8.789
  277   2HG2  THR  39          HG22      THR  39  -1.052  13.111  -9.364
  278   3HG2  THR  39          HG23      THR  39  -1.437  12.380  -7.806
  279    H    CYS  40           HN       CYS  40  -0.747   8.286  -8.726
  280    HA   CYS  40           HA       CYS  40   0.146   8.482  -5.974
  281   1HB   CYS  40          HB2       CYS  40   0.589   6.578  -8.232
  282   2HB   CYS  40          HB1       CYS  40   1.743   6.609  -6.905
  283    HA   PRO  41           HA       PRO  41   3.804  10.849  -6.218
  284   1HB   PRO  41          HB2       PRO  41   5.732   8.946  -5.459
  285   2HB   PRO  41          HB1       PRO  41   4.815   9.993  -4.383
  286   1HG   PRO  41          HG2       PRO  41   4.330   7.158  -5.151
  287   2HG   PRO  41          HG1       PRO  41   4.085   7.958  -3.588
  288   1HD   PRO  41          HD2       PRO  41   2.022   7.390  -5.166
  289   2HD   PRO  41          HD1       PRO  41   2.074   8.912  -4.255
  290    H    SER  42           HN       SER  42   6.470   9.482  -6.748
  291    HA   SER  42           HA       SER  42   6.986  10.188  -9.274
  292   1HB   SER  42          HB2       SER  42   8.846   8.616  -9.291
  293   2HB   SER  42          HB1       SER  42   8.669   9.325  -7.686
  294    HG   SER  42           HG       SER  42   8.961   6.948  -7.852
  295    H    ASP  43           HN       ASP  43   6.460   6.700  -8.637
  296    HA   ASP  43           HA       ASP  43   4.664   6.500 -10.884
  297   1HB   ASP  43          HB2       ASP  43   7.395   5.205 -11.008
  298   2HB   ASP  43          HB1       ASP  43   6.072   4.871 -12.121
  299    H    TYR  44           HN       TYR  44   3.830   5.904  -8.510
  300    HA   TYR  44           HA       TYR  44   4.300   3.081  -7.940
  301   1HB   TYR  44          HB2       TYR  44   2.636   5.120  -6.480
  302   2HB   TYR  44          HB1       TYR  44   2.865   3.471  -5.953
  303    HD1  TYR  44           HD1      TYR  44   3.710   4.108  -3.812
  304    HD2  TYR  44           HD2      TYR  44   5.641   5.466  -7.351
  305    HE1  TYR  44           HE1      TYR  44   5.644   4.825  -2.477
  306    HE2  TYR  44           HE2      TYR  44   7.577   6.183  -6.026
  307    HH   TYR  44           HH       TYR  44   8.498   5.281  -3.474
  308    HA   PRO  45           HA       PRO  45   0.812   2.525 -10.916
  309   1HB   PRO  45          HB2       PRO  45   1.036  -0.265 -10.438
  310   2HB   PRO  45          HB1       PRO  45   1.613   0.634 -11.842
  311   1HG   PRO  45          HG2       PRO  45   3.090  -0.259  -9.428
  312   2HG   PRO  45          HG1       PRO  45   3.673  -0.026 -11.086
  313   1HD   PRO  45          HD2       PRO  45   4.290   1.701  -9.140
  314   2HD   PRO  45          HD1       PRO  45   3.958   2.263 -10.793
  315    H    LYS  46           HN       LYS  46   1.246   0.873  -7.805
  316    HA   LYS  46           HA       LYS  46  -1.496   0.201  -7.512
  317   1HB   LYS  46          HB2       LYS  46  -0.045  -1.132  -6.263
  318   2HB   LYS  46          HB1       LYS  46   0.846   0.247  -5.664
  319   1HG   LYS  46          HG2       LYS  46  -0.542  -0.870  -3.947
  320   2HG   LYS  46          HG1       LYS  46  -0.923   0.836  -4.167
  321   1HD   LYS  46          HD2       LYS  46  -2.940   0.387  -5.207
  322   2HD   LYS  46          HD1       LYS  46  -2.447  -1.235  -5.690
  323   1HE   LYS  46          HE2       LYS  46  -2.367  -1.660  -3.114
  324   2HE   LYS  46          HE1       LYS  46  -3.423  -0.253  -3.046
  325   1HZ   LYS  46          HZ1       LYS  46  -4.391  -2.657  -3.279
  326   2HZ   LYS  46          HZ2       LYS  46  -4.090  -2.401  -4.923
  327   3HZ   LYS  46          HZ3       LYS  46  -5.114  -1.352  -4.079
  Start of MODEL   11
    1   1H    LYS   1          HT1       LYS   1  -7.785   3.880  -1.277
    2   2H    LYS   1          HT2       LYS   1  -7.580   2.682  -0.066
    3   3H    LYS   1          HT3       LYS   1  -8.958   2.644  -1.088
    4    HA   LYS   1           HA       LYS   1  -7.585   1.027  -1.913
    5   1HB   LYS   1          HB2       LYS   1  -8.126   3.414  -3.334
    6   2HB   LYS   1          HB1       LYS   1  -6.514   2.902  -3.812
    7   1HG   LYS   1          HG2       LYS   1  -8.694   0.879  -3.770
    8   2HG   LYS   1          HG1       LYS   1  -8.649   2.057  -5.083
    9   1HD   LYS   1          HD2       LYS   1  -7.462  -0.017  -5.661
   10   2HD   LYS   1          HD1       LYS   1  -6.383   1.378  -5.645
   11   1HE   LYS   1          HE2       LYS   1  -5.257   0.660  -3.794
   12   2HE   LYS   1          HE1       LYS   1  -6.654  -0.189  -3.138
   13   1HZ   LYS   1          HZ1       LYS   1  -5.654  -2.025  -3.860
   14   2HZ   LYS   1          HZ2       LYS   1  -4.549  -1.171  -4.812
   15   3HZ   LYS   1          HZ3       LYS   1  -6.078  -1.547  -5.427
   16    H    SER   2           HN       SER   2  -5.699   4.029  -1.619
   17    HA   SER   2           HA       SER   2  -3.548   4.399  -0.992
   18   1HB   SER   2          HB2       SER   2  -4.184   1.934   0.274
   19   2HB   SER   2          HB1       SER   2  -2.537   1.833  -0.342
   20    HG   SER   2           HG       SER   2  -2.094   3.787   0.763
   21    H    CYS   3           HN       CYS   3  -1.255   3.679  -1.511
   22    HA   CYS   3           HA       CYS   3  -1.157   2.437  -4.177
   23   1HB   CYS   3          HB2       CYS   3   0.480   4.820  -3.282
   24   2HB   CYS   3          HB1       CYS   3   0.513   4.064  -4.870
   25    H    CYS   4           HN       CYS   4   1.311   2.020  -4.710
   26    HA   CYS   4           HA       CYS   4   2.932   1.349  -2.408
   27   1HB   CYS   4          HB2       CYS   4   1.230  -0.540  -2.721
   28   2HB   CYS   4          HB1       CYS   4   2.106  -0.909  -4.199
   29    HA   PRO   5           HA       PRO   5   5.591   2.389  -5.906
   30   1HB   PRO   5          HB2       PRO   5   7.724   2.194  -3.873
   31   2HB   PRO   5          HB1       PRO   5   7.316   3.529  -4.957
   32   1HG   PRO   5          HG2       PRO   5   6.768   3.655  -2.345
   33   2HG   PRO   5          HG1       PRO   5   5.664   4.337  -3.556
   34   1HD   PRO   5          HD2       PRO   5   5.468   1.749  -2.064
   35   2HD   PRO   5          HD1       PRO   5   4.197   2.928  -2.438
   36    H    ASN   6           HN       ASN   6   5.455  -0.561  -4.196
   37    HA   ASN   6           HA       ASN   6   7.123  -1.769  -6.238
   38   1HB   ASN   6          HB2       ASN   6   7.741  -2.267  -3.322
   39   2HB   ASN   6          HB1       ASN   6   8.593  -2.925  -4.716
   40   1HD2  ASN   6          HD21      ASN   6   9.524  -1.247  -6.205
   41   2HD2  ASN   6          HD22      ASN   6  10.279   0.119  -5.465
   42    H    THR   7           HN       THR   7   6.305  -3.658  -6.890
   43    HA   THR   7           HA       THR   7   3.866  -4.648  -5.985
   44    HB   THR   7           HB       THR   7   4.333  -6.632  -7.323
   45    HG1  THR   7           HG1      THR   7   7.000  -5.673  -7.347
   46   1HG2  THR   7          HG21      THR   7   5.723  -4.515  -8.884
   47   2HG2  THR   7          HG22      THR   7   4.034  -4.292  -8.426
   48   3HG2  THR   7          HG23      THR   7   4.508  -5.685  -9.397
   49    H    THR   8           HN       THR   8   7.170  -5.577  -5.173
   50    HA   THR   8           HA       THR   8   6.662  -7.789  -3.566
   51    HB   THR   8           HB       THR   8   8.775  -6.711  -2.284
   52    HG1  THR   8           HG1      THR   8   8.458  -4.779  -3.657
   53   1HG2  THR   8          HG21      THR   8   8.776  -8.805  -3.604
   54   2HG2  THR   8          HG22      THR   8  10.243  -7.844  -3.788
   55   3HG2  THR   8          HG23      THR   8   9.020  -7.840  -5.059
   56    H    GLY   9           HN       GLY   9   6.100  -4.414  -3.026
   57   1HA   GLY   9          HA2       GLY   9   5.687  -4.773  -0.162
   58   2HA   GLY   9          HA1       GLY   9   5.537  -3.263  -1.061
   59    H    ARG  10           HN       ARG  10   3.916  -4.196  -3.136
   60    HA   ARG  10           HA       ARG  10   1.358  -3.758  -2.229
   61   1HB   ARG  10          HB2       ARG  10   2.325  -5.389  -4.580
   62   2HB   ARG  10          HB1       ARG  10   0.629  -5.024  -4.307
   63   1HG   ARG  10          HG2       ARG  10   2.622  -2.812  -4.425
   64   2HG   ARG  10          HG1       ARG  10   2.035  -3.557  -5.911
   65   1HD   ARG  10          HD2       ARG  10   0.465  -2.112  -3.798
   66   2HD   ARG  10          HD1       ARG  10   0.629  -1.706  -5.504
   67    HE   ARG  10           HE       ARG  10  -1.305  -3.406  -4.363
   68   1HH1  ARG  10          HH11      ARG  10   0.731  -3.115  -7.183
   69   2HH1  ARG  10          HH12      ARG  10  -0.307  -4.069  -8.185
   70   1HH2  ARG  10          HH21      ARG  10  -2.675  -4.654  -5.684
   71   2HH2  ARG  10          HH22      ARG  10  -2.242  -4.939  -7.337
   72    H    ASN  11           HN       ASN  11   3.097  -6.809  -2.550
   73    HA   ASN  11           HA       ASN  11   0.992  -8.555  -1.985
   74   1HB   ASN  11          HB2       ASN  11   3.973  -8.728  -1.634
   75   2HB   ASN  11          HB1       ASN  11   2.917 -10.057  -1.198
   76   1HD2  ASN  11          HD21      ASN  11   4.853  -8.965  -3.538
   77   2HD2  ASN  11          HD22      ASN  11   4.129  -9.705  -4.919
   78    H    ILE  12           HN       ILE  12   3.494  -7.376   0.289
   79    HA   ILE  12           HA       ILE  12   2.265  -8.543   2.535
   80    HB   ILE  12           HB       ILE  12   4.160  -6.197   2.403
   81   1HG1  ILE  12          HG12      ILE  12   5.630  -8.192   3.401
   82   2HG1  ILE  12          HG11      ILE  12   4.478  -9.156   2.482
   83   1HG2  ILE  12          HG21      ILE  12   4.631  -6.899   4.814
   84   2HG2  ILE  12          HG22      ILE  12   3.090  -7.755   4.736
   85   3HG2  ILE  12          HG23      ILE  12   3.140  -6.007   4.505
   86   1HD1  ILE  12          HD11      ILE  12   6.768  -7.775   1.562
   87   2HD1  ILE  12          HD12      ILE  12   5.346  -7.041   0.825
   88   3HD1  ILE  12          HD13      ILE  12   5.635  -8.771   0.647
   89    H    TYR  13           HN       TYR  13   2.048  -5.242   1.225
   90    HA   TYR  13           HA       TYR  13   0.393  -4.274   3.292
   91   1HB   TYR  13          HB2       TYR  13   1.718  -2.960   1.528
   92   2HB   TYR  13          HB1       TYR  13   0.329  -3.224   0.477
   93    HD1  TYR  13           HD1      TYR  13   1.709  -1.248   3.137
   94    HD2  TYR  13           HD2      TYR  13  -1.930  -2.370   1.243
   95    HE1  TYR  13           HE1      TYR  13   0.590   0.693   4.149
   96    HE2  TYR  13           HE2      TYR  13  -3.059  -0.430   2.247
   97    HH   TYR  13           HH       TYR  13  -1.622   1.447   4.728
   98    H    ASN  14           HN       ASN  14  -0.299  -5.866   0.228
   99    HA   ASN  14           HA       ASN  14  -3.102  -5.460   0.333
  100   1HB   ASN  14          HB2       ASN  14  -1.259  -7.192  -1.263
  101   2HB   ASN  14          HB1       ASN  14  -2.980  -7.514  -1.293
  102   1HD2  ASN  14          HD21      ASN  14  -1.407  -4.365  -1.037
  103   2HD2  ASN  14          HD22      ASN  14  -2.006  -3.747  -2.534
  104    H    THR  15           HN       THR  15  -1.064  -8.346   0.979
  105    HA   THR  15           HA       THR  15  -3.208  -9.910   1.958
  106    HB   THR  15           HB       THR  15  -1.139 -10.950   1.268
  107    HG1  THR  15           HG1      THR  15  -1.392 -12.460   2.693
  108   1HG2  THR  15          HG21      THR  15   0.913 -10.450   1.968
  109   2HG2  THR  15          HG22      THR  15   0.411 -10.359   3.657
  110   3HG2  THR  15          HG23      THR  15   0.190  -8.970   2.594
  111    H    CYS  16           HN       CYS  16  -0.960  -7.705   3.534
  112    HA   CYS  16           HA       CYS  16  -1.603  -8.260   6.201
  113   1HB   CYS  16          HB2       CYS  16   0.293  -6.893   5.797
  114   2HB   CYS  16          HB1       CYS  16  -0.627  -5.774   4.801
  115    H    ARG  17           HN       ARG  17  -2.929  -5.831   3.964
  116    HA   ARG  17           HA       ARG  17  -4.912  -4.821   5.674
  117   1HB   ARG  17          HB2       ARG  17  -4.267  -4.692   2.827
  118   2HB   ARG  17          HB1       ARG  17  -5.999  -4.663   3.122
  119   1HG   ARG  17          HG2       ARG  17  -4.377  -2.880   4.816
  120   2HG   ARG  17          HG1       ARG  17  -4.450  -2.474   3.101
  121   1HD   ARG  17          HD2       ARG  17  -7.020  -2.876   3.437
  122   2HD   ARG  17          HD1       ARG  17  -6.634  -2.565   5.129
  123    HE   ARG  17           HE       ARG  17  -6.690  -0.654   2.981
  124   1HH1  ARG  17          HH11      ARG  17  -5.386  -1.375   6.138
  125   2HH1  ARG  17          HH12      ARG  17  -5.100   0.285   6.536
  126   1HH2  ARG  17          HH21      ARG  17  -6.315   1.529   3.504
  127   2HH2  ARG  17          HH22      ARG  17  -5.628   1.935   5.041
  128    H    LEU  18           HN       LEU  18  -4.767  -7.617   3.575
  129    HA   LEU  18           HA       LEU  18  -7.484  -8.331   3.619
  130   1HB   LEU  18          HB2       LEU  18  -4.942  -9.554   2.857
  131   2HB   LEU  18          HB1       LEU  18  -6.107 -10.722   3.450
  132    HG   LEU  18           HG       LEU  18  -6.495  -8.817   1.143
  133   1HD1  LEU  18          HD11      LEU  18  -5.018 -10.760   0.722
  134   2HD1  LEU  18          HD12      LEU  18  -6.501 -10.788  -0.231
  135   3HD1  LEU  18          HD13      LEU  18  -6.345 -11.826   1.185
  136   1HD2  LEU  18          HD21      LEU  18  -8.603 -10.236   0.843
  137   2HD2  LEU  18          HD22      LEU  18  -8.619  -9.002   2.104
  138   3HD2  LEU  18          HD23      LEU  18  -8.378 -10.696   2.530
  139    H    GLY  19           HN       GLY  19  -5.108  -8.402   6.068
  140   1HA   GLY  19          HA2       GLY  19  -6.546 -10.425   7.616
  141   2HA   GLY  19          HA1       GLY  19  -4.972  -9.754   8.008
  142    H    GLY  20           HN       GLY  20  -6.838  -7.202   7.106
  143   1HA   GLY  20          HA2       GLY  20  -8.018  -5.585   8.218
  144   2HA   GLY  20          HA1       GLY  20  -8.460  -6.810   9.395
  145    H    GLY  21           HN       GLY  21  -5.281  -5.433   8.489
  146   1HA   GLY  21          HA2       GLY  21  -4.906  -4.803  11.333
  147   2HA   GLY  21          HA1       GLY  21  -3.607  -5.177  10.208
  148    H    SER  22           HN       SER  22  -2.778  -3.156  11.137
  149    HA   SER  22           HA       SER  22  -4.011  -0.670  10.500
  150   1HB   SER  22          HB2       SER  22  -1.204  -0.318  10.853
  151   2HB   SER  22          HB1       SER  22  -2.516   0.104  11.950
  152    HG   SER  22           HG       SER  22  -2.379  -1.938  12.861
  153    H    ARG  23           HN       ARG  23  -3.380   0.863   9.007
  154    HA   ARG  23           HA       ARG  23  -2.666  -0.184   6.457
  155   1HB   ARG  23          HB2       ARG  23  -2.452   2.606   6.305
  156   2HB   ARG  23          HB1       ARG  23  -3.804   1.614   5.795
  157   1HG   ARG  23          HG2       ARG  23  -4.732   3.255   7.164
  158   2HG   ARG  23          HG1       ARG  23  -4.651   1.821   8.187
  159   1HD   ARG  23          HD2       ARG  23  -2.856   2.659   9.420
  160   2HD   ARG  23          HD1       ARG  23  -2.422   3.824   8.171
  161    HE   ARG  23           HE       ARG  23  -3.874   5.305   9.116
  162   1HH1  ARG  23          HH11      ARG  23  -4.689   2.099  10.230
  163   2HH1  ARG  23          HH12      ARG  23  -5.884   2.657  11.352
  164   1HH2  ARG  23          HH21      ARG  23  -5.445   6.040  10.592
  165   2HH2  ARG  23          HH22      ARG  23  -6.313   4.894  11.558
  166    H    GLU  24           HN       GLU  24  -1.114   1.917   8.794
  167    HA   GLU  24           HA       GLU  24   1.268   2.297   7.295
  168   1HB   GLU  24          HB2       GLU  24   1.188   2.588  10.269
  169   2HB   GLU  24          HB1       GLU  24   2.013   3.580   9.073
  170   1HG   GLU  24          HG2       GLU  24  -0.355   4.224   8.295
  171   2HG   GLU  24          HG1       GLU  24  -0.872   3.584   9.855
  172    H    ARG  25           HN       ARG  25   0.248  -0.126   9.607
  173    HA   ARG  25           HA       ARG  25   2.728  -1.107  10.404
  174   1HB   ARG  25          HB2       ARG  25   0.294  -1.762  11.119
  175   2HB   ARG  25          HB1       ARG  25   0.453  -2.981   9.863
  176   1HG   ARG  25          HG2       ARG  25   1.940  -4.205  11.045
  177   2HG   ARG  25          HG1       ARG  25   2.672  -2.790  11.803
  178   1HD   ARG  25          HD2       ARG  25   1.201  -2.785  13.532
  179   2HD   ARG  25          HD1       ARG  25  -0.123  -3.407  12.549
  180    HE   ARG  25           HE       ARG  25   1.550  -5.521  12.729
  181   1HH1  ARG  25          HH11      ARG  25   0.129  -3.400  15.108
  182   2HH1  ARG  25          HH12      ARG  25   0.090  -4.610  16.346
  183   1HH2  ARG  25          HH21      ARG  25   1.499  -7.114  14.355
  184   2HH2  ARG  25          HH22      ARG  25   0.868  -6.719  15.920
  185    H    CYS  26           HN       CYS  26   0.730  -2.084   7.647
  186    HA   CYS  26           HA       CYS  26   2.644  -3.947   6.651
  187   1HB   CYS  26          HB2       CYS  26   0.836  -2.872   4.626
  188   2HB   CYS  26          HB1       CYS  26   1.066  -4.527   5.158
  189    H    ALA  27           HN       ALA  27   1.887  -0.579   5.996
  190    HA   ALA  27           HA       ALA  27   3.467  -0.188   3.730
  191   1HB   ALA  27          HB1       ALA  27   1.928   1.409   5.444
  192   2HB   ALA  27          HB2       ALA  27   2.661   1.873   3.908
  193   3HB   ALA  27          HB3       ALA  27   3.535   2.135   5.417
  194    H    SER  28           HN       SER  28   4.305   0.201   7.169
  195    HA   SER  28           HA       SER  28   6.997   0.937   6.664
  196   1HB   SER  28          HB2       SER  28   7.305   0.869   9.009
  197   2HB   SER  28          HB1       SER  28   5.628   1.367   8.787
  198    HG   SER  28           HG       SER  28   5.748  -0.262  10.341
  199    H    LEU  29           HN       LEU  29   5.329  -2.087   7.024
  200    HA   LEU  29           HA       LEU  29   7.603  -3.707   7.540
  201   1HB   LEU  29          HB2       LEU  29   4.801  -4.056   7.306
  202   2HB   LEU  29          HB1       LEU  29   5.554  -5.176   6.187
  203    HG   LEU  29           HG       LEU  29   6.510  -5.032   9.022
  204   1HD1  LEU  29          HD11      LEU  29   4.864  -7.066   9.254
  205   2HD1  LEU  29          HD12      LEU  29   3.958  -6.189   8.022
  206   3HD1  LEU  29          HD13      LEU  29   4.321  -5.417   9.565
  207   1HD2  LEU  29          HD21      LEU  29   6.300  -7.389   7.169
  208   2HD2  LEU  29          HD22      LEU  29   7.279  -7.223   8.626
  209   3HD2  LEU  29          HD23      LEU  29   7.693  -6.307   7.177
  210    H    SER  30           HN       SER  30   5.896  -2.766   4.582
  211    HA   SER  30           HA       SER  30   7.953  -4.153   3.022
  212   1HB   SER  30          HB2       SER  30   5.083  -3.698   2.628
  213   2HB   SER  30          HB1       SER  30   6.061  -3.401   1.191
  214    HG   SER  30           HG       SER  30   6.996  -5.512   1.584
  215    H    GLY  31           HN       GLY  31   5.898  -1.422   2.098
  216   1HA   GLY  31          HA2       GLY  31   7.386   0.761   2.322
  217   2HA   GLY  31          HA1       GLY  31   8.253  -0.076   1.047
  218    H    CYS  32           HN       CYS  32   4.763  -0.119   1.457
  219    HA   CYS  32           HA       CYS  32   4.282   0.659  -1.252
  220   1HB   CYS  32          HB2       CYS  32   2.522   0.274   1.181
  221   2HB   CYS  32          HB1       CYS  32   1.877   0.765  -0.376
  222    H    LYS  33           HN       LYS  33   2.111   2.425  -1.002
  223    HA   LYS  33           HA       LYS  33   3.326   4.847   0.126
  224   1HB   LYS  33          HB2       LYS  33   2.769   4.224  -2.641
  225   2HB   LYS  33          HB1       LYS  33   1.877   5.649  -2.134
  226   1HG   LYS  33          HG2       LYS  33   4.849   5.224  -2.073
  227   2HG   LYS  33          HG1       LYS  33   3.941   6.377  -3.048
  228   1HD   LYS  33          HD2       LYS  33   4.440   6.418  -0.084
  229   2HD   LYS  33          HD1       LYS  33   4.904   7.619  -1.287
  230   1HE   LYS  33          HE2       LYS  33   2.167   7.486  -1.560
  231   2HE   LYS  33          HE1       LYS  33   2.404   7.303   0.176
  232   1HZ   LYS  33          HZ1       LYS  33   2.926   9.598  -1.536
  233   2HZ   LYS  33          HZ2       LYS  33   4.042   9.322  -0.296
  234   3HZ   LYS  33          HZ3       LYS  33   2.407   9.543   0.073
  235    H    ILE  34           HN       ILE  34   2.011   5.866   1.481
  236    HA   ILE  34           HA       ILE  34  -0.873   5.356   1.293
  237    HB   ILE  34           HB       ILE  34   0.967   5.597   3.567
  238   1HG1  ILE  34          HG12      ILE  34  -0.640   4.134   4.619
  239   2HG1  ILE  34          HG11      ILE  34  -1.837   4.491   3.379
  240   1HG2  ILE  34          HG21      ILE  34  -1.632   7.104   3.580
  241   2HG2  ILE  34          HG22      ILE  34  -0.026   7.681   4.028
  242   3HG2  ILE  34          HG23      ILE  34  -0.865   6.520   5.058
  243   1HD1  ILE  34          HD11      ILE  34   0.413   3.535   2.020
  244   2HD1  ILE  34          HD12      ILE  34  -1.127   2.718   2.273
  245   3HD1  ILE  34          HD13      ILE  34   0.193   2.483   3.416
  246    H    ILE  35           HN       ILE  35  -1.964   6.941   0.349
  247    HA   ILE  35           HA       ILE  35  -1.301   9.716   1.046
  248    HB   ILE  35           HB       ILE  35  -2.175   9.315  -1.748
  249   1HG1  ILE  35          HG12      ILE  35   0.333   8.965  -2.350
  250   2HG1  ILE  35          HG11      ILE  35   0.470   8.325  -0.716
  251   1HG2  ILE  35          HG21      ILE  35  -1.189  11.320  -2.060
  252   2HG2  ILE  35          HG22      ILE  35   0.206  10.911  -1.063
  253   3HG2  ILE  35          HG23      ILE  35  -1.302  11.416  -0.302
  254   1HD1  ILE  35          HD11      ILE  35  -0.781   6.472  -1.192
  255   2HD1  ILE  35          HD12      ILE  35   0.015   6.748  -2.741
  256   3HD1  ILE  35          HD13      ILE  35  -1.654   7.264  -2.504
  257    H    SER  36           HN       SER  36  -3.201  10.909  -0.662
  258    HA   SER  36           HA       SER  36  -5.721   9.909   0.476
  259   1HB   SER  36          HB2       SER  36  -4.636  12.301   1.070
  260   2HB   SER  36          HB1       SER  36  -5.526  12.748  -0.384
  261    HG   SER  36           HG       SER  36  -6.759  12.958   1.563
  262    H    ALA  37           HN       ALA  37  -7.543   9.879  -0.861
  263    HA   ALA  37           HA       ALA  37  -8.679   9.607  -2.818
  264   1HB   ALA  37          HB1       ALA  37  -7.721  12.112  -2.939
  265   2HB   ALA  37          HB2       ALA  37  -8.687  11.383  -4.222
  266   3HB   ALA  37          HB3       ALA  37  -6.929  11.424  -4.356
  267    H    SER  38           HN       SER  38  -6.023   8.215  -2.199
  268    HA   SER  38           HA       SER  38  -4.804   6.539  -3.104
  269   1HB   SER  38          HB2       SER  38  -6.989   6.805  -5.097
  270   2HB   SER  38          HB1       SER  38  -5.590   5.821  -5.515
  271    HG   SER  38           HG       SER  38  -7.633   5.309  -3.766
  272    H    THR  39           HN       THR  39  -4.496   9.560  -3.941
  273    HA   THR  39           HA       THR  39  -3.257   9.476  -6.462
  274    HB   THR  39           HB       THR  39  -2.351  11.477  -4.451
  275    HG1  THR  39           HG1      THR  39  -4.272  12.167  -4.022
  276   1HG2  THR  39          HG21      THR  39  -3.318  12.882  -6.529
  277   2HG2  THR  39          HG22      THR  39  -2.848  11.388  -7.340
  278   3HG2  THR  39          HG23      THR  39  -1.657  12.301  -6.414
  279    H    CYS  40           HN       CYS  40  -1.443   8.486  -6.995
  280    HA   CYS  40           HA       CYS  40   0.507   7.822  -4.917
  281   1HB   CYS  40          HB2       CYS  40   0.621   6.838  -7.754
  282   2HB   CYS  40          HB1       CYS  40   1.256   6.081  -6.298
  283    HA   PRO  41           HA       PRO  41   3.633  10.656  -6.051
  284   1HB   PRO  41          HB2       PRO  41   5.828   8.987  -6.357
  285   2HB   PRO  41          HB1       PRO  41   5.239   9.625  -4.823
  286   1HG   PRO  41          HG2       PRO  41   4.750   6.960  -6.083
  287   2HG   PRO  41          HG1       PRO  41   5.061   7.359  -4.382
  288   1HD   PRO  41          HD2       PRO  41   2.592   6.818  -5.237
  289   2HD   PRO  41          HD1       PRO  41   2.881   8.086  -4.027
  290    H    SER  42           HN       SER  42   5.259   8.130  -7.861
  291    HA   SER  42           HA       SER  42   5.338   9.748 -10.193
  292   1HB   SER  42          HB2       SER  42   7.219   8.374  -9.880
  293   2HB   SER  42          HB1       SER  42   6.235   6.943  -9.575
  294    HG   SER  42           HG       SER  42   7.244   7.097 -11.709
  295    H    ASP  43           HN       ASP  43   4.438   6.348 -10.407
  296    HA   ASP  43           HA       ASP  43   1.779   6.937 -11.368
  297   1HB   ASP  43          HB2       ASP  43   3.997   6.064 -13.203
  298   2HB   ASP  43          HB1       ASP  43   2.327   5.620 -13.539
  299    H    TYR  44           HN       TYR  44   2.140   5.569  -9.209
  300    HA   TYR  44           HA       TYR  44   2.027   2.733  -9.965
  301   1HB   TYR  44          HB2       TYR  44   3.846   3.700  -8.326
  302   2HB   TYR  44          HB1       TYR  44   2.539   3.602  -7.151
  303    HD1  TYR  44           HD1      TYR  44   1.169   1.164  -7.709
  304    HD2  TYR  44           HD2      TYR  44   5.337   1.980  -7.989
  305    HE1  TYR  44           HE1      TYR  44   1.654  -1.220  -7.350
  306    HE2  TYR  44           HE2      TYR  44   5.834  -0.400  -7.625
  307    HH   TYR  44           HH       TYR  44   3.742  -2.548  -6.389
  308    HA   PRO  45           HA       PRO  45  -2.157   4.108  -8.302
  309   1HB   PRO  45          HB2       PRO  45  -3.627   3.401 -10.453
  310   2HB   PRO  45          HB1       PRO  45  -2.851   4.983 -10.316
  311   1HG   PRO  45          HG2       PRO  45  -1.933   2.548 -11.800
  312   2HG   PRO  45          HG1       PRO  45  -1.946   4.241 -12.331
  313   1HD   PRO  45          HD2       PRO  45   0.289   3.027 -11.411
  314   2HD   PRO  45          HD1       PRO  45  -0.030   4.756 -11.162
  315    H    LYS  46           HN       LYS  46  -1.223   2.050  -7.104
  316    HA   LYS  46           HA       LYS  46  -2.103  -0.481  -8.057
  317   1HB   LYS  46          HB2       LYS  46  -1.189  -1.374  -6.144
  318   2HB   LYS  46          HB1       LYS  46  -0.269   0.109  -6.300
  319   1HG   LYS  46          HG2       LYS  46  -0.793   0.496  -4.178
  320   2HG   LYS  46          HG1       LYS  46  -2.425   0.856  -4.746
  321   1HD   LYS  46          HD2       LYS  46  -2.706  -1.754  -4.581
  322   2HD   LYS  46          HD1       LYS  46  -1.357  -1.610  -3.455
  323   1HE   LYS  46          HE2       LYS  46  -3.473   0.354  -3.014
  324   2HE   LYS  46          HE1       LYS  46  -4.004  -1.315  -2.817
  325   1HZ   LYS  46          HZ1       LYS  46  -1.522  -0.391  -1.528
  326   2HZ   LYS  46          HZ2       LYS  46  -2.544  -1.665  -1.086
  327   3HZ   LYS  46          HZ3       LYS  46  -3.020  -0.066  -0.811
  Start of MODEL   12
    1   1H    LYS   1          HT1       LYS   1  -7.151   1.968  -0.900
    2   2H    LYS   1          HT2       LYS   1  -6.697   0.320  -0.733
    3   3H    LYS   1          HT3       LYS   1  -8.148   0.736  -1.551
    4    HA   LYS   1           HA       LYS   1  -6.645   0.213  -3.195
    5   1HB   LYS   1          HB2       LYS   1  -7.646   2.849  -2.793
    6   2HB   LYS   1          HB1       LYS   1  -6.068   2.991  -3.557
    7   1HG   LYS   1          HG2       LYS   1  -8.007   1.035  -4.674
    8   2HG   LYS   1          HG1       LYS   1  -8.267   2.754  -4.976
    9   1HD   LYS   1          HD2       LYS   1  -6.966   1.706  -6.771
   10   2HD   LYS   1          HD1       LYS   1  -6.031   2.940  -5.926
   11   1HE   LYS   1          HE2       LYS   1  -4.649   1.399  -4.923
   12   2HE   LYS   1          HE1       LYS   1  -5.843   0.107  -5.020
   13   1HZ   LYS   1          HZ1       LYS   1  -5.390   0.579  -7.604
   14   2HZ   LYS   1          HZ2       LYS   1  -4.545  -0.575  -6.704
   15   3HZ   LYS   1          HZ3       LYS   1  -3.867   0.951  -6.966
   16    H    SER   2           HN       SER   2  -5.153   2.846  -1.301
   17    HA   SER   2           HA       SER   2  -2.990   3.317  -0.785
   18   1HB   SER   2          HB2       SER   2  -1.667   1.556   0.036
   19   2HB   SER   2          HB1       SER   2  -3.318   0.977   0.254
   20    HG   SER   2           HG       SER   2  -1.902  -0.584  -0.703
   21    H    CYS   3           HN       CYS   3  -0.714   3.235  -1.573
   22    HA   CYS   3           HA       CYS   3  -0.640   2.803  -4.488
   23   1HB   CYS   3          HB2       CYS   3  -0.638   5.183  -3.990
   24   2HB   CYS   3          HB1       CYS   3   0.695   4.977  -2.861
   25    H    CYS   4           HN       CYS   4   1.017   1.631  -5.298
   26    HA   CYS   4           HA       CYS   4   3.389   1.171  -3.676
   27   1HB   CYS   4          HB2       CYS   4   1.596  -1.067  -4.630
   28   2HB   CYS   4          HB1       CYS   4   3.219  -1.298  -3.989
   29    HA   PRO   5           HA       PRO   5   5.135   1.508  -7.736
   30   1HB   PRO   5          HB2       PRO   5   7.683   0.822  -7.155
   31   2HB   PRO   5          HB1       PRO   5   6.983   2.375  -6.679
   32   1HG   PRO   5          HG2       PRO   5   7.362  -0.109  -5.051
   33   2HG   PRO   5          HG1       PRO   5   7.670   1.579  -4.604
   34   1HD   PRO   5          HD2       PRO   5   5.431   0.242  -3.851
   35   2HD   PRO   5          HD1       PRO   5   5.454   1.993  -4.144
   36    H    ASN   6           HN       ASN   6   5.006  -1.454  -5.957
   37    HA   ASN   6           HA       ASN   6   4.948  -2.973  -8.379
   38   1HB   ASN   6          HB2       ASN   6   6.873  -4.507  -7.469
   39   2HB   ASN   6          HB1       ASN   6   7.256  -3.078  -8.423
   40   1HD2  ASN   6          HD21      ASN   6   9.283  -2.835  -7.550
   41   2HD2  ASN   6          HD22      ASN   6   9.549  -2.322  -5.922
   42    H    THR   7           HN       THR   7   4.406  -5.208  -8.042
   43    HA   THR   7           HA       THR   7   2.448  -5.652  -6.161
   44    HB   THR   7           HB       THR   7   2.465  -7.118  -7.979
   45    HG1  THR   7           HG1      THR   7   1.881  -8.553  -6.560
   46   1HG2  THR   7          HG21      THR   7   5.344  -7.226  -7.553
   47   2HG2  THR   7          HG22      THR   7   4.401  -7.437  -9.029
   48   3HG2  THR   7          HG23      THR   7   4.619  -8.791  -7.920
   49    H    THR   8           HN       THR   8   5.898  -5.982  -5.803
   50    HA   THR   8           HA       THR   8   6.072  -7.690  -3.626
   51    HB   THR   8           HB       THR   8   8.070  -6.082  -3.002
   52    HG1  THR   8           HG1      THR   8   7.241  -4.426  -4.440
   53   1HG2  THR   8          HG21      THR   8   8.068  -8.352  -4.276
   54   2HG2  THR   8          HG22      THR   8   9.486  -7.304  -4.320
   55   3HG2  THR   8          HG23      THR   8   8.369  -7.334  -5.684
   56    H    GLY   9           HN       GLY   9   5.409  -4.215  -3.706
   57   1HA   GLY   9          HA2       GLY   9   5.181  -4.047  -0.827
   58   2HA   GLY   9          HA1       GLY   9   4.842  -2.762  -1.981
   59    H    ARG  10           HN       ARG  10   3.048  -4.100  -3.624
   60    HA   ARG  10           HA       ARG  10   0.597  -3.653  -2.384
   61   1HB   ARG  10          HB2       ARG  10   1.515  -4.438  -4.926
   62   2HB   ARG  10          HB1       ARG  10   0.320  -5.634  -4.436
   63   1HG   ARG  10          HG2       ARG  10  -0.695  -3.085  -3.767
   64   2HG   ARG  10          HG1       ARG  10  -0.080  -3.007  -5.418
   65   1HD   ARG  10          HD2       ARG  10  -1.427  -5.432  -5.288
   66   2HD   ARG  10          HD1       ARG  10  -2.444  -4.306  -4.386
   67    HE   ARG  10           HE       ARG  10  -1.639  -3.054  -6.727
   68   1HH1  ARG  10          HH11      ARG  10  -3.631  -5.743  -5.746
   69   2HH1  ARG  10          HH12      ARG  10  -4.688  -5.625  -7.112
   70   1HH2  ARG  10          HH21      ARG  10  -3.031  -2.893  -8.531
   71   2HH2  ARG  10          HH22      ARG  10  -4.347  -4.007  -8.694
   72    H    ASN  11           HN       ASN  11   2.618  -6.496  -2.484
   73    HA   ASN  11           HA       ASN  11   0.717  -8.414  -1.704
   74   1HB   ASN  11          HB2       ASN  11   3.703  -8.232  -1.684
   75   2HB   ASN  11          HB1       ASN  11   2.920  -9.555  -0.838
   76   1HD2  ASN  11          HD21      ASN  11   4.382  -8.823  -3.593
   77   2HD2  ASN  11          HD22      ASN  11   3.572  -9.886  -4.687
   78    H    ILE  12           HN       ILE  12   3.170  -6.697   0.265
   79    HA   ILE  12           HA       ILE  12   2.257  -7.785   2.701
   80    HB   ILE  12           HB       ILE  12   3.787  -5.230   2.217
   81   1HG1  ILE  12          HG12      ILE  12   5.591  -6.907   3.261
   82   2HG1  ILE  12          HG11      ILE  12   4.540  -8.092   2.492
   83   1HG2  ILE  12          HG21      ILE  12   4.517  -5.856   4.680
   84   2HG2  ILE  12          HG22      ILE  12   2.918  -6.598   4.708
   85   3HG2  ILE  12          HG23      ILE  12   3.085  -4.877   4.363
   86   1HD1  ILE  12          HD11      ILE  12   6.540  -6.461   1.325
   87   2HD1  ILE  12          HD12      ILE  12   4.980  -6.023   0.629
   88   3HD1  ILE  12          HD13      ILE  12   5.535  -7.696   0.568
   89    H    TYR  13           HN       TYR  13   1.573  -4.705   1.094
   90    HA   TYR  13           HA       TYR  13  -0.057  -3.603   3.071
   91   1HB   TYR  13          HB2       TYR  13   0.917  -2.625   0.848
   92   2HB   TYR  13          HB1       TYR  13  -0.608  -3.168   0.164
   93    HD1  TYR  13           HD1      TYR  13   1.019  -0.434   1.519
   94    HD2  TYR  13           HD2      TYR  13  -2.721  -2.452   1.696
   95    HE1  TYR  13           HE1      TYR  13  -0.055   1.638   2.291
   96    HE2  TYR  13           HE2      TYR  13  -3.806  -0.384   2.469
   97    HH   TYR  13           HH       TYR  13  -3.307   2.145   2.250
   98    H    ASN  14           HN       ASN  14  -0.909  -5.575   0.236
   99    HA   ASN  14           HA       ASN  14  -3.680  -5.611   0.744
  100   1HB   ASN  14          HB2       ASN  14  -1.825  -7.202  -0.985
  101   2HB   ASN  14          HB1       ASN  14  -3.498  -7.691  -0.803
  102   1HD2  ASN  14          HD21      ASN  14  -1.792  -4.601  -1.212
  103   2HD2  ASN  14          HD22      ASN  14  -2.782  -4.035  -2.507
  104    H    THR  15           HN       THR  15  -1.149  -8.092   1.318
  105    HA   THR  15           HA       THR  15  -2.896  -9.925   2.563
  106    HB   THR  15           HB       THR  15  -0.643 -10.491   1.707
  107    HG1  THR  15           HG1      THR  15  -1.215 -12.083   2.971
  108   1HG2  THR  15          HG21      THR  15   1.325  -9.876   2.647
  109   2HG2  THR  15          HG22      THR  15   0.615  -9.631   4.242
  110   3HG2  THR  15          HG23      THR  15   0.385  -8.421   2.980
  111    H    CYS  16           HN       CYS  16  -0.996  -7.248   3.778
  112    HA   CYS  16           HA       CYS  16  -1.249  -7.651   6.521
  113   1HB   CYS  16          HB2       CYS  16   0.214  -5.936   5.835
  114   2HB   CYS  16          HB1       CYS  16  -0.993  -5.199   4.795
  115    H    ARG  17           HN       ARG  17  -3.257  -5.623   4.384
  116    HA   ARG  17           HA       ARG  17  -5.267  -5.100   6.271
  117   1HB   ARG  17          HB2       ARG  17  -4.895  -4.762   3.389
  118   2HB   ARG  17          HB1       ARG  17  -6.568  -5.067   3.830
  119   1HG   ARG  17          HG2       ARG  17  -5.114  -3.051   5.429
  120   2HG   ARG  17          HG1       ARG  17  -5.508  -2.626   3.762
  121   1HD   ARG  17          HD2       ARG  17  -7.854  -3.116   4.173
  122   2HD   ARG  17          HD1       ARG  17  -7.478  -3.608   5.823
  123    HE   ARG  17           HE       ARG  17  -7.447  -1.406   6.426
  124   1HH1  ARG  17          HH11      ARG  17  -7.142  -1.611   2.955
  125   2HH1  ARG  17          HH12      ARG  17  -7.266   0.098   2.718
  126   1HH2  ARG  17          HH21      ARG  17  -7.609   0.844   6.116
  127   2HH2  ARG  17          HH22      ARG  17  -7.531   1.493   4.512
  128    H    LEU  18           HN       LEU  18  -4.817  -7.718   3.938
  129    HA   LEU  18           HA       LEU  18  -7.343  -8.925   4.307
  130   1HB   LEU  18          HB2       LEU  18  -4.796  -9.608   3.028
  131   2HB   LEU  18          HB1       LEU  18  -5.674 -10.999   3.632
  132    HG   LEU  18           HG       LEU  18  -6.702  -8.959   1.659
  133   1HD1  LEU  18          HD11      LEU  18  -6.110 -11.889   1.285
  134   2HD1  LEU  18          HD12      LEU  18  -5.027 -10.584   0.804
  135   3HD1  LEU  18          HD13      LEU  18  -6.614 -10.734   0.052
  136   1HD2  LEU  18          HD21      LEU  18  -8.581 -10.702   1.483
  137   2HD2  LEU  18          HD22      LEU  18  -8.599  -9.593   2.854
  138   3HD2  LEU  18          HD23      LEU  18  -8.029 -11.248   3.067
  139    H    GLY  19           HN       GLY  19  -4.578  -8.777   6.296
  140   1HA   GLY  19          HA2       GLY  19  -5.547 -11.052   7.889
  141   2HA   GLY  19          HA1       GLY  19  -3.900 -10.442   7.920
  142    H    GLY  20           HN       GLY  20  -6.322  -8.023   7.803
  143   1HA   GLY  20          HA2       GLY  20  -7.122  -6.555   9.379
  144   2HA   GLY  20          HA1       GLY  20  -6.893  -7.824  10.572
  145    H    GLY  21           HN       GLY  21  -4.854  -5.721   8.555
  146   1HA   GLY  21          HA2       GLY  21  -3.296  -5.086  10.969
  147   2HA   GLY  21          HA1       GLY  21  -2.519  -5.429   9.430
  148    H    SER  22           HN       SER  22  -3.301  -3.036  11.418
  149    HA   SER  22           HA       SER  22  -4.563  -0.993  10.205
  150   1HB   SER  22          HB2       SER  22  -1.985  -0.093  11.273
  151   2HB   SER  22          HB1       SER  22  -3.625   0.316  11.778
  152    HG   SER  22           HG       SER  22  -3.054  -0.872  13.440
  153    H    ARG  23           HN       ARG  23  -3.963   0.804   8.922
  154    HA   ARG  23           HA       ARG  23  -2.740   0.137   6.507
  155   1HB   ARG  23          HB2       ARG  23  -4.315   2.173   7.361
  156   2HB   ARG  23          HB1       ARG  23  -2.772   3.000   7.204
  157   1HG   ARG  23          HG2       ARG  23  -2.678   2.684   4.928
  158   2HG   ARG  23          HG1       ARG  23  -3.760   1.291   4.969
  159   1HD   ARG  23          HD2       ARG  23  -4.717   3.424   4.003
  160   2HD   ARG  23          HD1       ARG  23  -5.662   2.654   5.273
  161    HE   ARG  23           HE       ARG  23  -4.170   5.158   5.474
  162   1HH1  ARG  23          HH11      ARG  23  -6.186   2.759   7.026
  163   2HH1  ARG  23          HH12      ARG  23  -6.605   3.794   8.349
  164   1HH2  ARG  23          HH21      ARG  23  -4.723   6.509   7.214
  165   2HH2  ARG  23          HH22      ARG  23  -5.777   5.918   8.457
  166    H    GLU  24           HN       GLU  24  -1.493   1.787   9.327
  167    HA   GLU  24           HA       GLU  24   0.984   2.545   8.152
  168   1HB   GLU  24          HB2       GLU  24   0.709   2.156  11.101
  169   2HB   GLU  24          HB1       GLU  24   1.526   3.437  10.213
  170   1HG   GLU  24          HG2       GLU  24  -0.840   4.121   9.460
  171   2HG   GLU  24          HG1       GLU  24  -1.388   3.115  10.802
  172    H    ARG  25           HN       ARG  25  -0.072  -0.252  10.012
  173    HA   ARG  25           HA       ARG  25   2.390  -1.387  10.603
  174   1HB   ARG  25          HB2       ARG  25  -0.102  -2.118  11.137
  175   2HB   ARG  25          HB1       ARG  25   0.156  -3.172   9.752
  176   1HG   ARG  25          HG2       ARG  25   2.352  -3.802  11.041
  177   2HG   ARG  25          HG1       ARG  25   1.444  -3.209  12.433
  178   1HD   ARG  25          HD2       ARG  25  -0.432  -4.761  11.328
  179   2HD   ARG  25          HD1       ARG  25   1.003  -5.605  10.750
  180    HE   ARG  25           HE       ARG  25   1.382  -6.344  12.880
  181   1HH1  ARG  25          HH11      ARG  25  -0.883  -3.691  13.000
  182   2HH1  ARG  25          HH12      ARG  25  -1.220  -3.892  14.687
  183   1HH2  ARG  25          HH21      ARG  25   0.938  -6.609  15.098
  184   2HH2  ARG  25          HH22      ARG  25  -0.186  -5.547  15.878
  185    H    CYS  26           HN       CYS  26   0.402  -1.770   7.697
  186    HA   CYS  26           HA       CYS  26   2.232  -3.525   6.397
  187   1HB   CYS  26          HB2       CYS  26   0.561  -2.032   4.543
  188   2HB   CYS  26          HB1       CYS  26   0.638  -3.758   4.848
  189    H    ALA  27           HN       ALA  27   1.700  -0.046   6.342
  190    HA   ALA  27           HA       ALA  27   3.407   0.538   4.180
  191   1HB   ALA  27          HB1       ALA  27   1.849   2.193   4.877
  192   2HB   ALA  27          HB2       ALA  27   3.461   2.845   5.178
  193   3HB   ALA  27          HB3       ALA  27   2.502   2.210   6.515
  194    H    SER  28           HN       SER  28   4.010   0.359   7.666
  195    HA   SER  28           HA       SER  28   6.716   1.186   7.505
  196   1HB   SER  28          HB2       SER  28   5.422   1.357   9.588
  197   2HB   SER  28          HB1       SER  28   5.315  -0.400   9.668
  198    HG   SER  28           HG       SER  28   7.086  -0.173  10.794
  199    H    LEU  29           HN       LEU  29   5.131  -1.970   7.594
  200    HA   LEU  29           HA       LEU  29   7.532  -3.487   7.698
  201   1HB   LEU  29          HB2       LEU  29   4.807  -4.011   7.895
  202   2HB   LEU  29          HB1       LEU  29   5.299  -4.857   6.441
  203    HG   LEU  29           HG       LEU  29   7.258  -5.656   8.117
  204   1HD1  LEU  29          HD11      LEU  29   5.868  -6.314  10.222
  205   2HD1  LEU  29          HD12      LEU  29   4.910  -4.896   9.796
  206   3HD1  LEU  29          HD13      LEU  29   6.635  -4.729  10.130
  207   1HD2  LEU  29          HD21      LEU  29   4.521  -6.842   7.704
  208   2HD2  LEU  29          HD22      LEU  29   5.855  -7.704   8.470
  209   3HD2  LEU  29          HD23      LEU  29   5.993  -7.177   6.792
  210    H    SER  30           HN       SER  30   5.324  -2.652   5.038
  211    HA   SER  30           HA       SER  30   7.094  -3.857   3.092
  212   1HB   SER  30          HB2       SER  30   4.413  -3.587   3.128
  213   2HB   SER  30          HB1       SER  30   4.842  -2.168   2.174
  214    HG   SER  30           HG       SER  30   6.169  -3.708   0.911
  215    H    GLY  31           HN       GLY  31   5.647  -0.607   3.381
  216   1HA   GLY  31          HA2       GLY  31   7.138   1.335   3.466
  217   2HA   GLY  31          HA1       GLY  31   8.189   0.484   2.346
  218    H    CYS  32           HN       CYS  32   4.780   0.281   1.842
  219    HA   CYS  32           HA       CYS  32   4.981   1.444  -0.743
  220   1HB   CYS  32          HB2       CYS  32   2.763   0.357   0.943
  221   2HB   CYS  32          HB1       CYS  32   2.355   1.320  -0.469
  222    H    LYS  33           HN       LYS  33   2.864   3.037  -1.162
  223    HA   LYS  33           HA       LYS  33   3.334   5.331   0.621
  224   1HB   LYS  33          HB2       LYS  33   3.730   5.082  -2.193
  225   2HB   LYS  33          HB1       LYS  33   2.421   6.222  -1.924
  226   1HG   LYS  33          HG2       LYS  33   5.225   6.377  -0.846
  227   2HG   LYS  33          HG1       LYS  33   4.472   7.434  -2.041
  228   1HD   LYS  33          HD2       LYS  33   3.714   7.182   0.869
  229   2HD   LYS  33          HD1       LYS  33   4.547   8.539   0.113
  230   1HE   LYS  33          HE2       LYS  33   2.145   8.032  -1.328
  231   2HE   LYS  33          HE1       LYS  33   1.761   8.107   0.387
  232   1HZ   LYS  33          HZ1       LYS  33   1.657  10.280  -0.737
  233   2HZ   LYS  33          HZ2       LYS  33   3.311  10.174  -1.072
  234   3HZ   LYS  33          HZ3       LYS  33   2.779  10.256   0.530
  235    H    ILE  34           HN       ILE  34   1.604   6.452   1.362
  236    HA   ILE  34           HA       ILE  34  -1.008   5.255   0.929
  237    HB   ILE  34           HB       ILE  34   0.000   5.967   3.213
  238   1HG1  ILE  34          HG12      ILE  34  -2.474   6.875   3.778
  239   2HG1  ILE  34          HG11      ILE  34  -2.769   6.173   2.189
  240   1HG2  ILE  34          HG21      ILE  34  -1.245   8.600   2.467
  241   2HG2  ILE  34          HG22      ILE  34   0.491   8.299   2.410
  242   3HG2  ILE  34          HG23      ILE  34  -0.373   8.189   3.944
  243   1HD1  ILE  34          HD11      ILE  34  -1.306   4.231   3.469
  244   2HD1  ILE  34          HD12      ILE  34  -3.059   4.254   3.269
  245   3HD1  ILE  34          HD13      ILE  34  -2.331   4.880   4.749
  246    H    ILE  35           HN       ILE  35  -2.662   6.185  -0.164
  247    HA   ILE  35           HA       ILE  35  -2.107   8.313  -1.955
  248    HB   ILE  35           HB       ILE  35  -4.957   7.717  -1.385
  249   1HG1  ILE  35          HG12      ILE  35  -4.160   5.480  -1.141
  250   2HG1  ILE  35          HG11      ILE  35  -4.776   5.611  -2.785
  251   1HG2  ILE  35          HG21      ILE  35  -3.962   7.399  -4.095
  252   2HG2  ILE  35          HG22      ILE  35  -3.540   8.959  -3.391
  253   3HG2  ILE  35          HG23      ILE  35  -5.228   8.454  -3.465
  254   1HD1  ILE  35          HD11      ILE  35  -2.849   4.766  -3.462
  255   2HD1  ILE  35          HD12      ILE  35  -2.138   4.936  -1.858
  256   3HD1  ILE  35          HD13      ILE  35  -2.095   6.287  -2.989
  257    H    SER  36           HN       SER  36  -3.112  10.370  -2.093
  258    HA   SER  36           HA       SER  36  -4.224  11.429   0.404
  259   1HB   SER  36          HB2       SER  36  -1.727  12.286  -0.964
  260   2HB   SER  36          HB1       SER  36  -2.771  13.561  -0.338
  261    HG   SER  36           HG       SER  36  -1.200  12.802   1.188
  262    H    ALA  37           HN       ALA  37  -5.222  10.690  -2.334
  263    HA   ALA  37           HA       ALA  37  -7.089  12.750  -2.663
  264   1HB   ALA  37          HB1       ALA  37  -5.563  14.204  -3.606
  265   2HB   ALA  37          HB2       ALA  37  -6.232  13.407  -5.030
  266   3HB   ALA  37          HB3       ALA  37  -4.662  12.909  -4.397
  267    H    SER  38           HN       SER  38  -5.219  10.327  -4.435
  268    HA   SER  38           HA       SER  38  -7.114   8.425  -4.796
  269   1HB   SER  38          HB2       SER  38  -7.666  10.730  -6.510
  270   2HB   SER  38          HB1       SER  38  -7.546   9.217  -7.406
  271    HG   SER  38           HG       SER  38  -9.518  10.094  -5.773
  272    H    THR  39           HN       THR  39  -5.005  10.271  -6.998
  273    HA   THR  39           HA       THR  39  -3.924   7.830  -8.109
  274    HB   THR  39           HB       THR  39  -4.330   9.769  -9.556
  275    HG1  THR  39           HG1      THR  39  -2.626   8.331 -10.086
  276   1HG2  THR  39          HG21      THR  39  -3.946  11.711  -8.394
  277   2HG2  THR  39          HG22      THR  39  -2.500  11.597  -9.397
  278   3HG2  THR  39          HG23      THR  39  -2.436  11.124  -7.698
  279    H    CYS  40           HN       CYS  40  -1.461   7.736  -8.387
  280    HA   CYS  40           HA       CYS  40  -0.308   7.705  -5.755
  281   1HB   CYS  40          HB2       CYS  40   0.546   6.788  -8.471
  282   2HB   CYS  40          HB1       CYS  40   1.758   6.954  -7.205
  283    HA   PRO  41           HA       PRO  41   1.747  11.611  -5.960
  284   1HB   PRO  41          HB2       PRO  41   3.694  11.226  -4.127
  285   2HB   PRO  41          HB1       PRO  41   1.993  11.408  -3.684
  286   1HG   PRO  41          HG2       PRO  41   3.636   8.923  -3.910
  287   2HG   PRO  41          HG1       PRO  41   2.420   9.359  -2.699
  288   1HD   PRO  41          HD2       PRO  41   1.931   7.688  -4.809
  289   2HD   PRO  41          HD1       PRO  41   0.682   8.662  -4.013
  290    H    SER  42           HN       SER  42   4.074   8.902  -5.747
  291    HA   SER  42           HA       SER  42   6.114  10.306  -7.141
  292   1HB   SER  42          HB2       SER  42   6.812   8.578  -5.654
  293   2HB   SER  42          HB1       SER  42   5.756   7.394  -6.423
  294    HG   SER  42           HG       SER  42   7.093   7.321  -8.162
  295    H    ASP  43           HN       ASP  43   4.840   7.174  -8.202
  296    HA   ASP  43           HA       ASP  43   3.647   7.979 -10.580
  297   1HB   ASP  43          HB2       ASP  43   5.482   7.275 -12.192
  298   2HB   ASP  43          HB1       ASP  43   5.715   8.823 -11.386
  299    H    TYR  44           HN       TYR  44   3.342   5.991  -8.537
  300    HA   TYR  44           HA       TYR  44   3.920   3.473  -9.882
  301   1HB   TYR  44          HB2       TYR  44   2.458   3.747  -7.268
  302   2HB   TYR  44          HB1       TYR  44   3.373   2.375  -7.869
  303    HD1  TYR  44           HD1      TYR  44   3.702   3.547  -5.140
  304    HD2  TYR  44           HD2      TYR  44   5.681   4.429  -8.803
  305    HE1  TYR  44           HE1      TYR  44   5.670   4.317  -3.885
  306    HE2  TYR  44           HE2      TYR  44   7.655   5.201  -7.555
  307    HH   TYR  44           HH       TYR  44   7.908   6.196  -4.941
  308    HA   PRO  45           HA       PRO  45  -0.023   3.089 -11.808
  309   1HB   PRO  45          HB2       PRO  45   0.109   0.204 -11.173
  310   2HB   PRO  45          HB1       PRO  45  -0.016   1.007 -12.741
  311   1HG   PRO  45          HG2       PRO  45   2.265  -0.140 -11.956
  312   2HG   PRO  45          HG1       PRO  45   2.262   1.366 -12.892
  313   1HD   PRO  45          HD2       PRO  45   2.700   0.953  -9.960
  314   2HD   PRO  45          HD1       PRO  45   3.519   2.062 -11.081
  315    H    LYS  46           HN       LYS  46   0.468   1.524  -8.685
  316    HA   LYS  46           HA       LYS  46  -2.284   1.033  -8.180
  317   1HB   LYS  46          HB2       LYS  46   0.213   0.576  -6.859
  318   2HB   LYS  46          HB1       LYS  46  -0.903   1.310  -5.718
  319   1HG   LYS  46          HG2       LYS  46  -2.035  -0.861  -7.333
  320   2HG   LYS  46          HG1       LYS  46  -0.748  -1.336  -6.224
  321   1HD   LYS  46          HD2       LYS  46  -2.975   0.410  -5.263
  322   2HD   LYS  46          HD1       LYS  46  -3.225  -1.329  -5.413
  323   1HE   LYS  46          HE2       LYS  46  -0.797  -1.148  -4.123
  324   2HE   LYS  46          HE1       LYS  46  -1.718   0.185  -3.430
  325   1HZ   LYS  46          HZ1       LYS  46  -3.243  -1.219  -2.511
  326   2HZ   LYS  46          HZ2       LYS  46  -1.870  -2.203  -2.428
  327   3HZ   LYS  46          HZ3       LYS  46  -3.007  -2.438  -3.659
  Start of MODEL   13
    1   1H    LYS   1          HT1       LYS   1  -7.362   1.342   0.056
    2   2H    LYS   1          HT2       LYS   1  -6.173   2.554   0.307
    3   3H    LYS   1          HT3       LYS   1  -5.843   0.923   0.731
    4    HA   LYS   1           HA       LYS   1  -6.241   0.399  -1.670
    5   1HB   LYS   1          HB2       LYS   1  -6.563   3.291  -1.567
    6   2HB   LYS   1          HB1       LYS   1  -5.339   2.817  -2.736
    7   1HG   LYS   1          HG2       LYS   1  -8.246   2.080  -2.676
    8   2HG   LYS   1          HG1       LYS   1  -7.352   2.934  -3.933
    9   1HD   LYS   1          HD2       LYS   1  -7.353   0.012  -3.265
   10   2HD   LYS   1          HD1       LYS   1  -7.625   0.798  -4.820
   11   1HE   LYS   1          HE2       LYS   1  -5.138   1.604  -4.457
   12   2HE   LYS   1          HE1       LYS   1  -5.071   0.186  -3.412
   13   1HZ   LYS   1          HZ1       LYS   1  -4.875   0.279  -6.192
   14   2HZ   LYS   1          HZ2       LYS   1  -6.314  -0.526  -5.828
   15   3HZ   LYS   1          HZ3       LYS   1  -4.851  -1.086  -5.194
   16    H    SER   2           HN       SER   2  -4.104   3.031  -0.585
   17    HA   SER   2           HA       SER   2  -1.874   3.063  -0.124
   18   1HB   SER   2          HB2       SER   2  -0.733   1.151   0.434
   19   2HB   SER   2          HB1       SER   2  -2.384   0.538   0.529
   20    HG   SER   2           HG       SER   2  -1.723  -0.867  -0.878
   21    H    CYS   3           HN       CYS   3   0.106   3.248  -1.253
   22    HA   CYS   3           HA       CYS   3  -0.087   2.842  -4.168
   23   1HB   CYS   3          HB2       CYS   3  -0.283   5.281  -3.053
   24   2HB   CYS   3          HB1       CYS   3   1.470   5.158  -3.138
   25    H    CYS   4           HN       CYS   4   1.552   1.617  -4.940
   26    HA   CYS   4           HA       CYS   4   4.175   1.832  -3.662
   27   1HB   CYS   4          HB2       CYS   4   2.467  -0.321  -3.145
   28   2HB   CYS   4          HB1       CYS   4   3.633  -0.938  -4.310
   29    HA   PRO   5           HA       PRO   5   5.517   1.413  -7.849
   30   1HB   PRO   5          HB2       PRO   5   8.135   1.143  -7.481
   31   2HB   PRO   5          HB1       PRO   5   7.290   2.604  -6.958
   32   1HG   PRO   5          HG2       PRO   5   8.313   0.327  -5.342
   33   2HG   PRO   5          HG1       PRO   5   8.197   2.044  -4.920
   34   1HD   PRO   5          HD2       PRO   5   6.388  -0.015  -4.207
   35   2HD   PRO   5          HD1       PRO   5   6.160   1.728  -3.977
   36    H    ASN   6           HN       ASN   6   5.276  -1.335  -5.989
   37    HA   ASN   6           HA       ASN   6   5.729  -3.027  -8.251
   38   1HB   ASN   6          HB2       ASN   6   7.785  -2.840  -6.108
   39   2HB   ASN   6          HB1       ASN   6   7.402  -4.443  -6.726
   40   1HD2  ASN   6          HD21      ASN   6   9.517  -2.053  -7.034
   41   2HD2  ASN   6          HD22      ASN   6   9.954  -2.216  -8.697
   42    H    THR   7           HN       THR   7   4.920  -5.120  -7.986
   43    HA   THR   7           HA       THR   7   2.750  -5.411  -6.265
   44    HB   THR   7           HB       THR   7   2.865  -6.732  -8.262
   45    HG1  THR   7           HG1      THR   7   1.852  -8.236  -7.245
   46   1HG2  THR   7          HG21      THR   7   4.491  -8.732  -8.255
   47   2HG2  THR   7          HG22      THR   7   5.441  -7.743  -7.146
   48   3HG2  THR   7          HG23      THR   7   5.075  -7.150  -8.766
   49    H    THR   8           HN       THR   8   6.123  -6.109  -5.801
   50    HA   THR   8           HA       THR   8   6.018  -7.928  -3.699
   51    HB   THR   8           HB       THR   8   8.198  -6.552  -3.003
   52    HG1  THR   8           HG1      THR   8   7.530  -4.898  -4.610
   53   1HG2  THR   8          HG21      THR   8   8.079  -8.847  -4.031
   54   2HG2  THR   8          HG22      THR   8   9.510  -7.892  -4.423
   55   3HG2  THR   8          HG23      THR   8   8.206  -8.053  -5.600
   56    H    GLY   9           HN       GLY   9   5.366  -4.510  -3.762
   57   1HA   GLY   9          HA2       GLY   9   5.307  -4.356  -0.842
   58   2HA   GLY   9          HA1       GLY   9   5.104  -3.009  -1.957
   59    H    ARG  10           HN       ARG  10   3.166  -3.884  -3.625
   60    HA   ARG  10           HA       ARG  10   0.797  -3.347  -2.300
   61   1HB   ARG  10          HB2       ARG  10   1.176  -3.222  -4.753
   62   2HB   ARG  10          HB1       ARG  10   1.146  -4.979  -4.816
   63   1HG   ARG  10          HG2       ARG  10  -0.998  -4.554  -5.370
   64   2HG   ARG  10          HG1       ARG  10  -1.168  -4.621  -3.616
   65   1HD   ARG  10          HD2       ARG  10  -2.050  -2.576  -3.705
   66   2HD   ARG  10          HD1       ARG  10  -0.459  -1.983  -4.178
   67    HE   ARG  10           HE       ARG  10  -1.635  -2.897  -6.483
   68   1HH1  ARG  10          HH11      ARG  10  -2.360  -0.488  -4.071
   69   2HH1  ARG  10          HH12      ARG  10  -3.196   0.549  -5.176
   70   1HH2  ARG  10          HH21      ARG  10  -2.733  -1.539  -7.943
   71   2HH2  ARG  10          HH22      ARG  10  -3.405  -0.046  -7.379
   72    H    ASN  11           HN       ASN  11   2.562  -6.320  -2.618
   73    HA   ASN  11           HA       ASN  11   0.453  -8.119  -2.036
   74   1HB   ASN  11          HB2       ASN  11   3.448  -8.260  -2.047
   75   2HB   ASN  11          HB1       ASN  11   2.513  -9.582  -1.372
   76   1HD2  ASN  11          HD21      ASN  11   4.208  -9.082  -3.876
   77   2HD2  ASN  11          HD22      ASN  11   3.243  -9.741  -5.148
   78    H    ILE  12           HN       ILE  12   3.114  -6.865   0.010
   79    HA   ILE  12           HA       ILE  12   2.158  -8.087   2.362
   80    HB   ILE  12           HB       ILE  12   3.965  -5.704   1.975
   81   1HG1  ILE  12          HG12      ILE  12   5.443  -7.636   3.169
   82   2HG1  ILE  12          HG11      ILE  12   4.302  -8.628   2.266
   83   1HG2  ILE  12          HG21      ILE  12   4.556  -6.042   4.401
   84   2HG2  ILE  12          HG22      ILE  12   3.106  -7.037   4.535
   85   3HG2  ILE  12          HG23      ILE  12   2.970  -5.333   4.098
   86   1HD1  ILE  12          HD11      ILE  12   6.630  -7.354   1.336
   87   2HD1  ILE  12          HD12      ILE  12   5.255  -6.559   0.572
   88   3HD1  ILE  12          HD13      ILE  12   5.460  -8.303   0.419
   89    H    TYR  13           HN       TYR  13   1.609  -4.865   1.006
   90    HA   TYR  13           HA       TYR  13   0.119  -3.871   3.163
   91   1HB   TYR  13          HB2       TYR  13   1.123  -2.762   0.973
   92   2HB   TYR  13          HB1       TYR  13  -0.510  -3.027   0.385
   93    HD1  TYR  13           HD1      TYR  13   1.617  -0.831   2.141
   94    HD2  TYR  13           HD2      TYR  13  -2.425  -2.142   1.944
   95    HE1  TYR  13           HE1      TYR  13   0.901   1.226   3.280
   96    HE2  TYR  13           HE2      TYR  13  -3.152  -0.087   3.080
   97    HH   TYR  13           HH       TYR  13  -0.911   2.102   4.532
   98    H    ASN  14           HN       ASN  14  -0.858  -5.528   0.183
   99    HA   ASN  14           HA       ASN  14  -3.630  -5.420   0.667
  100   1HB   ASN  14          HB2       ASN  14  -1.840  -6.997  -1.131
  101   2HB   ASN  14          HB1       ASN  14  -3.517  -7.483  -0.954
  102   1HD2  ASN  14          HD21      ASN  14  -1.841  -4.363  -1.178
  103   2HD2  ASN  14          HD22      ASN  14  -2.812  -3.744  -2.464
  104    H    THR  15           HN       THR  15  -1.297  -8.118   1.090
  105    HA   THR  15           HA       THR  15  -3.156  -9.869   2.273
  106    HB   THR  15           HB       THR  15  -1.016 -10.646   1.411
  107    HG1  THR  15           HG1      THR  15  -1.789 -12.052   2.865
  108   1HG2  THR  15          HG21      THR  15   1.030 -10.048   2.118
  109   2HG2  THR  15          HG22      THR  15   0.508  -9.829   3.789
  110   3HG2  THR  15          HG23      THR  15   0.191  -8.572   2.594
  111    H    CYS  16           HN       CYS  16  -0.976  -7.467   3.658
  112    HA   CYS  16           HA       CYS  16  -1.291  -7.967   6.356
  113   1HB   CYS  16          HB2       CYS  16   0.283  -6.335   5.816
  114   2HB   CYS  16          HB1       CYS  16  -0.811  -5.498   4.729
  115    H    ARG  17           HN       ARG  17  -3.198  -5.744   4.320
  116    HA   ARG  17           HA       ARG  17  -5.119  -5.115   6.269
  117   1HB   ARG  17          HB2       ARG  17  -4.798  -4.754   3.381
  118   2HB   ARG  17          HB1       ARG  17  -6.477  -4.933   3.870
  119   1HG   ARG  17          HG2       ARG  17  -5.614  -3.161   5.715
  120   2HG   ARG  17          HG1       ARG  17  -4.592  -2.732   4.342
  121   1HD   ARG  17          HD2       ARG  17  -6.522  -1.396   4.137
  122   2HD   ARG  17          HD1       ARG  17  -6.712  -2.691   2.956
  123    HE   ARG  17           HE       ARG  17  -8.542  -3.427   4.114
  124   1HH1  ARG  17          HH11      ARG  17  -6.716  -1.265   6.158
  125   2HH1  ARG  17          HH12      ARG  17  -7.918  -1.227   7.404
  126   1HH2  ARG  17          HH21      ARG  17 -10.124  -3.377   5.751
  127   2HH2  ARG  17          HH22      ARG  17  -9.853  -2.427   7.173
  128    H    LEU  18           HN       LEU  18  -4.887  -7.732   3.922
  129    HA   LEU  18           HA       LEU  18  -7.488  -8.761   4.255
  130   1HB   LEU  18          HB2       LEU  18  -4.970  -9.625   3.037
  131   2HB   LEU  18          HB1       LEU  18  -5.939 -10.954   3.642
  132    HG   LEU  18           HG       LEU  18  -6.808  -8.882   1.626
  133   1HD1  LEU  18          HD11      LEU  18  -5.231 -10.604   0.804
  134   2HD1  LEU  18          HD12      LEU  18  -6.822 -10.699   0.051
  135   3HD1  LEU  18          HD13      LEU  18  -6.374 -11.847   1.312
  136   1HD2  LEU  18          HD21      LEU  18  -8.757  -9.383   2.810
  137   2HD2  LEU  18          HD22      LEU  18  -8.299 -11.072   3.030
  138   3HD2  LEU  18          HD23      LEU  18  -8.794 -10.493   1.440
  139    H    GLY  19           HN       GLY  19  -4.784  -8.778   6.330
  140   1HA   GLY  19          HA2       GLY  19  -5.937 -10.983   7.899
  141   2HA   GLY  19          HA1       GLY  19  -4.258 -10.474   7.977
  142    H    GLY  20           HN       GLY  20  -6.614  -7.972   7.802
  143   1HA   GLY  20          HA2       GLY  20  -7.429  -6.496   9.364
  144   2HA   GLY  20          HA1       GLY  20  -7.135  -7.724  10.585
  145    H    GLY  21           HN       GLY  21  -5.202  -5.626   8.450
  146   1HA   GLY  21          HA2       GLY  21  -3.663  -4.800  10.815
  147   2HA   GLY  21          HA1       GLY  21  -2.839  -5.311   9.349
  148    H    SER  22           HN       SER  22  -3.653  -2.701  11.032
  149    HA   SER  22           HA       SER  22  -4.880  -0.816   9.545
  150   1HB   SER  22          HB2       SER  22  -2.339   0.200  10.603
  151   2HB   SER  22          HB1       SER  22  -3.993   0.671  10.987
  152    HG   SER  22           HG       SER  22  -2.466  -1.448  12.062
  153    H    ARG  23           HN       ARG  23  -4.205   0.828   8.080
  154    HA   ARG  23           HA       ARG  23  -2.831  -0.156   5.842
  155   1HB   ARG  23          HB2       ARG  23  -4.255   2.248   6.595
  156   2HB   ARG  23          HB1       ARG  23  -2.845   2.626   5.619
  157   1HG   ARG  23          HG2       ARG  23  -3.794   1.853   3.757
  158   2HG   ARG  23          HG1       ARG  23  -4.386   0.398   4.560
  159   1HD   ARG  23          HD2       ARG  23  -6.272   1.658   3.783
  160   2HD   ARG  23          HD1       ARG  23  -6.220   1.755   5.542
  161    HE   ARG  23           HE       ARG  23  -5.857   4.012   5.378
  162   1HH1  ARG  23          HH11      ARG  23  -5.344   2.548   2.252
  163   2HH1  ARG  23          HH12      ARG  23  -5.218   4.062   1.424
  164   1HH2  ARG  23          HH21      ARG  23  -5.691   6.006   4.290
  165   2HH2  ARG  23          HH22      ARG  23  -5.414   6.027   2.580
  166    H    GLU  24           HN       GLU  24  -1.862   1.935   8.469
  167    HA   GLU  24           HA       GLU  24   0.664   2.648   7.375
  168   1HB   GLU  24          HB2       GLU  24   0.172   2.661  10.321
  169   2HB   GLU  24          HB1       GLU  24   1.009   3.842   9.321
  170   1HG   GLU  24          HG2       GLU  24  -1.313   4.297   8.306
  171   2HG   GLU  24          HG1       GLU  24  -1.927   3.467   9.735
  172    H    ARG  25           HN       ARG  25  -0.415   0.078   9.540
  173    HA   ARG  25           HA       ARG  25   2.048  -0.815  10.457
  174   1HB   ARG  25          HB2       ARG  25  -0.138  -1.636  11.274
  175   2HB   ARG  25          HB1       ARG  25  -0.358  -2.509   9.764
  176   1HG   ARG  25          HG2       ARG  25   1.752  -3.761  10.300
  177   2HG   ARG  25          HG1       ARG  25   1.693  -3.016  11.899
  178   1HD   ARG  25          HD2       ARG  25  -0.211  -4.169  12.513
  179   2HD   ARG  25          HD1       ARG  25  -0.708  -4.440  10.843
  180    HE   ARG  25           HE       ARG  25   0.554  -6.351  10.810
  181   1HH1  ARG  25          HH11      ARG  25   1.468  -4.436  13.581
  182   2HH1  ARG  25          HH12      ARG  25   2.469  -5.673  14.263
  183   1HH2  ARG  25          HH21      ARG  25   1.869  -7.978  11.706
  184   2HH2  ARG  25          HH22      ARG  25   2.698  -7.685  13.198
  185    H    CYS  26           HN       CYS  26   0.309  -1.718   7.506
  186    HA   CYS  26           HA       CYS  26   2.319  -3.534   6.617
  187   1HB   CYS  26          HB2       CYS  26   0.713  -2.378   4.467
  188   2HB   CYS  26          HB1       CYS  26   0.898  -4.053   4.958
  189    H    ALA  27           HN       ALA  27   1.617  -0.135   6.036
  190    HA   ALA  27           HA       ALA  27   3.361   0.377   3.943
  191   1HB   ALA  27          HB1       ALA  27   1.699   1.905   5.410
  192   2HB   ALA  27          HB2       ALA  27   2.925   2.564   4.327
  193   3HB   ALA  27          HB3       ALA  27   3.253   2.438   6.055
  194    H    SER  28           HN       SER  28   4.023   0.458   7.439
  195    HA   SER  28           HA       SER  28   6.786   1.040   7.126
  196   1HB   SER  28          HB2       SER  28   5.515   1.533   9.205
  197   2HB   SER  28          HB1       SER  28   5.375  -0.199   9.501
  198    HG   SER  28           HG       SER  28   7.252  -0.057  10.409
  199    H    LEU  29           HN       LEU  29   4.878  -1.831   7.053
  200    HA   LEU  29           HA       LEU  29   6.924  -3.716   7.621
  201   1HB   LEU  29          HB2       LEU  29   4.223  -3.835   7.377
  202   2HB   LEU  29          HB1       LEU  29   4.713  -4.541   5.850
  203    HG   LEU  29           HG       LEU  29   4.291  -6.205   7.652
  204   1HD1  LEU  29          HD11      LEU  29   5.834  -7.610   6.799
  205   2HD1  LEU  29          HD12      LEU  29   7.170  -6.497   7.092
  206   3HD1  LEU  29          HD13      LEU  29   6.122  -6.267   5.692
  207   1HD2  LEU  29          HD21      LEU  29   5.636  -6.386   9.544
  208   2HD2  LEU  29          HD22      LEU  29   5.329  -4.654   9.421
  209   3HD2  LEU  29          HD23      LEU  29   6.873  -5.316   8.886
  210    H    SER  30           HN       SER  30   5.354  -2.833   4.539
  211    HA   SER  30           HA       SER  30   7.519  -4.089   3.067
  212   1HB   SER  30          HB2       SER  30   4.807  -3.793   2.580
  213   2HB   SER  30          HB1       SER  30   5.555  -2.655   1.460
  214    HG   SER  30           HG       SER  30   6.739  -4.318   0.581
  215    H    GLY  31           HN       GLY  31   6.016  -0.872   3.284
  216   1HA   GLY  31          HA2       GLY  31   7.610   1.013   3.500
  217   2HA   GLY  31          HA1       GLY  31   8.540   0.242   2.225
  218    H    CYS  32           HN       CYS  32   5.109   0.150   1.914
  219    HA   CYS  32           HA       CYS  32   5.173   1.602  -0.524
  220   1HB   CYS  32          HB2       CYS  32   2.899   0.607   1.200
  221   2HB   CYS  32          HB1       CYS  32   2.665   1.384  -0.356
  222    H    LYS  33           HN       LYS  33   3.126   3.272  -0.665
  223    HA   LYS  33           HA       LYS  33   3.591   5.284   1.431
  224   1HB   LYS  33          HB2       LYS  33   4.704   5.769  -0.798
  225   2HB   LYS  33          HB1       LYS  33   3.088   5.928  -1.471
  226   1HG   LYS  33          HG2       LYS  33   4.139   8.084  -0.870
  227   2HG   LYS  33          HG1       LYS  33   2.607   7.792  -0.047
  228   1HD   LYS  33          HD2       LYS  33   4.879   6.782   1.455
  229   2HD   LYS  33          HD1       LYS  33   5.007   8.512   1.135
  230   1HE   LYS  33          HE2       LYS  33   2.330   7.955   1.903
  231   2HE   LYS  33          HE1       LYS  33   3.403   7.171   3.062
  232   1HZ   LYS  33          HZ1       LYS  33   3.509  10.035   2.280
  233   2HZ   LYS  33          HZ2       LYS  33   4.524   9.280   3.403
  234   3HZ   LYS  33          HZ3       LYS  33   2.870   9.432   3.727
  235    H    ILE  34           HN       ILE  34   1.823   5.972   2.426
  236    HA   ILE  34           HA       ILE  34  -0.751   5.001   1.658
  237    HB   ILE  34           HB       ILE  34   0.047   5.405   4.034
  238   1HG1  ILE  34          HG12      ILE  34  -2.289   6.451   4.650
  239   2HG1  ILE  34          HG11      ILE  34  -2.598   6.255   2.926
  240   1HG2  ILE  34          HG21      ILE  34  -0.821   8.242   3.569
  241   2HG2  ILE  34          HG22      ILE  34   0.868   7.744   3.489
  242   3HG2  ILE  34          HG23      ILE  34  -0.037   7.550   4.990
  243   1HD1  ILE  34          HD11      ILE  34  -3.307   4.381   4.517
  244   2HD1  ILE  34          HD12      ILE  34  -1.591   3.978   4.583
  245   3HD1  ILE  34          HD13      ILE  34  -2.447   3.941   3.042
  246    H    ILE  35           HN       ILE  35  -2.142   5.901   0.293
  247    HA   ILE  35           HA       ILE  35  -1.770   8.732  -0.414
  248    HB   ILE  35           HB       ILE  35  -3.366   7.852  -2.392
  249   1HG1  ILE  35          HG12      ILE  35  -2.424   5.649  -3.161
  250   2HG1  ILE  35          HG11      ILE  35  -1.688   5.476  -1.571
  251   1HG2  ILE  35          HG21      ILE  35  -0.859   8.830  -2.189
  252   2HG2  ILE  35          HG22      ILE  35  -1.614   8.350  -3.708
  253   3HG2  ILE  35          HG23      ILE  35  -0.533   7.237  -2.870
  254   1HD1  ILE  35          HD11      ILE  35  -4.585   6.027  -1.627
  255   2HD1  ILE  35          HD12      ILE  35  -3.646   4.967  -0.575
  256   3HD1  ILE  35          HD13      ILE  35  -4.061   4.446  -2.207
  257    H    SER  36           HN       SER  36  -3.996   9.514  -1.499
  258    HA   SER  36           HA       SER  36  -6.308   8.710   0.052
  259   1HB   SER  36          HB2       SER  36  -6.738  10.894   0.999
  260   2HB   SER  36          HB1       SER  36  -5.118  10.389   1.479
  261    HG   SER  36           HG       SER  36  -4.247  11.861   0.165
  262    H    ALA  37           HN       ALA  37  -8.256   9.311  -0.886
  263    HA   ALA  37           HA       ALA  37  -9.696   9.922  -2.539
  264   1HB   ALA  37          HB1       ALA  37  -8.324  12.149  -2.114
  265   2HB   ALA  37          HB2       ALA  37  -9.502  12.013  -3.420
  266   3HB   ALA  37          HB3       ALA  37  -7.781  11.832  -3.762
  267    H    SER  38           HN       SER  38  -7.340   7.982  -2.947
  268    HA   SER  38           HA       SER  38  -6.871   6.446  -4.569
  269   1HB   SER  38          HB2       SER  38  -9.193   7.654  -5.587
  270   2HB   SER  38          HB1       SER  38  -8.035   7.669  -6.916
  271    HG   SER  38           HG       SER  38  -8.763   5.400  -5.371
  272    H    THR  39           HN       THR  39  -6.887   9.734  -5.962
  273    HA   THR  39           HA       THR  39  -4.963   9.572  -7.844
  274    HB   THR  39           HB       THR  39  -5.976  11.668  -7.557
  275    HG1  THR  39           HG1      THR  39  -3.779  11.875  -8.111
  276   1HG2  THR  39          HG21      THR  39  -5.425  11.269  -4.724
  277   2HG2  THR  39          HG22      THR  39  -6.703  12.189  -5.519
  278   3HG2  THR  39          HG23      THR  39  -5.109  12.908  -5.292
  279    H    CYS  40           HN       CYS  40  -2.841   9.213  -7.999
  280    HA   CYS  40           HA       CYS  40  -1.267   9.101  -5.508
  281   1HB   CYS  40          HB2       CYS  40  -1.594   7.133  -7.682
  282   2HB   CYS  40          HB1       CYS  40   0.064   7.392  -7.153
  283    HA   PRO  41           HA       PRO  41   1.727  11.910  -7.062
  284   1HB   PRO  41          HB2       PRO  41   3.777   9.829  -6.452
  285   2HB   PRO  41          HB1       PRO  41   3.694  11.515  -5.928
  286   1HG   PRO  41          HG2       PRO  41   3.094   9.552  -4.245
  287   2HG   PRO  41          HG1       PRO  41   2.148  11.051  -4.258
  288   1HD   PRO  41          HD2       PRO  41   1.460   8.368  -5.380
  289   2HD   PRO  41          HD1       PRO  41   0.419   9.554  -4.570
  290    H    SER  42           HN       SER  42   4.366  10.483  -8.010
  291    HA   SER  42           HA       SER  42   4.257  10.885 -10.663
  292   1HB   SER  42          HB2       SER  42   5.757   8.791  -9.107
  293   2HB   SER  42          HB1       SER  42   5.960   8.954 -10.851
  294    HG   SER  42           HG       SER  42   6.268  11.112  -9.041
  295    H    ASP  43           HN       ASP  43   4.237   7.460  -9.714
  296    HA   ASP  43           HA       ASP  43   1.742   6.794 -10.789
  297   1HB   ASP  43          HB2       ASP  43   3.907   7.093 -12.749
  298   2HB   ASP  43          HB1       ASP  43   3.076   5.544 -12.840
  299    H    TYR  44           HN       TYR  44   2.916   5.950  -8.530
  300    HA   TYR  44           HA       TYR  44   3.682   3.180  -9.121
  301   1HB   TYR  44          HB2       TYR  44   5.022   3.150  -7.133
  302   2HB   TYR  44          HB1       TYR  44   5.488   4.555  -8.076
  303    HD1  TYR  44           HD1      TYR  44   4.604   3.385  -4.876
  304    HD2  TYR  44           HD2      TYR  44   4.289   6.795  -7.398
  305    HE1  TYR  44           HE1      TYR  44   4.242   4.803  -2.901
  306    HE2  TYR  44           HE2      TYR  44   3.926   8.221  -5.430
  307    HH   TYR  44           HH       TYR  44   4.433   8.164  -2.995
  308    HA   PRO  45           HA       PRO  45  -0.345   3.303  -6.713
  309   1HB   PRO  45          HB2       PRO  45  -1.849   1.927  -8.479
  310   2HB   PRO  45          HB1       PRO  45  -1.624   3.678  -8.588
  311   1HG   PRO  45          HG2       PRO  45  -0.235   1.493 -10.096
  312   2HG   PRO  45          HG1       PRO  45  -0.891   3.024 -10.701
  313   1HD   PRO  45          HD2       PRO  45   1.744   2.666 -10.181
  314   2HD   PRO  45          HD1       PRO  45   0.933   4.233  -9.991
  315    H    LYS  46           HN       LYS  46   1.525   0.829  -8.299
  316    HA   LYS  46           HA       LYS  46   0.924  -1.007  -6.132
  317   1HB   LYS  46          HB2       LYS  46  -0.754  -1.618  -7.742
  318   2HB   LYS  46          HB1       LYS  46   0.445  -1.677  -9.018
  319   1HG   LYS  46          HG2       LYS  46   1.535  -3.570  -7.871
  320   2HG   LYS  46          HG1       LYS  46   0.250  -3.535  -6.663
  321   1HD   LYS  46          HD2       LYS  46  -1.387  -3.852  -8.545
  322   2HD   LYS  46          HD1       LYS  46  -0.004  -4.133  -9.605
  323   1HE   LYS  46          HE2       LYS  46   0.402  -6.183  -8.751
  324   2HE   LYS  46          HE1       LYS  46  -0.041  -5.703  -7.113
  325   1HZ   LYS  46          HZ1       LYS  46  -2.240  -6.164  -7.477
  326   2HZ   LYS  46          HZ2       LYS  46  -1.524  -7.349  -8.447
  327   3HZ   LYS  46          HZ3       LYS  46  -2.142  -5.941  -9.151
  Start of MODEL   14
    1   1H    LYS   1          HT1       LYS   1  -6.660   1.481  -1.598
    2   2H    LYS   1          HT2       LYS   1  -6.407  -0.207  -1.431
    3   3H    LYS   1          HT3       LYS   1  -7.717   0.376  -2.372
    4    HA   LYS   1           HA       LYS   1  -6.009  -0.366  -3.794
    5   1HB   LYS   1          HB2       LYS   1  -7.258   2.085  -3.834
    6   2HB   LYS   1          HB1       LYS   1  -5.571   2.523  -4.062
    7   1HG   LYS   1          HG2       LYS   1  -5.763   0.498  -5.818
    8   2HG   LYS   1          HG1       LYS   1  -7.420   1.098  -5.856
    9   1HD   LYS   1          HD2       LYS   1  -6.207   2.249  -7.556
   10   2HD   LYS   1          HD1       LYS   1  -6.486   3.392  -6.242
   11   1HE   LYS   1          HE2       LYS   1  -4.225   3.639  -7.008
   12   2HE   LYS   1          HE1       LYS   1  -4.199   2.908  -5.405
   13   1HZ   LYS   1          HZ1       LYS   1  -3.405   1.785  -7.967
   14   2HZ   LYS   1          HZ2       LYS   1  -4.215   0.734  -6.924
   15   3HZ   LYS   1          HZ3       LYS   1  -2.793   1.494  -6.418
   16    H    SER   2           HN       SER   2  -4.818   2.326  -1.789
   17    HA   SER   2           HA       SER   2  -2.749   2.850  -1.021
   18   1HB   SER   2          HB2       SER   2  -2.945   0.015  -0.832
   19   2HB   SER   2          HB1       SER   2  -1.298   0.433  -1.297
   20    HG   SER   2           HG       SER   2  -2.710   1.566   0.886
   21    H    CYS   3           HN       CYS   3  -0.400   2.940  -1.635
   22    HA   CYS   3           HA       CYS   3  -0.123   2.788  -4.566
   23   1HB   CYS   3          HB2       CYS   3   0.161   5.043  -2.768
   24   2HB   CYS   3          HB1       CYS   3   1.641   4.768  -3.680
   25    H    CYS   4           HN       CYS   4   1.356   1.375  -5.168
   26    HA   CYS   4           HA       CYS   4   3.860   1.194  -3.660
   27   1HB   CYS   4          HB2       CYS   4   2.265  -1.211  -4.566
   28   2HB   CYS   4          HB1       CYS   4   3.859  -1.256  -3.826
   29    HA   PRO   5           HA       PRO   5   5.608   1.290  -7.703
   30   1HB   PRO   5          HB2       PRO   5   8.063   0.306  -7.247
   31   2HB   PRO   5          HB1       PRO   5   7.545   1.862  -6.587
   32   1HG   PRO   5          HG2       PRO   5   7.699  -0.807  -5.244
   33   2HG   PRO   5          HG1       PRO   5   8.179   0.785  -4.627
   34   1HD   PRO   5          HD2       PRO   5   5.809  -0.440  -4.004
   35   2HD   PRO   5          HD1       PRO   5   6.042   1.318  -4.000
   36    H    ASN   6           HN       ASN   6   4.581  -1.562  -6.390
   37    HA   ASN   6           HA       ASN   6   4.353  -2.981  -8.715
   38   1HB   ASN   6          HB2       ASN   6   7.079  -3.096  -7.678
   39   2HB   ASN   6          HB1       ASN   6   6.363  -4.696  -7.857
   40   1HD2  ASN   6          HD21      ASN   6   8.491  -3.193  -9.341
   41   2HD2  ASN   6          HD22      ASN   6   8.024  -3.308 -11.000
   42    H    THR   7           HN       THR   7   3.991  -5.368  -8.359
   43    HA   THR   7           HA       THR   7   2.130  -5.821  -6.389
   44    HB   THR   7           HB       THR   7   2.290  -8.164  -6.913
   45    HG1  THR   7           HG1      THR   7   4.204  -8.958  -7.141
   46   1HG2  THR   7          HG21      THR   7   3.135  -7.063  -9.528
   47   2HG2  THR   7          HG22      THR   7   1.683  -6.400  -8.778
   48   3HG2  THR   7          HG23      THR   7   1.787  -8.126  -9.123
   49    H    THR   8           HN       THR   8   5.591  -5.981  -6.158
   50    HA   THR   8           HA       THR   8   5.955  -7.624  -3.961
   51    HB   THR   8           HB       THR   8   7.879  -5.831  -3.493
   52    HG1  THR   8           HG1      THR   8   6.819  -4.430  -5.124
   53   1HG2  THR   8          HG21      THR   8   7.641  -8.061  -5.353
   54   2HG2  THR   8          HG22      THR   8   8.913  -7.672  -4.195
   55   3HG2  THR   8          HG23      THR   8   8.899  -6.902  -5.781
   56    H    GLY   9           HN       GLY   9   5.128  -4.171  -4.045
   57   1HA   GLY   9          HA2       GLY   9   5.063  -4.004  -1.151
   58   2HA   GLY   9          HA1       GLY   9   4.642  -2.724  -2.284
   59    H    ARG  10           HN       ARG  10   2.760  -4.036  -3.818
   60    HA   ARG  10           HA       ARG  10   0.402  -3.646  -2.397
   61   1HB   ARG  10          HB2       ARG  10   0.330  -3.564  -4.771
   62   2HB   ARG  10          HB1       ARG  10   1.039  -5.162  -4.924
   63   1HG   ARG  10          HG2       ARG  10  -1.019  -5.918  -5.222
   64   2HG   ARG  10          HG1       ARG  10  -1.294  -5.608  -3.509
   65   1HD   ARG  10          HD2       ARG  10  -3.036  -4.451  -4.470
   66   2HD   ARG  10          HD1       ARG  10  -1.818  -3.188  -4.313
   67    HE   ARG  10           HE       ARG  10  -1.871  -2.984  -6.578
   68   1HH1  ARG  10          HH11      ARG  10  -2.894  -6.223  -5.765
   69   2HH1  ARG  10          HH12      ARG  10  -3.204  -6.671  -7.408
   70   1HH2  ARG  10          HH21      ARG  10  -2.280  -3.574  -8.739
   71   2HH2  ARG  10          HH22      ARG  10  -2.856  -5.168  -9.096
   72    H    ASN  11           HN       ASN  11   2.416  -6.477  -2.786
   73    HA   ASN  11           HA       ASN  11   0.632  -8.447  -1.911
   74   1HB   ASN  11          HB2       ASN  11   3.607  -8.176  -2.049
   75   2HB   ASN  11          HB1       ASN  11   2.912  -9.533  -1.177
   76   1HD2  ASN  11          HD21      ASN  11   4.348  -8.980  -3.877
   77   2HD2  ASN  11          HD22      ASN  11   3.454  -9.957  -4.986
   78    H    ILE  12           HN       ILE  12   3.173  -6.756  -0.026
   79    HA   ILE  12           HA       ILE  12   2.393  -7.897   2.421
   80    HB   ILE  12           HB       ILE  12   3.851  -5.304   1.908
   81   1HG1  ILE  12          HG12      ILE  12   5.704  -6.968   2.907
   82   2HG1  ILE  12          HG11      ILE  12   4.649  -8.153   2.142
   83   1HG2  ILE  12          HG21      ILE  12   3.205  -6.750   4.449
   84   2HG2  ILE  12          HG22      ILE  12   3.093  -5.028   4.083
   85   3HG2  ILE  12          HG23      ILE  12   4.672  -5.779   4.318
   86   1HD1  ILE  12          HD11      ILE  12   5.017  -6.066   0.296
   87   2HD1  ILE  12          HD12      ILE  12   5.619  -7.722   0.211
   88   3HD1  ILE  12          HD13      ILE  12   6.600  -6.463   0.961
   89    H    TYR  13           HN       TYR  13   1.559  -4.760   0.965
   90    HA   TYR  13           HA       TYR  13  -0.032  -3.890   3.105
   91   1HB   TYR  13          HB2       TYR  13   0.881  -2.622   1.011
   92   2HB   TYR  13          HB1       TYR  13  -0.646  -3.109   0.287
   93    HD1  TYR  13           HD1      TYR  13  -2.792  -2.360   1.351
   94    HD2  TYR  13           HD2      TYR  13   0.991  -0.841   2.564
   95    HE1  TYR  13           HE1      TYR  13  -3.910  -0.461   2.444
   96    HE2  TYR  13           HE2      TYR  13  -0.114   1.060   3.659
   97    HH   TYR  13           HH       TYR  13  -2.261   1.669   4.562
   98    H    ASN  14           HN       ASN  14  -0.788  -5.826   0.248
   99    HA   ASN  14           HA       ASN  14  -3.589  -5.860   0.670
  100   1HB   ASN  14          HB2       ASN  14  -1.675  -7.398  -1.033
  101   2HB   ASN  14          HB1       ASN  14  -3.313  -7.990  -0.836
  102   1HD2  ASN  14          HD21      ASN  14  -1.997  -4.710  -1.125
  103   2HD2  ASN  14          HD22      ASN  14  -2.951  -4.264  -2.493
  104    H    THR  15           HN       THR  15  -1.071  -8.362   1.240
  105    HA   THR  15           HA       THR  15  -2.825 -10.159   2.523
  106    HB   THR  15           HB       THR  15   0.033 -10.061   3.340
  107    HG1  THR  15           HG1      THR  15   0.742 -10.198   1.386
  108   1HG2  THR  15          HG21      THR  15  -0.064 -12.460   2.978
  109   2HG2  THR  15          HG22      THR  15  -1.725 -12.309   2.404
  110   3HG2  THR  15          HG23      THR  15  -1.334 -11.925   4.079
  111    H    CYS  16           HN       CYS  16  -0.853  -7.500   3.709
  112    HA   CYS  16           HA       CYS  16  -1.101  -7.924   6.457
  113   1HB   CYS  16          HB2       CYS  16   0.436  -6.272   5.763
  114   2HB   CYS  16          HB1       CYS  16  -0.764  -5.443   4.784
  115    H    ARG  17           HN       ARG  17  -3.047  -5.744   4.389
  116    HA   ARG  17           HA       ARG  17  -4.990  -5.115   6.290
  117   1HB   ARG  17          HB2       ARG  17  -4.698  -4.911   3.391
  118   2HB   ARG  17          HB1       ARG  17  -6.367  -5.177   3.877
  119   1HG   ARG  17          HG2       ARG  17  -5.630  -3.244   5.624
  120   2HG   ARG  17          HG1       ARG  17  -4.652  -2.823   4.217
  121   1HD   ARG  17          HD2       ARG  17  -6.838  -1.693   4.209
  122   2HD   ARG  17          HD1       ARG  17  -6.627  -2.759   2.821
  123    HE   ARG  17           HE       ARG  17  -8.367  -4.037   3.582
  124   1HH1  ARG  17          HH11      ARG  17  -7.294  -1.943   6.160
  125   2HH1  ARG  17          HH12      ARG  17  -8.610  -2.351   7.207
  126   1HH2  ARG  17          HH21      ARG  17 -10.100  -4.575   4.958
  127   2HH2  ARG  17          HH22      ARG  17 -10.203  -3.845   6.526
  128    H    LEU  18           HN       LEU  18  -4.606  -7.860   4.173
  129    HA   LEU  18           HA       LEU  18  -7.103  -9.062   4.420
  130   1HB   LEU  18          HB2       LEU  18  -4.443  -9.775   3.524
  131   2HB   LEU  18          HB1       LEU  18  -5.234 -11.137   4.291
  132    HG   LEU  18           HG       LEU  18  -6.250  -9.549   1.938
  133   1HD1  LEU  18          HD11      LEU  18  -4.523 -11.021   1.242
  134   2HD1  LEU  18          HD12      LEU  18  -6.053 -11.788   0.814
  135   3HD1  LEU  18          HD13      LEU  18  -5.156 -12.337   2.230
  136   1HD2  LEU  18          HD21      LEU  18  -7.901 -11.629   2.016
  137   2HD2  LEU  18          HD22      LEU  18  -8.245 -10.124   2.868
  138   3HD2  LEU  18          HD23      LEU  18  -7.570 -11.498   3.743
  139    H    GLY  19           HN       GLY  19  -4.568  -8.711   6.710
  140   1HA   GLY  19          HA2       GLY  19  -5.629 -10.839   8.413
  141   2HA   GLY  19          HA1       GLY  19  -4.132  -9.959   8.675
  142    H    GLY  20           HN       GLY  20  -6.457  -7.749   7.837
  143   1HA   GLY  20          HA2       GLY  20  -7.707  -6.227   9.002
  144   2HA   GLY  20          HA1       GLY  20  -7.940  -7.473  10.216
  145    H    GLY  21           HN       GLY  21  -4.992  -5.768   9.118
  146   1HA   GLY  21          HA2       GLY  21  -4.537  -5.046  11.930
  147   2HA   GLY  21          HA1       GLY  21  -3.267  -5.296  10.738
  148    H    SER  22           HN       SER  22  -2.571  -3.198  11.529
  149    HA   SER  22           HA       SER  22  -4.102  -0.854  11.005
  150   1HB   SER  22          HB2       SER  22  -1.261  -0.340  11.086
  151   2HB   SER  22          HB1       SER  22  -2.525   0.166  12.203
  152    HG   SER  22           HG       SER  22  -0.989  -2.203  12.231
  153    H    ARG  23           HN       ARG  23  -3.771   0.727   9.466
  154    HA   ARG  23           HA       ARG  23  -3.237  -0.250   6.842
  155   1HB   ARG  23          HB2       ARG  23  -4.419   2.092   8.027
  156   2HB   ARG  23          HB1       ARG  23  -3.292   2.562   6.762
  157   1HG   ARG  23          HG2       ARG  23  -4.520   1.561   5.104
  158   2HG   ARG  23          HG1       ARG  23  -5.267   0.405   6.207
  159   1HD   ARG  23          HD2       ARG  23  -7.055   1.763   5.971
  160   2HD   ARG  23          HD1       ARG  23  -6.234   2.696   7.223
  161    HE   ARG  23           HE       ARG  23  -5.242   3.640   4.843
  162   1HH1  ARG  23          HH11      ARG  23  -8.401   3.360   6.301
  163   2HH1  ARG  23          HH12      ARG  23  -9.036   4.751   5.488
  164   1HH2  ARG  23          HH21      ARG  23  -6.076   5.470   3.774
  165   2HH2  ARG  23          HH22      ARG  23  -7.716   5.949   4.054
  166    H    GLU  24           HN       GLU  24  -1.628   1.967   9.034
  167    HA   GLU  24           HA       GLU  24   0.536   2.574   7.296
  168   1HB   GLU  24          HB2       GLU  24   0.757   2.826  10.266
  169   2HB   GLU  24          HB1       GLU  24   1.349   3.903   9.008
  170   1HG   GLU  24          HG2       GLU  24  -1.141   4.331   8.510
  171   2HG   GLU  24          HG1       GLU  24  -1.419   3.631  10.104
  172    H    ARG  25           HN       ARG  25  -0.039   0.049   9.635
  173    HA   ARG  25           HA       ARG  25   2.555  -0.748  10.206
  174   1HB   ARG  25          HB2       ARG  25  -0.082  -1.834  10.488
  175   2HB   ARG  25          HB1       ARG  25   0.999  -3.101   9.927
  176   1HG   ARG  25          HG2       ARG  25   1.393  -1.384  12.369
  177   2HG   ARG  25          HG1       ARG  25   0.879  -3.072  12.347
  178   1HD   ARG  25          HD2       ARG  25   2.965  -3.839  11.947
  179   2HD   ARG  25          HD1       ARG  25   3.381  -2.476  10.910
  180    HE   ARG  25           HE       ARG  25   4.384  -1.518  12.711
  181   1HH1  ARG  25          HH11      ARG  25   1.970  -3.749  13.883
  182   2HH1  ARG  25          HH12      ARG  25   2.368  -3.497  15.550
  183   1HH2  ARG  25          HH21      ARG  25   4.909  -1.187  14.902
  184   2HH2  ARG  25          HH22      ARG  25   4.036  -2.042  16.129
  185    H    CYS  26           HN       CYS  26   0.492  -1.671   7.486
  186    HA   CYS  26           HA       CYS  26   2.397  -3.444   6.329
  187   1HB   CYS  26          HB2       CYS  26   0.499  -2.284   4.430
  188   2HB   CYS  26          HB1       CYS  26   0.790  -3.964   4.850
  189    H    ALA  27           HN       ALA  27   1.553  -0.058   5.780
  190    HA   ALA  27           HA       ALA  27   3.191   0.328   3.521
  191   1HB   ALA  27          HB1       ALA  27   1.347   1.841   4.779
  192   2HB   ALA  27          HB2       ALA  27   2.492   2.473   3.595
  193   3HB   ALA  27          HB3       ALA  27   2.826   2.634   5.319
  194    H    SER  28           HN       SER  28   3.817   0.650   6.981
  195    HA   SER  28           HA       SER  28   6.423   1.732   6.692
  196   1HB   SER  28          HB2       SER  28   6.667   1.322   9.069
  197   2HB   SER  28          HB1       SER  28   5.043   1.937   8.763
  198    HG   SER  28           HG       SER  28   5.856  -0.692   9.377
  199    H    LEU  29           HN       LEU  29   5.138  -1.524   7.077
  200    HA   LEU  29           HA       LEU  29   7.658  -2.815   7.336
  201   1HB   LEU  29          HB2       LEU  29   5.041  -3.561   7.658
  202   2HB   LEU  29          HB1       LEU  29   5.475  -4.398   6.180
  203    HG   LEU  29           HG       LEU  29   7.338  -4.643   8.484
  204   1HD1  LEU  29          HD11      LEU  29   4.584  -5.820   8.372
  205   2HD1  LEU  29          HD12      LEU  29   5.403  -5.034   9.722
  206   3HD1  LEU  29          HD13      LEU  29   5.902  -6.645   9.206
  207   1HD2  LEU  29          HD21      LEU  29   8.018  -5.753   6.529
  208   2HD2  LEU  29          HD22      LEU  29   6.398  -6.375   6.217
  209   3HD2  LEU  29          HD23      LEU  29   7.344  -7.015   7.560
  210    H    SER  30           HN       SER  30   5.367  -2.620   4.609
  211    HA   SER  30           HA       SER  30   7.198  -3.806   2.770
  212   1HB   SER  30          HB2       SER  30   4.515  -3.486   2.756
  213   2HB   SER  30          HB1       SER  30   4.986  -2.157   1.698
  214    HG   SER  30           HG       SER  30   6.252  -3.778   0.537
  215    H    GLY  31           HN       GLY  31   6.044  -0.490   3.307
  216   1HA   GLY  31          HA2       GLY  31   7.571   1.367   3.174
  217   2HA   GLY  31          HA1       GLY  31   8.490   0.471   1.972
  218    H    CYS  32           HN       CYS  32   5.008   0.656   1.923
  219    HA   CYS  32           HA       CYS  32   5.112   1.903  -0.694
  220   1HB   CYS  32          HB2       CYS  32   2.932   0.606   0.932
  221   2HB   CYS  32          HB1       CYS  32   2.600   1.451  -0.570
  222    H    LYS  33           HN       LYS  33   3.035   3.382  -1.038
  223    HA   LYS  33           HA       LYS  33   3.096   5.451   1.058
  224   1HB   LYS  33          HB2       LYS  33   3.852   5.647  -1.663
  225   2HB   LYS  33          HB1       LYS  33   2.345   6.535  -1.492
  226   1HG   LYS  33          HG2       LYS  33   4.878   6.969   0.073
  227   2HG   LYS  33          HG1       LYS  33   4.206   8.023  -1.170
  228   1HD   LYS  33          HD2       LYS  33   3.274   9.120   0.552
  229   2HD   LYS  33          HD1       LYS  33   2.105   7.797   0.553
  230   1HE   LYS  33          HE2       LYS  33   2.902   6.928   2.469
  231   2HE   LYS  33          HE1       LYS  33   4.579   7.256   2.037
  232   1HZ   LYS  33          HZ1       LYS  33   3.802   8.536   3.974
  233   2HZ   LYS  33          HZ2       LYS  33   2.661   9.310   2.994
  234   3HZ   LYS  33          HZ3       LYS  33   4.313   9.530   2.702
  235    H    ILE  34           HN       ILE  34   1.164   6.361   1.672
  236    HA   ILE  34           HA       ILE  34  -1.208   4.908   0.832
  237    HB   ILE  34           HB       ILE  34  -0.544   5.467   3.279
  238   1HG1  ILE  34          HG12      ILE  34  -2.926   5.516   3.921
  239   2HG1  ILE  34          HG11      ILE  34  -3.356   5.913   2.260
  240   1HG2  ILE  34          HG21      ILE  34  -2.084   7.980   2.690
  241   2HG2  ILE  34          HG22      ILE  34  -0.323   7.930   2.759
  242   3HG2  ILE  34          HG23      ILE  34  -1.272   7.519   4.187
  243   1HD1  ILE  34          HD11      ILE  34  -3.561   3.479   3.045
  244   2HD1  ILE  34          HD12      ILE  34  -1.805   3.436   2.887
  245   3HD1  ILE  34          HD13      ILE  34  -2.809   3.800   1.483
  246    H    ILE  35           HN       ILE  35  -2.746   5.688  -0.456
  247    HA   ILE  35           HA       ILE  35  -2.577   8.516  -1.248
  248    HB   ILE  35           HB       ILE  35  -4.096   7.493  -3.197
  249   1HG1  ILE  35          HG12      ILE  35  -2.169   5.234  -2.706
  250   2HG1  ILE  35          HG11      ILE  35  -3.813   5.191  -2.075
  251   1HG2  ILE  35          HG21      ILE  35  -1.091   7.458  -3.047
  252   2HG2  ILE  35          HG22      ILE  35  -2.121   8.779  -3.595
  253   3HG2  ILE  35          HG23      ILE  35  -2.013   7.295  -4.540
  254   1HD1  ILE  35          HD11      ILE  35  -3.965   5.890  -4.809
  255   2HD1  ILE  35          HD12      ILE  35  -4.519   4.416  -4.016
  256   3HD1  ILE  35          HD13      ILE  35  -2.881   4.507  -4.662
  257    H    SER  36           HN       SER  36  -4.887   9.090  -2.331
  258    HA   SER  36           HA       SER  36  -7.118   8.123  -0.790
  259   1HB   SER  36          HB2       SER  36  -7.707  10.338   0.149
  260   2HB   SER  36          HB1       SER  36  -6.185   9.723   0.795
  261    HG   SER  36           HG       SER  36  -5.137  11.294  -0.158
  262    H    ALA  37           HN       ALA  37  -5.899  10.577  -2.978
  263    HA   ALA  37           HA       ALA  37  -8.400  11.251  -4.125
  264   1HB   ALA  37          HB1       ALA  37  -5.558  11.797  -4.748
  265   2HB   ALA  37          HB2       ALA  37  -6.916  12.910  -4.566
  266   3HB   ALA  37          HB3       ALA  37  -6.723  11.989  -6.058
  267    H    SER  38           HN       SER  38  -5.741   9.848  -5.981
  268    HA   SER  38           HA       SER  38  -7.011   7.454  -6.703
  269   1HB   SER  38          HB2       SER  38  -7.884   9.811  -8.170
  270   2HB   SER  38          HB1       SER  38  -7.196   8.589  -9.239
  271    HG   SER  38           HG       SER  38  -9.132   7.976  -7.268
  272    H    THR  39           HN       THR  39  -5.198   9.977  -8.460
  273    HA   THR  39           HA       THR  39  -3.371   8.070  -9.562
  274    HB   THR  39           HB       THR  39  -3.822  10.006 -10.872
  275    HG1  THR  39           HG1      THR  39  -1.259  10.424  -9.745
  276   1HG2  THR  39          HG21      THR  39  -4.446  11.853  -9.794
  277   2HG2  THR  39          HG22      THR  39  -2.720  12.215  -9.737
  278   3HG2  THR  39          HG23      THR  39  -3.507  11.450  -8.357
  279    H    CYS  40           HN       CYS  40  -1.333   7.548  -8.932
  280    HA   CYS  40           HA       CYS  40  -0.617   7.840  -6.233
  281   1HB   CYS  40          HB2       CYS  40   0.167   6.175  -8.187
  282   2HB   CYS  40          HB1       CYS  40   1.533   7.286  -8.202
  283    HA   PRO  41           HA       PRO  41   1.136  11.916  -6.135
  284   1HB   PRO  41          HB2       PRO  41   2.875  11.506  -4.030
  285   2HB   PRO  41          HB1       PRO  41   1.160  11.886  -3.855
  286   1HG   PRO  41          HG2       PRO  41   2.539   9.237  -3.721
  287   2HG   PRO  41          HG1       PRO  41   1.213   9.865  -2.724
  288   1HD   PRO  41          HD2       PRO  41   0.770   8.112  -4.706
  289   2HD   PRO  41          HD1       PRO  41  -0.383   9.412  -4.341
  290    H    SER  42           HN       SER  42   3.564   9.402  -5.395
  291    HA   SER  42           HA       SER  42   5.669  10.831  -6.664
  292   1HB   SER  42          HB2       SER  42   6.496   8.175  -6.512
  293   2HB   SER  42          HB1       SER  42   6.770   9.426  -5.299
  294    HG   SER  42           HG       SER  42   5.181   8.637  -4.097
  295    H    ASP  43           HN       ASP  43   4.945   7.481  -7.541
  296    HA   ASP  43           HA       ASP  43   3.953   7.914 -10.113
  297   1HB   ASP  43          HB2       ASP  43   6.189   8.968 -10.470
  298   2HB   ASP  43          HB1       ASP  43   6.937   7.417 -10.105
  299    H    TYR  44           HN       TYR  44   3.613   6.086  -7.938
  300    HA   TYR  44           HA       TYR  44   4.517   3.558  -9.117
  301   1HB   TYR  44          HB2       TYR  44   3.231   3.584  -6.439
  302   2HB   TYR  44          HB1       TYR  44   4.550   2.602  -7.041
  303    HD1  TYR  44           HD1      TYR  44   6.421   4.738  -7.960
  304    HD2  TYR  44           HD2      TYR  44   4.076   4.413  -4.425
  305    HE1  TYR  44           HE1      TYR  44   8.038   6.153  -6.764
  306    HE2  TYR  44           HE2      TYR  44   5.684   5.828  -3.220
  307    HH   TYR  44           HH       TYR  44   7.995   7.684  -4.731
  308    HA   PRO  45           HA       PRO  45   0.424   2.596 -10.436
  309   1HB   PRO  45          HB2       PRO  45   0.492  -0.132 -10.270
  310   2HB   PRO  45          HB1       PRO  45   1.242   0.793 -11.573
  311   1HG   PRO  45          HG2       PRO  45   2.491  -0.434  -9.158
  312   2HG   PRO  45          HG1       PRO  45   3.113  -0.323 -10.811
  313   1HD   PRO  45          HD2       PRO  45   3.941   1.306  -8.799
  314   2HD   PRO  45          HD1       PRO  45   3.914   1.803 -10.502
  315    H    LYS  46           HN       LYS  46   0.920  -0.092  -8.202
  316    HA   LYS  46           HA       LYS  46  -0.883   1.052  -6.244
  317   1HB   LYS  46          HB2       LYS  46  -2.387   0.003  -7.875
  318   2HB   LYS  46          HB1       LYS  46  -1.532  -1.511  -7.660
  319   1HG   LYS  46          HG2       LYS  46  -2.220  -1.577  -5.313
  320   2HG   LYS  46          HG1       LYS  46  -3.094  -0.064  -5.529
  321   1HD   LYS  46          HD2       LYS  46  -4.730  -1.047  -6.848
  322   2HD   LYS  46          HD1       LYS  46  -3.686  -2.392  -7.309
  323   1HE   LYS  46          HE2       LYS  46  -4.430  -3.631  -5.620
  324   2HE   LYS  46          HE1       LYS  46  -4.082  -2.351  -4.458
  325   1HZ   LYS  46          HZ1       LYS  46  -6.587  -3.077  -5.717
  326   2HZ   LYS  46          HZ2       LYS  46  -6.294  -1.414  -5.625
  327   3HZ   LYS  46          HZ3       LYS  46  -6.299  -2.350  -4.217
  Start of MODEL   15
    1   1H    LYS   1          HT1       LYS   1  -7.794   5.266  -3.543
    2   2H    LYS   1          HT2       LYS   1  -6.273   5.756  -2.914
    3   3H    LYS   1          HT3       LYS   1  -7.022   4.323  -2.337
    4    HA   LYS   1           HA       LYS   1  -6.864   3.399  -4.573
    5   1HB   LYS   1          HB2       LYS   1  -6.283   6.063  -5.182
    6   2HB   LYS   1          HB1       LYS   1  -4.756   5.219  -5.393
    7   1HG   LYS   1          HG2       LYS   1  -7.199   4.028  -6.597
    8   2HG   LYS   1          HG1       LYS   1  -6.489   5.452  -7.360
    9   1HD   LYS   1          HD2       LYS   1  -5.612   3.396  -8.346
   10   2HD   LYS   1          HD1       LYS   1  -4.338   4.298  -7.522
   11   1HE   LYS   1          HE2       LYS   1  -4.086   2.728  -5.897
   12   2HE   LYS   1          HE1       LYS   1  -5.787   2.261  -5.934
   13   1HZ   LYS   1          HZ1       LYS   1  -3.552   1.277  -7.539
   14   2HZ   LYS   1          HZ2       LYS   1  -5.061   1.371  -8.296
   15   3HZ   LYS   1          HZ3       LYS   1  -4.875   0.438  -6.898
   16    H    SER   2           HN       SER   2  -4.277   5.267  -3.004
   17    HA   SER   2           HA       SER   2  -2.458   4.581  -1.810
   18   1HB   SER   2          HB2       SER   2  -2.223   2.403  -1.017
   19   2HB   SER   2          HB1       SER   2  -3.963   2.510  -1.283
   20    HG   SER   2           HG       SER   2  -3.640   0.793  -2.454
   21    H    CYS   3           HN       CYS   3  -0.280   3.600  -2.243
   22    HA   CYS   3           HA       CYS   3   0.207   3.040  -5.075
   23   1HB   CYS   3          HB2       CYS   3   0.674   5.581  -3.889
   24   2HB   CYS   3          HB1       CYS   3   2.243   4.848  -4.198
   25    H    CYS   4           HN       CYS   4   1.884   1.678  -5.444
   26    HA   CYS   4           HA       CYS   4   3.728   1.078  -3.242
   27   1HB   CYS   4          HB2       CYS   4   1.752  -0.743  -4.443
   28   2HB   CYS   4          HB1       CYS   4   3.381  -1.400  -4.364
   29    HA   PRO   5           HA       PRO   5   6.585   1.852  -6.622
   30   1HB   PRO   5          HB2       PRO   5   8.694   0.527  -5.305
   31   2HB   PRO   5          HB1       PRO   5   8.353   2.258  -5.275
   32   1HG   PRO   5          HG2       PRO   5   7.658   0.154  -3.291
   33   2HG   PRO   5          HG1       PRO   5   8.076   1.857  -3.029
   34   1HD   PRO   5          HD2       PRO   5   5.553   0.997  -2.827
   35   2HD   PRO   5          HD1       PRO   5   5.927   2.588  -3.522
   36    H    ASN   6           HN       ASN   6   5.821  -1.263  -5.223
   37    HA   ASN   6           HA       ASN   6   6.029  -2.518  -7.783
   38   1HB   ASN   6          HB2       ASN   6   8.187  -2.909  -5.761
   39   2HB   ASN   6          HB1       ASN   6   7.662  -4.307  -6.693
   40   1HD2  ASN   6          HD21      ASN   6   9.743  -1.738  -6.606
   41   2HD2  ASN   6          HD22      ASN   6  10.181  -1.678  -8.277
   42    H    THR   7           HN       THR   7   5.314  -4.759  -7.745
   43    HA   THR   7           HA       THR   7   3.067  -5.170  -6.169
   44    HB   THR   7           HB       THR   7   3.167  -6.417  -8.149
   45    HG1  THR   7           HG1      THR   7   2.366  -8.076  -7.186
   46   1HG2  THR   7          HG21      THR   7   4.989  -8.237  -8.388
   47   2HG2  THR   7          HG22      THR   7   5.904  -7.217  -7.276
   48   3HG2  THR   7          HG23      THR   7   5.361  -6.569  -8.825
   49    H    THR   8           HN       THR   8   6.408  -5.897  -5.536
   50    HA   THR   8           HA       THR   8   6.168  -7.827  -3.545
   51    HB   THR   8           HB       THR   8   8.308  -6.495  -2.649
   52    HG1  THR   8           HG1      THR   8   7.747  -4.765  -4.209
   53   1HG2  THR   8          HG21      THR   8   8.364  -8.724  -3.679
   54   2HG2  THR   8          HG22      THR   8   9.708  -7.703  -4.188
   55   3HG2  THR   8          HG23      THR   8   8.342  -7.967  -5.271
   56    H    GLY   9           HN       GLY   9   5.518  -4.413  -3.475
   57   1HA   GLY   9          HA2       GLY   9   5.278  -4.413  -0.558
   58   2HA   GLY   9          HA1       GLY   9   5.173  -3.005  -1.608
   59    H    ARG  10           HN       ARG  10   3.333  -3.928  -3.464
   60    HA   ARG  10           HA       ARG  10   0.892  -3.310  -2.276
   61   1HB   ARG  10          HB2       ARG  10   0.866  -3.029  -4.572
   62   2HB   ARG  10          HB1       ARG  10   1.741  -4.520  -4.872
   63   1HG   ARG  10          HG2       ARG  10  -0.286  -5.122  -5.677
   64   2HG   ARG  10          HG1       ARG  10  -0.525  -5.594  -3.997
   65   1HD   ARG  10          HD2       ARG  10  -2.363  -4.327  -4.089
   66   2HD   ARG  10          HD1       ARG  10  -1.261  -2.956  -3.977
   67    HE   ARG  10           HE       ARG  10  -1.911  -2.398  -6.083
   68   1HH1  ARG  10          HH11      ARG  10  -2.331  -5.843  -5.713
   69   2HH1  ARG  10          HH12      ARG  10  -2.981  -6.059  -7.303
   70   1HH2  ARG  10          HH21      ARG  10  -2.767  -2.681  -8.172
   71   2HH2  ARG  10          HH22      ARG  10  -3.229  -4.266  -8.699
   72    H    ASN  11           HN       ASN  11   2.521  -6.377  -2.682
   73    HA   ASN  11           HA       ASN  11   0.354  -8.070  -2.097
   74   1HB   ASN  11          HB2       ASN  11   3.343  -8.385  -1.885
   75   2HB   ASN  11          HB1       ASN  11   2.229  -9.681  -1.502
   76   1HD2  ASN  11          HD21      ASN  11   4.276  -9.064  -3.696
   77   2HD2  ASN  11          HD22      ASN  11   3.441  -9.482  -5.149
   78    H    ILE  12           HN       ILE  12   3.070  -7.083   0.023
   79    HA   ILE  12           HA       ILE  12   2.008  -8.231   2.332
   80    HB   ILE  12           HB       ILE  12   3.907  -5.915   1.998
   81   1HG1  ILE  12          HG12      ILE  12   5.274  -7.916   3.224
   82   2HG1  ILE  12          HG11      ILE  12   4.118  -8.849   2.277
   83   1HG2  ILE  12          HG21      ILE  12   4.439  -6.338   4.448
   84   2HG2  ILE  12          HG22      ILE  12   2.894  -7.183   4.527
   85   3HG2  ILE  12          HG23      ILE  12   2.943  -5.472   4.099
   86   1HD1  ILE  12          HD11      ILE  12   6.382  -8.321   1.235
   87   2HD1  ILE  12          HD12      ILE  12   5.762  -6.682   1.034
   88   3HD1  ILE  12          HD13      ILE  12   4.941  -8.036   0.259
   89    H    TYR  13           HN       TYR  13   1.646  -4.907   1.130
   90    HA   TYR  13           HA       TYR  13   0.129  -3.964   3.289
   91   1HB   TYR  13          HB2       TYR  13   1.122  -2.506   1.576
   92   2HB   TYR  13          HB1       TYR  13  -0.010  -3.137   0.386
   93    HD1  TYR  13           HD1      TYR  13   0.450  -0.859   3.186
   94    HD2  TYR  13           HD2      TYR  13  -2.397  -2.551   0.515
   95    HE1  TYR  13           HE1      TYR  13  -1.152   0.906   3.785
   96    HE2  TYR  13           HE2      TYR  13  -4.006  -0.789   1.107
   97    HH   TYR  13           HH       TYR  13  -3.649   1.775   2.084
   98    H    ASN  14           HN       ASN  14  -0.861  -5.469   0.244
   99    HA   ASN  14           HA       ASN  14  -3.627  -5.294   0.679
  100   1HB   ASN  14          HB2       ASN  14  -1.854  -6.870  -1.134
  101   2HB   ASN  14          HB1       ASN  14  -3.555  -7.288  -1.021
  102   1HD2  ASN  14          HD21      ASN  14  -1.743  -4.228  -1.073
  103   2HD2  ASN  14          HD22      ASN  14  -2.653  -3.517  -2.357
  104    H    THR  15           HN       THR  15  -1.459  -8.170   1.015
  105    HA   THR  15           HA       THR  15  -3.492  -9.763   2.150
  106    HB   THR  15           HB       THR  15  -1.672 -10.971   1.329
  107    HG1  THR  15           HG1      THR  15  -1.204 -10.958   4.120
  108   1HG2  THR  15          HG21      THR  15   0.343 -10.071   1.193
  109   2HG2  THR  15          HG22      THR  15   0.556 -10.429   2.907
  110   3HG2  THR  15          HG23      THR  15  -0.057  -8.854   2.405
  111    H    CYS  16           HN       CYS  16  -1.067  -7.660   3.600
  112    HA   CYS  16           HA       CYS  16  -1.383  -8.258   6.277
  113   1HB   CYS  16          HB2       CYS  16   0.293  -6.693   5.744
  114   2HB   CYS  16          HB1       CYS  16  -0.811  -5.695   4.810
  115    H    ARG  17           HN       ARG  17  -3.175  -5.852   4.357
  116    HA   ARG  17           HA       ARG  17  -5.044  -5.177   6.340
  117   1HB   ARG  17          HB2       ARG  17  -4.724  -4.769   3.459
  118   2HB   ARG  17          HB1       ARG  17  -6.406  -4.863   3.959
  119   1HG   ARG  17          HG2       ARG  17  -5.441  -3.182   5.833
  120   2HG   ARG  17          HG1       ARG  17  -4.390  -2.786   4.471
  121   1HD   ARG  17          HD2       ARG  17  -6.450  -1.397   4.592
  122   2HD   ARG  17          HD1       ARG  17  -6.277  -2.288   3.080
  123    HE   ARG  17           HE       ARG  17  -8.187  -3.437   3.584
  124   1HH1  ARG  17          HH11      ARG  17  -6.995  -1.922   6.494
  125   2HH1  ARG  17          HH12      ARG  17  -8.388  -2.342   7.432
  126   1HH2  ARG  17          HH21      ARG  17 -10.020  -3.989   4.817
  127   2HH2  ARG  17          HH22      ARG  17 -10.105  -3.517   6.482
  128    H    LEU  18           HN       LEU  18  -4.931  -7.766   3.970
  129    HA   LEU  18           HA       LEU  18  -7.580  -8.652   4.204
  130   1HB   LEU  18          HB2       LEU  18  -6.919 -10.139   2.656
  131   2HB   LEU  18          HB1       LEU  18  -5.361  -9.352   2.723
  132    HG   LEU  18           HG       LEU  18  -4.754 -11.015   4.536
  133   1HD1  LEU  18          HD11      LEU  18  -6.430 -12.268   5.313
  134   2HD1  LEU  18          HD12      LEU  18  -6.309 -13.178   3.808
  135   3HD1  LEU  18          HD13      LEU  18  -7.472 -11.860   3.951
  136   1HD2  LEU  18          HD21      LEU  18  -5.021 -12.828   2.374
  137   2HD2  LEU  18          HD22      LEU  18  -3.607 -11.892   2.850
  138   3HD2  LEU  18          HD23      LEU  18  -4.759 -11.220   1.699
  139    H    GLY  19           HN       GLY  19  -4.897  -8.919   6.329
  140   1HA   GLY  19          HA2       GLY  19  -6.296 -10.973   7.899
  141   2HA   GLY  19          HA1       GLY  19  -4.581 -10.614   8.017
  142    H    GLY  20           HN       GLY  20  -6.764  -7.947   7.791
  143   1HA   GLY  20          HA2       GLY  20  -7.454  -6.387   9.332
  144   2HA   GLY  20          HA1       GLY  20  -7.306  -7.637  10.556
  145    H    GLY  21           HN       GLY  21  -5.118  -5.762   8.470
  146   1HA   GLY  21          HA2       GLY  21  -3.508  -5.169  10.862
  147   2HA   GLY  21          HA1       GLY  21  -2.774  -5.578   9.316
  148    H    SER  22           HN       SER  22  -3.365  -3.108  11.271
  149    HA   SER  22           HA       SER  22  -4.548  -1.025  10.047
  150   1HB   SER  22          HB2       SER  22  -1.903  -0.233  11.026
  151   2HB   SER  22          HB1       SER  22  -3.506   0.255  11.576
  152    HG   SER  22           HG       SER  22  -3.198  -1.032  13.193
  153    H    ARG  23           HN       ARG  23  -3.874   0.704   8.694
  154    HA   ARG  23           HA       ARG  23  -2.657  -0.145   6.311
  155   1HB   ARG  23          HB2       ARG  23  -3.880   2.289   7.371
  156   2HB   ARG  23          HB1       ARG  23  -2.609   2.597   6.204
  157   1HG   ARG  23          HG2       ARG  23  -4.261   2.388   4.705
  158   2HG   ARG  23          HG1       ARG  23  -3.998   0.658   4.930
  159   1HD   ARG  23          HD2       ARG  23  -6.346   1.099   5.114
  160   2HD   ARG  23          HD1       ARG  23  -5.728   0.684   6.712
  161    HE   ARG  23           HE       ARG  23  -5.601   3.401   6.641
  162   1HH1  ARG  23          HH11      ARG  23  -8.142   1.071   6.097
  163   2HH1  ARG  23          HH12      ARG  23  -9.399   2.128   6.644
  164   1HH2  ARG  23          HH21      ARG  23  -7.254   4.793   7.361
  165   2HH2  ARG  23          HH22      ARG  23  -8.896   4.242   7.361
  166    H    GLU  24           HN       GLU  24  -1.523   1.743   9.027
  167    HA   GLU  24           HA       GLU  24   0.984   2.432   7.875
  168   1HB   GLU  24          HB2       GLU  24   0.597   2.314  10.836
  169   2HB   GLU  24          HB1       GLU  24   1.442   3.514   9.865
  170   1HG   GLU  24          HG2       GLU  24  -0.892   4.105   8.959
  171   2HG   GLU  24          HG1       GLU  24  -1.492   3.220  10.361
  172    H    ARG  25           HN       ARG  25  -0.126  -0.256   9.860
  173    HA   ARG  25           HA       ARG  25   2.338  -1.262  10.677
  174   1HB   ARG  25          HB2       ARG  25   0.034  -2.061  11.371
  175   2HB   ARG  25          HB1       ARG  25  -0.021  -2.960   9.862
  176   1HG   ARG  25          HG2       ARG  25   1.715  -4.388  10.515
  177   2HG   ARG  25          HG1       ARG  25   2.209  -3.322  11.831
  178   1HD   ARG  25          HD2       ARG  25   0.544  -4.033  13.219
  179   2HD   ARG  25          HD1       ARG  25  -0.557  -4.389  11.890
  180    HE   ARG  25           HE       ARG  25   1.708  -6.148  11.999
  181   1HH1  ARG  25          HH11      ARG  25  -1.509  -5.563  13.216
  182   2HH1  ARG  25          HH12      ARG  25  -1.800  -7.225  13.604
  183   1HH2  ARG  25          HH21      ARG  25   1.326  -8.336  12.508
  184   2HH2  ARG  25          HH22      ARG  25  -0.190  -8.799  13.203
  185    H    CYS  26           HN       CYS  26   0.462  -2.064   7.777
  186    HA   CYS  26           HA       CYS  26   2.499  -3.724   6.669
  187   1HB   CYS  26          HB2       CYS  26   0.684  -2.602   4.683
  188   2HB   CYS  26          HB1       CYS  26   0.969  -4.276   5.122
  189    H    ALA  27           HN       ALA  27   1.570  -0.354   6.306
  190    HA   ALA  27           HA       ALA  27   3.146   0.310   4.101
  191   1HB   ALA  27          HB1       ALA  27   2.544   2.120   6.434
  192   2HB   ALA  27          HB2       ALA  27   1.395   1.749   5.148
  193   3HB   ALA  27          HB3       ALA  27   2.897   2.592   4.771
  194    H    SER  28           HN       SER  28   3.961   0.180   7.540
  195    HA   SER  28           HA       SER  28   6.570   1.253   7.244
  196   1HB   SER  28          HB2       SER  28   5.326   1.214   9.400
  197   2HB   SER  28          HB1       SER  28   5.521  -0.537   9.448
  198    HG   SER  28           HG       SER  28   7.229   0.129  10.568
  199    H    LEU  29           HN       LEU  29   5.227  -1.988   7.169
  200    HA   LEU  29           HA       LEU  29   7.710  -3.368   7.193
  201   1HB   LEU  29          HB2       LEU  29   5.087  -4.091   7.436
  202   2HB   LEU  29          HB1       LEU  29   5.460  -4.675   5.826
  203    HG   LEU  29           HG       LEU  29   7.594  -5.633   7.201
  204   1HD1  LEU  29          HD11      LEU  29   6.909  -6.493   9.317
  205   2HD1  LEU  29          HD12      LEU  29   5.268  -5.888   9.096
  206   3HD1  LEU  29          HD13      LEU  29   6.602  -4.757   9.320
  207   1HD2  LEU  29          HD21      LEU  29   4.892  -6.856   6.696
  208   2HD2  LEU  29          HD22      LEU  29   6.266  -7.783   7.299
  209   3HD2  LEU  29          HD23      LEU  29   6.356  -6.999   5.722
  210    H    SER  30           HN       SER  30   5.400  -2.729   4.551
  211    HA   SER  30           HA       SER  30   7.225  -3.624   2.540
  212   1HB   SER  30          HB2       SER  30   5.515  -3.171   0.988
  213   2HB   SER  30          HB1       SER  30   4.652  -3.638   2.453
  214    HG   SER  30           HG       SER  30   4.040  -1.590   2.771
  215    H    GLY  31           HN       GLY  31   6.010  -0.433   3.538
  216   1HA   GLY  31          HA2       GLY  31   7.298   1.542   3.563
  217   2HA   GLY  31          HA1       GLY  31   8.468   0.765   2.504
  218    H    CYS  32           HN       CYS  32   5.093   0.571   1.772
  219    HA   CYS  32           HA       CYS  32   5.486   1.882  -0.752
  220   1HB   CYS  32          HB2       CYS  32   3.176   0.534   0.618
  221   2HB   CYS  32          HB1       CYS  32   2.930   1.441  -0.865
  222    H    LYS  33           HN       LYS  33   3.204   3.256  -1.253
  223    HA   LYS  33           HA       LYS  33   3.406   5.523   0.606
  224   1HB   LYS  33          HB2       LYS  33   3.765   5.403  -2.164
  225   2HB   LYS  33          HB1       LYS  33   2.195   6.159  -1.947
  226   1HG   LYS  33          HG2       LYS  33   4.866   7.093  -0.952
  227   2HG   LYS  33          HG1       LYS  33   3.750   7.915  -2.043
  228   1HD   LYS  33          HD2       LYS  33   3.363   7.408   0.906
  229   2HD   LYS  33          HD1       LYS  33   3.666   8.961   0.129
  230   1HE   LYS  33          HE2       LYS  33   1.363   7.590  -0.996
  231   2HE   LYS  33          HE1       LYS  33   1.195   7.875   0.734
  232   1HZ   LYS  33          HZ1       LYS  33   0.549   9.909   0.155
  233   2HZ   LYS  33          HZ2       LYS  33   1.098   9.742  -1.435
  234   3HZ   LYS  33          HZ3       LYS  33   2.168  10.229  -0.219
  235    H    ILE  34           HN       ILE  34   1.665   6.085   1.729
  236    HA   ILE  34           HA       ILE  34  -0.927   4.959   0.929
  237    HB   ILE  34           HB       ILE  34  -0.115   4.113   3.077
  238   1HG1  ILE  34          HG12      ILE  34  -2.146   5.404   4.422
  239   2HG1  ILE  34          HG11      ILE  34  -2.602   5.622   2.734
  240   1HG2  ILE  34          HG21      ILE  34   0.813   5.369   4.666
  241   2HG2  ILE  34          HG22      ILE  34  -0.474   6.571   4.589
  242   3HG2  ILE  34          HG23      ILE  34   0.874   6.651   3.456
  243   1HD1  ILE  34          HD11      ILE  34  -2.151   3.084   2.547
  244   2HD1  ILE  34          HD12      ILE  34  -3.646   3.651   3.291
  245   3HD1  ILE  34          HD13      ILE  34  -2.309   3.106   4.303
  246    H    ILE  35           HN       ILE  35  -1.429   6.725  -0.447
  247    HA   ILE  35           HA       ILE  35  -1.358   9.419   0.339
  248    HB   ILE  35           HB       ILE  35  -3.260   9.596  -1.465
  249   1HG1  ILE  35          HG12      ILE  35  -2.087   7.182  -2.673
  250   2HG1  ILE  35          HG11      ILE  35  -3.169   6.868  -1.321
  251   1HG2  ILE  35          HG21      ILE  35  -1.573   9.733  -3.182
  252   2HG2  ILE  35          HG22      ILE  35  -0.465   8.765  -2.209
  253   3HG2  ILE  35          HG23      ILE  35  -0.935  10.377  -1.669
  254   1HD1  ILE  35          HD11      ILE  35  -4.009   7.061  -3.831
  255   2HD1  ILE  35          HD12      ILE  35  -4.116   8.763  -3.380
  256   3HD1  ILE  35          HD13      ILE  35  -5.000   7.548  -2.456
  257    H    SER  36           HN       SER  36  -4.083   7.121   0.281
  258    HA   SER  36           HA       SER  36  -5.826   6.926   1.771
  259   1HB   SER  36          HB2       SER  36  -5.367   9.663   2.906
  260   2HB   SER  36          HB1       SER  36  -6.034   8.229   3.685
  261    HG   SER  36           HG       SER  36  -3.473   9.074   3.570
  262    H    ALA  37           HN       ALA  37  -5.232   9.595  -0.289
  263    HA   ALA  37           HA       ALA  37  -8.010  10.452  -0.305
  264   1HB   ALA  37          HB1       ALA  37  -6.630  12.301  -0.494
  265   2HB   ALA  37          HB2       ALA  37  -7.065  11.987  -2.173
  266   3HB   ALA  37          HB3       ALA  37  -5.495  11.471  -1.558
  267    H    SER  38           HN       SER  38  -5.765   9.802  -2.965
  268    HA   SER  38           HA       SER  38  -6.942   7.585  -4.075
  269   1HB   SER  38          HB2       SER  38  -8.565   9.962  -4.465
  270   2HB   SER  38          HB1       SER  38  -8.066   9.267  -6.008
  271    HG   SER  38           HG       SER  38  -9.315   7.850  -3.886
  272    H    THR  39           HN       THR  39  -6.085  10.806  -5.360
  273    HA   THR  39           HA       THR  39  -4.698   9.925  -7.603
  274    HB   THR  39           HB       THR  39  -3.770  12.367  -6.146
  275    HG1  THR  39           HG1      THR  39  -5.670  13.223  -6.153
  276   1HG2  THR  39          HG21      THR  39  -3.880  13.376  -8.368
  277   2HG2  THR  39          HG22      THR  39  -4.458  11.846  -9.028
  278   3HG2  THR  39          HG23      THR  39  -2.838  11.954  -8.340
  279    H    CYS  40           HN       CYS  40  -2.845   8.874  -7.861
  280    HA   CYS  40           HA       CYS  40  -1.179   8.291  -5.592
  281   1HB   CYS  40          HB2       CYS  40  -1.611   7.202  -8.232
  282   2HB   CYS  40          HB1       CYS  40   0.111   7.380  -7.915
  283    HA   PRO  41           HA       PRO  41   1.714  11.592  -6.042
  284   1HB   PRO  41          HB2       PRO  41   3.941  10.356  -5.010
  285   2HB   PRO  41          HB1       PRO  41   2.648  11.059  -4.034
  286   1HG   PRO  41          HG2       PRO  41   3.127   8.207  -4.778
  287   2HG   PRO  41          HG1       PRO  41   2.553   8.890  -3.247
  288   1HD   PRO  41          HD2       PRO  41   0.892   7.722  -5.030
  289   2HD   PRO  41          HD1       PRO  41   0.383   9.070  -3.994
  290    H    SER  42           HN       SER  42   3.847   8.787  -6.453
  291    HA   SER  42           HA       SER  42   5.122   9.970  -8.697
  292   1HB   SER  42          HB2       SER  42   5.545   7.685  -6.986
  293   2HB   SER  42          HB1       SER  42   5.803   7.245  -8.674
  294    HG   SER  42           HG       SER  42   7.086   9.263  -7.166
  295    H    ASP  43           HN       ASP  43   3.991   6.610  -8.858
  296    HA   ASP  43           HA       ASP  43   1.888   6.957 -10.645
  297   1HB   ASP  43          HB2       ASP  43   4.221   7.705 -11.888
  298   2HB   ASP  43          HB1       ASP  43   4.047   6.029 -12.397
  299    H    TYR  44           HN       TYR  44   2.765   5.145  -8.519
  300    HA   TYR  44           HA       TYR  44   2.831   2.613 -10.000
  301   1HB   TYR  44          HB2       TYR  44   3.143   1.954  -7.321
  302   2HB   TYR  44          HB1       TYR  44   4.407   2.015  -8.536
  303    HD1  TYR  44           HD1      TYR  44   3.032   3.541  -5.559
  304    HD2  TYR  44           HD2      TYR  44   5.850   4.039  -8.705
  305    HE1  TYR  44           HE1      TYR  44   4.195   5.251  -4.233
  306    HE2  TYR  44           HE2      TYR  44   7.020   5.757  -7.390
  307    HH   TYR  44           HH       TYR  44   5.823   7.382  -5.004
  308    HA   PRO  45           HA       PRO  45  -1.614   2.917  -8.849
  309   1HB   PRO  45          HB2       PRO  45  -2.248   0.836 -10.584
  310   2HB   PRO  45          HB1       PRO  45  -2.313   2.555 -10.978
  311   1HG   PRO  45          HG2       PRO  45  -0.177   0.555 -11.563
  312   2HG   PRO  45          HG1       PRO  45  -0.776   1.888 -12.568
  313   1HD   PRO  45          HD2       PRO  45   1.545   2.073 -11.255
  314   2HD   PRO  45          HD1       PRO  45   0.470   3.477 -11.419
  315    H    LYS  46           HN       LYS  46  -1.249   2.103  -6.764
  316    HA   LYS  46           HA       LYS  46  -0.885  -0.760  -6.420
  317   1HB   LYS  46          HB2       LYS  46   0.429   0.549  -4.979
  318   2HB   LYS  46          HB1       LYS  46  -0.917   1.580  -4.563
  319   1HG   LYS  46          HG2       LYS  46  -1.946  -0.423  -3.430
  320   2HG   LYS  46          HG1       LYS  46  -0.388  -1.225  -3.655
  321   1HD   LYS  46          HD2       LYS  46   0.684   0.679  -2.465
  322   2HD   LYS  46          HD1       LYS  46  -0.912   1.320  -2.126
  323   1HE   LYS  46          HE2       LYS  46  -1.459  -0.466  -0.721
  324   2HE   LYS  46          HE1       LYS  46  -0.145  -1.467  -1.341
  325   1HZ   LYS  46          HZ1       LYS  46   1.161   0.675  -0.359
  326   2HZ   LYS  46          HZ2       LYS  46   0.932  -0.775   0.475
  327   3HZ   LYS  46          HZ3       LYS  46  -0.114   0.525   0.739
  Start of MODEL   16
    1   1H    LYS   1          HT1       LYS   1  -6.485   0.436   1.674
    2   2H    LYS   1          HT2       LYS   1  -6.606   2.112   1.318
    3   3H    LYS   1          HT3       LYS   1  -5.256   1.513   2.191
    4    HA   LYS   1           HA       LYS   1  -4.839   0.083   0.173
    5   1HB   LYS   1          HB2       LYS   1  -7.170   1.573  -0.586
    6   2HB   LYS   1          HB1       LYS   1  -5.845   2.007  -1.655
    7   1HG   LYS   1          HG2       LYS   1  -5.498  -0.534  -1.896
    8   2HG   LYS   1          HG1       LYS   1  -7.130  -0.659  -1.235
    9   1HD   LYS   1          HD2       LYS   1  -7.532  -0.612  -3.513
   10   2HD   LYS   1          HD1       LYS   1  -7.724   1.085  -3.069
   11   1HE   LYS   1          HE2       LYS   1  -6.266   1.513  -4.708
   12   2HE   LYS   1          HE1       LYS   1  -5.037   0.899  -3.608
   13   1HZ   LYS   1          HZ1       LYS   1  -4.659  -0.783  -4.987
   14   2HZ   LYS   1          HZ2       LYS   1  -5.765  -0.132  -6.084
   15   3HZ   LYS   1          HZ3       LYS   1  -6.279  -1.260  -4.937
   16    H    SER   2           HN       SER   2  -2.879   0.626  -0.641
   17    HA   SER   2           HA       SER   2  -2.108   3.425  -0.688
   18   1HB   SER   2          HB2       SER   2  -0.010   3.017   0.441
   19   2HB   SER   2          HB1       SER   2  -1.318   2.431   1.465
   20    HG   SER   2           HG       SER   2   0.463   0.931  -0.134
   21    H    CYS   3           HN       CYS   3  -0.611   3.970  -2.240
   22    HA   CYS   3           HA       CYS   3  -0.495   2.273  -4.500
   23   1HB   CYS   3          HB2       CYS   3   1.186   4.734  -4.073
   24   2HB   CYS   3          HB1       CYS   3   0.669   4.030  -5.600
   25    H    CYS   4           HN       CYS   4   1.329   1.343  -5.520
   26    HA   CYS   4           HA       CYS   4   3.795   1.206  -3.979
   27   1HB   CYS   4          HB2       CYS   4   2.333  -1.334  -4.707
   28   2HB   CYS   4          HB1       CYS   4   3.837  -1.196  -3.804
   29    HA   PRO   5           HA       PRO   5   5.364   1.130  -8.125
   30   1HB   PRO   5          HB2       PRO   5   7.976   0.815  -7.585
   31   2HB   PRO   5          HB1       PRO   5   7.124   2.320  -7.223
   32   1HG   PRO   5          HG2       PRO   5   7.857   0.070  -5.391
   33   2HG   PRO   5          HG1       PRO   5   7.970   1.817  -5.117
   34   1HD   PRO   5          HD2       PRO   5   5.929   0.262  -4.167
   35   2HD   PRO   5          HD1       PRO   5   5.760   1.990  -4.532
   36    H    ASN   6           HN       ASN   6   5.362  -1.562  -6.046
   37    HA   ASN   6           HA       ASN   6   5.671  -3.354  -8.275
   38   1HB   ASN   6          HB2       ASN   6   7.773  -3.168  -6.134
   39   2HB   ASN   6          HB1       ASN   6   7.472  -4.686  -6.974
   40   1HD2  ASN   6          HD21      ASN   6   9.171  -1.822  -7.009
   41   2HD2  ASN   6          HD22      ASN   6   9.728  -1.862  -8.644
   42    H    THR   7           HN       THR   7   4.592  -5.227  -7.969
   43    HA   THR   7           HA       THR   7   2.651  -5.504  -6.065
   44    HB   THR   7           HB       THR   7   2.426  -6.929  -7.884
   45    HG1  THR   7           HG1      THR   7   1.795  -8.214  -6.278
   46   1HG2  THR   7          HG21      THR   7   5.259  -7.782  -7.406
   47   2HG2  THR   7          HG22      THR   7   4.560  -7.039  -8.845
   48   3HG2  THR   7          HG23      THR   7   4.151  -8.702  -8.423
   49    H    THR   8           HN       THR   8   6.037  -6.202  -5.732
   50    HA   THR   8           HA       THR   8   6.051  -7.998  -3.621
   51    HB   THR   8           HB       THR   8   8.158  -6.412  -2.977
   52    HG1  THR   8           HG1      THR   8   7.403  -4.976  -4.739
   53   1HG2  THR   8          HG21      THR   8   7.871  -8.838  -4.176
   54   2HG2  THR   8          HG22      THR   8   9.409  -8.054  -3.813
   55   3HG2  THR   8          HG23      THR   8   8.702  -7.905  -5.422
   56    H    GLY   9           HN       GLY   9   5.930  -4.438  -3.504
   57   1HA   GLY   9          HA2       GLY   9   5.619  -4.384  -0.642
   58   2HA   GLY   9          HA1       GLY   9   5.445  -3.016  -1.738
   59    H    ARG  10           HN       ARG  10   3.524  -4.033  -3.452
   60    HA   ARG  10           HA       ARG  10   1.129  -3.378  -2.191
   61   1HB   ARG  10          HB2       ARG  10   1.895  -3.918  -4.764
   62   2HB   ARG  10          HB1       ARG  10   0.839  -5.276  -4.395
   63   1HG   ARG  10          HG2       ARG  10  -0.933  -4.009  -4.676
   64   2HG   ARG  10          HG1       ARG  10  -0.370  -2.907  -3.417
   65   1HD   ARG  10          HD2       ARG  10   0.094  -1.364  -4.925
   66   2HD   ARG  10          HD1       ARG  10   1.145  -2.486  -5.793
   67    HE   ARG  10           HE       ARG  10  -1.661  -2.866  -6.242
   68   1HH1  ARG  10          HH11      ARG  10   1.230  -1.247  -7.326
   69   2HH1  ARG  10          HH12      ARG  10   0.656  -1.027  -8.944
   70   1HH2  ARG  10          HH21      ARG  10  -2.422  -2.580  -8.378
   71   2HH2  ARG  10          HH22      ARG  10  -1.418  -1.782  -9.541
   72    H    ASN  11           HN       ASN  11   2.822  -6.411  -2.491
   73    HA   ASN  11           HA       ASN  11   0.735  -8.143  -1.789
   74   1HB   ASN  11          HB2       ASN  11   3.714  -8.268  -1.806
   75   2HB   ASN  11          HB1       ASN  11   2.843  -9.502  -0.909
   76   1HD2  ASN  11          HD21      ASN  11   4.304  -9.009  -3.696
   77   2HD2  ASN  11          HD22      ASN  11   3.352  -9.989  -4.753
   78    H    ILE  12           HN       ILE  12   3.135  -6.400   0.153
   79    HA   ILE  12           HA       ILE  12   2.297  -7.554   2.605
   80    HB   ILE  12           HB       ILE  12   3.819  -4.996   2.115
   81   1HG1  ILE  12          HG12      ILE  12   5.581  -6.720   3.223
   82   2HG1  ILE  12          HG11      ILE  12   4.554  -7.850   2.347
   83   1HG2  ILE  12          HG21      ILE  12   2.903  -6.318   4.607
   84   2HG2  ILE  12          HG22      ILE  12   3.144  -4.606   4.253
   85   3HG2  ILE  12          HG23      ILE  12   4.531  -5.641   4.596
   86   1HD1  ILE  12          HD11      ILE  12   5.820  -7.407   0.589
   87   2HD1  ILE  12          HD12      ILE  12   6.541  -5.996   1.365
   88   3HD1  ILE  12          HD13      ILE  12   4.999  -5.848   0.523
   89    H    TYR  13           HN       TYR  13   1.642  -4.369   1.103
   90    HA   TYR  13           HA       TYR  13  -0.058  -3.503   3.177
   91   1HB   TYR  13          HB2       TYR  13   1.033  -2.172   1.223
   92   2HB   TYR  13          HB1       TYR  13  -0.425  -2.611   0.341
   93    HD1  TYR  13           HD1      TYR  13  -2.582  -1.683   0.962
   94    HD2  TYR  13           HD2      TYR  13   0.939  -0.635   3.105
   95    HE1  TYR  13           HE1      TYR  13  -3.782   0.191   2.005
   96    HE2  TYR  13           HE2      TYR  13  -0.250   1.243   4.155
   97    HH   TYR  13           HH       TYR  13  -2.187   2.652   3.753
   98    H    ASN  14           HN       ASN  14  -0.727  -5.145   0.116
   99    HA   ASN  14           HA       ASN  14  -3.530  -5.128   0.390
  100   1HB   ASN  14          HB2       ASN  14  -1.599  -6.674  -1.309
  101   2HB   ASN  14          HB1       ASN  14  -3.311  -7.031  -1.332
  102   1HD2  ASN  14          HD21      ASN  14  -1.272  -4.102  -1.384
  103   2HD2  ASN  14          HD22      ASN  14  -2.113  -3.347  -2.689
  104    H    THR  15           HN       THR  15  -1.073  -7.658   1.080
  105    HA   THR  15           HA       THR  15  -3.031  -9.514   2.012
  106    HB   THR  15           HB       THR  15  -0.104  -9.489   2.717
  107    HG1  THR  15           HG1      THR  15   0.269  -9.922   0.715
  108   1HG2  THR  15          HG21      THR  15  -0.288 -11.859   2.922
  109   2HG2  THR  15          HG22      THR  15  -1.973 -11.815   2.404
  110   3HG2  THR  15          HG23      THR  15  -1.506 -11.105   3.949
  111    H    CYS  16           HN       CYS  16  -1.054  -7.031   3.489
  112    HA   CYS  16           HA       CYS  16  -1.393  -7.640   6.184
  113   1HB   CYS  16          HB2       CYS  16   0.139  -5.924   5.675
  114   2HB   CYS  16          HB1       CYS  16  -1.023  -5.056   4.686
  115    H    ARG  17           HN       ARG  17  -3.288  -5.320   4.222
  116    HA   ARG  17           HA       ARG  17  -5.327  -4.931   6.107
  117   1HB   ARG  17          HB2       ARG  17  -4.909  -4.373   3.266
  118   2HB   ARG  17          HB1       ARG  17  -6.591  -4.714   3.645
  119   1HG   ARG  17          HG2       ARG  17  -5.939  -2.995   5.642
  120   2HG   ARG  17          HG1       ARG  17  -4.937  -2.393   4.319
  121   1HD   ARG  17          HD2       ARG  17  -6.740  -1.813   3.034
  122   2HD   ARG  17          HD1       ARG  17  -7.781  -3.045   3.746
  123    HE   ARG  17           HE       ARG  17  -7.268  -1.243   5.762
  124   1HH1  ARG  17          HH11      ARG  17  -8.718  -1.134   2.590
  125   2HH1  ARG  17          HH12      ARG  17  -9.788   0.167   2.988
  126   1HH2  ARG  17          HH21      ARG  17  -8.675   0.468   6.287
  127   2HH2  ARG  17          HH22      ARG  17  -9.764   1.078   5.085
  128    H    LEU  18           HN       LEU  18  -4.878  -7.308   3.563
  129    HA   LEU  18           HA       LEU  18  -7.351  -8.600   3.711
  130   1HB   LEU  18          HB2       LEU  18  -4.741  -9.049   2.536
  131   2HB   LEU  18          HB1       LEU  18  -5.466 -10.552   3.055
  132    HG   LEU  18           HG       LEU  18  -6.640  -8.551   1.130
  133   1HD1  LEU  18          HD11      LEU  18  -6.391 -10.328  -0.509
  134   2HD1  LEU  18          HD12      LEU  18  -5.689 -11.382   0.718
  135   3HD1  LEU  18          HD13      LEU  18  -4.833  -9.926   0.211
  136   1HD2  LEU  18          HD21      LEU  18  -8.295 -10.564   0.853
  137   2HD2  LEU  18          HD22      LEU  18  -8.546  -9.364   2.120
  138   3HD2  LEU  18          HD23      LEU  18  -7.811 -10.918   2.512
  139    H    GLY  19           HN       GLY  19  -4.565  -8.752   5.748
  140   1HA   GLY  19          HA2       GLY  19  -5.684 -11.064   7.168
  141   2HA   GLY  19          HA1       GLY  19  -4.024 -10.505   7.294
  142    H    GLY  20           HN       GLY  20  -6.471  -8.083   7.329
  143   1HA   GLY  20          HA2       GLY  20  -7.250  -6.710   9.000
  144   2HA   GLY  20          HA1       GLY  20  -7.079  -8.081  10.086
  145    H    GLY  21           HN       GLY  21  -4.896  -5.931   8.284
  146   1HA   GLY  21          HA2       GLY  21  -3.390  -5.531  10.781
  147   2HA   GLY  21          HA1       GLY  21  -2.600  -5.730   9.223
  148    H    SER  22           HN       SER  22  -3.384  -3.541  11.434
  149    HA   SER  22           HA       SER  22  -4.598  -1.368  10.416
  150   1HB   SER  22          HB2       SER  22  -2.034  -0.606  11.609
  151   2HB   SER  22          HB1       SER  22  -3.678  -0.243  12.134
  152    HG   SER  22           HG       SER  22  -3.769  -2.193  13.179
  153    H    ARG  23           HN       ARG  23  -3.964   0.533   9.325
  154    HA   ARG  23           HA       ARG  23  -2.694   0.097   6.880
  155   1HB   ARG  23          HB2       ARG  23  -4.300   1.843   7.046
  156   2HB   ARG  23          HB1       ARG  23  -3.418   2.622   8.351
  157   1HG   ARG  23          HG2       ARG  23  -1.990   2.326   5.782
  158   2HG   ARG  23          HG1       ARG  23  -3.337   3.466   5.824
  159   1HD   ARG  23          HD2       ARG  23  -1.218   3.496   7.944
  160   2HD   ARG  23          HD1       ARG  23  -0.968   4.316   6.404
  161    HE   ARG  23           HE       ARG  23  -3.424   5.158   7.372
  162   1HH1  ARG  23          HH11      ARG  23  -0.077   5.325   8.347
  163   2HH1  ARG  23          HH12      ARG  23  -0.269   6.823   9.194
  164   1HH2  ARG  23          HH21      ARG  23  -3.678   7.128   8.486
  165   2HH2  ARG  23          HH22      ARG  23  -2.313   7.846   9.273
  166    H    GLU  24           HN       GLU  24  -1.500   1.461   9.873
  167    HA   GLU  24           HA       GLU  24   0.998   2.318   8.821
  168   1HB   GLU  24          HB2       GLU  24   0.674   1.649  11.714
  169   2HB   GLU  24          HB1       GLU  24   1.505   3.008  10.966
  170   1HG   GLU  24          HG2       GLU  24  -0.847   3.765  10.246
  171   2HG   GLU  24          HG1       GLU  24  -1.417   2.636  11.474
  172    H    ARG  25           HN       ARG  25  -0.109  -0.654  10.339
  173    HA   ARG  25           HA       ARG  25   2.349  -1.845  10.864
  174   1HB   ARG  25          HB2       ARG  25  -0.407  -2.818  10.372
  175   2HB   ARG  25          HB1       ARG  25   0.881  -4.000  10.187
  176   1HG   ARG  25          HG2       ARG  25   1.659  -3.463  12.465
  177   2HG   ARG  25          HG1       ARG  25   0.294  -2.359  12.642
  178   1HD   ARG  25          HD2       ARG  25  -1.247  -4.063  12.729
  179   2HD   ARG  25          HD1       ARG  25  -0.223  -5.177  11.824
  180    HE   ARG  25           HE       ARG  25   0.860  -4.507  14.387
  181   1HH1  ARG  25          HH11      ARG  25  -1.406  -6.580  12.730
  182   2HH1  ARG  25          HH12      ARG  25  -1.350  -7.817  13.939
  183   1HH2  ARG  25          HH21      ARG  25   0.936  -6.134  15.979
  184   2HH2  ARG  25          HH22      ARG  25  -0.021  -7.565  15.784
  185    H    CYS  26           HN       CYS  26   0.387  -1.957   7.914
  186    HA   CYS  26           HA       CYS  26   2.253  -3.544   6.461
  187   1HB   CYS  26          HB2       CYS  26   0.588  -1.926   4.724
  188   2HB   CYS  26          HB1       CYS  26   0.647  -3.670   4.915
  189    H    ALA  27           HN       ALA  27   1.643  -0.080   6.718
  190    HA   ALA  27           HA       ALA  27   3.359   0.726   4.637
  191   1HB   ALA  27          HB1       ALA  27   3.427   2.868   6.258
  192   2HB   ALA  27          HB2       ALA  27   2.019   2.038   6.917
  193   3HB   ALA  27          HB3       ALA  27   2.060   2.485   5.212
  194    H    SER  28           HN       SER  28   3.939   0.223   8.091
  195    HA   SER  28           HA       SER  28   6.624   1.135   8.044
  196   1HB   SER  28          HB2       SER  28   5.252   1.026  10.110
  197   2HB   SER  28          HB1       SER  28   5.309  -0.734  10.026
  198    HG   SER  28           HG       SER  28   7.386  -0.714  10.580
  199    H    LEU  29           HN       LEU  29   5.121  -2.054   7.803
  200    HA   LEU  29           HA       LEU  29   7.561  -3.510   7.774
  201   1HB   LEU  29          HB2       LEU  29   4.850  -4.120   7.900
  202   2HB   LEU  29          HB1       LEU  29   5.373  -4.813   6.377
  203    HG   LEU  29           HG       LEU  29   6.947  -5.359   8.863
  204   1HD1  LEU  29          HD11      LEU  29   4.317  -6.573   8.085
  205   2HD1  LEU  29          HD12      LEU  29   4.833  -5.960   9.657
  206   3HD1  LEU  29          HD13      LEU  29   5.508  -7.464   9.033
  207   1HD2  LEU  29          HD21      LEU  29   7.489  -5.989   6.362
  208   2HD2  LEU  29          HD22      LEU  29   6.378  -7.316   6.697
  209   3HD2  LEU  29          HD23      LEU  29   7.825  -7.108   7.682
  210    H    SER  30           HN       SER  30   5.338  -2.500   5.179
  211    HA   SER  30           HA       SER  30   7.218  -3.420   3.166
  212   1HB   SER  30          HB2       SER  30   4.482  -3.310   3.217
  213   2HB   SER  30          HB1       SER  30   4.882  -1.893   2.249
  214    HG   SER  30           HG       SER  30   4.706  -3.693   0.917
  215    H    GLY  31           HN       GLY  31   5.389  -0.370   3.437
  216   1HA   GLY  31          HA2       GLY  31   6.577   1.742   3.731
  217   2HA   GLY  31          HA1       GLY  31   7.892   1.057   2.788
  218    H    CYS  32           HN       CYS  32   4.528   0.650   1.927
  219    HA   CYS  32           HA       CYS  32   4.964   1.666  -0.689
  220   1HB   CYS  32          HB2       CYS  32   2.595   0.664   0.841
  221   2HB   CYS  32          HB1       CYS  32   2.337   1.498  -0.683
  222    H    LYS  33           HN       LYS  33   2.862   3.219  -1.389
  223    HA   LYS  33           HA       LYS  33   3.349   5.667   0.158
  224   1HB   LYS  33          HB2       LYS  33   3.982   5.521  -2.317
  225   2HB   LYS  33          HB1       LYS  33   2.254   5.549  -2.643
  226   1HG   LYS  33          HG2       LYS  33   3.296   7.762  -2.847
  227   2HG   LYS  33          HG1       LYS  33   2.049   7.714  -1.599
  228   1HD   LYS  33          HD2       LYS  33   4.809   7.126  -0.722
  229   2HD   LYS  33          HD1       LYS  33   4.483   8.786  -1.219
  230   1HE   LYS  33          HE2       LYS  33   2.311   8.150   0.358
  231   2HE   LYS  33          HE1       LYS  33   3.656   7.354   1.175
  232   1HZ   LYS  33          HZ1       LYS  33   3.582  10.221   0.399
  233   2HZ   LYS  33          HZ2       LYS  33   4.833   9.449   1.236
  234   3HZ   LYS  33          HZ3       LYS  33   3.315   9.626   1.960
  235    H    ILE  34           HN       ILE  34   1.751   6.463   1.327
  236    HA   ILE  34           HA       ILE  34  -0.968   5.497   0.842
  237    HB   ILE  34           HB       ILE  34   0.010   5.155   3.098
  238   1HG1  ILE  34          HG12      ILE  34  -2.164   7.072   3.645
  239   2HG1  ILE  34          HG11      ILE  34  -2.532   5.847   2.434
  240   1HG2  ILE  34          HG21      ILE  34  -0.249   8.114   3.518
  241   2HG2  ILE  34          HG22      ILE  34   1.269   7.368   3.026
  242   3HG2  ILE  34          HG23      ILE  34   0.520   6.915   4.556
  243   1HD1  ILE  34          HD11      ILE  34  -1.363   4.394   4.447
  244   2HD1  ILE  34          HD12      ILE  34  -3.094   4.556   4.152
  245   3HD1  ILE  34          HD13      ILE  34  -2.295   5.612   5.316
  246    H    ILE  35           HN       ILE  35  -2.255   6.801  -0.287
  247    HA   ILE  35           HA       ILE  35  -1.777   9.695  -0.147
  248    HB   ILE  35           HB       ILE  35  -3.637   9.326  -2.182
  249   1HG1  ILE  35          HG12      ILE  35  -2.377   7.658  -3.654
  250   2HG1  ILE  35          HG11      ILE  35  -1.610   7.085  -2.179
  251   1HG2  ILE  35          HG21      ILE  35  -1.376  10.667  -1.858
  252   2HG2  ILE  35          HG22      ILE  35  -2.086  10.387  -3.448
  253   3HG2  ILE  35          HG23      ILE  35  -0.761   9.369  -2.881
  254   1HD1  ILE  35          HD11      ILE  35  -4.507   6.954  -2.939
  255   2HD1  ILE  35          HD12      ILE  35  -3.942   6.678  -1.291
  256   3HD1  ILE  35          HD13      ILE  35  -3.398   5.626  -2.598
  257    H    SER  36           HN       SER  36  -4.864   8.430  -1.236
  258    HA   SER  36           HA       SER  36  -6.427   8.269   0.946
  259   1HB   SER  36          HB2       SER  36  -7.336  10.739   1.016
  260   2HB   SER  36          HB1       SER  36  -5.916  10.293   1.960
  261    HG   SER  36           HG       SER  36  -4.913  11.779   0.885
  262    H    ALA  37           HN       ALA  37  -6.424   7.502  -1.775
  263    HA   ALA  37           HA       ALA  37  -9.106   7.614  -2.422
  264   1HB   ALA  37          HB1       ALA  37  -8.783   9.151  -4.536
  265   2HB   ALA  37          HB2       ALA  37  -7.540   9.889  -3.526
  266   3HB   ALA  37          HB3       ALA  37  -9.211   9.833  -2.966
  267    H    SER  38           HN       SER  38  -6.538   8.301  -4.749
  268    HA   SER  38           HA       SER  38  -6.048   5.567  -5.391
  269   1HB   SER  38          HB2       SER  38  -8.244   6.914  -6.733
  270   2HB   SER  38          HB1       SER  38  -7.015   6.380  -7.880
  271    HG   SER  38           HG       SER  38  -7.181   4.288  -6.912
  272    H    THR  39           HN       THR  39  -5.984   8.916  -6.549
  273    HA   THR  39           HA       THR  39  -3.945   8.720  -8.419
  274    HB   THR  39           HB       THR  39  -5.120  10.768  -8.296
  275    HG1  THR  39           HG1      THR  39  -3.367  11.808  -8.710
  276   1HG2  THR  39          HG21      THR  39  -5.964  11.439  -6.365
  277   2HG2  THR  39          HG22      THR  39  -4.372  12.109  -6.003
  278   3HG2  THR  39          HG23      THR  39  -4.798  10.492  -5.440
  279    H    CYS  40           HN       CYS  40  -1.760   8.597  -8.346
  280    HA   CYS  40           HA       CYS  40  -0.494   8.635  -5.689
  281   1HB   CYS  40          HB2       CYS  40   0.359   6.804  -7.928
  282   2HB   CYS  40          HB1       CYS  40   0.848   6.751  -6.238
  283    HA   PRO  41           HA       PRO  41   2.320  11.633  -7.244
  284   1HB   PRO  41          HB2       PRO  41   4.584  10.917  -5.858
  285   2HB   PRO  41          HB1       PRO  41   3.246  11.845  -5.174
  286   1HG   PRO  41          HG2       PRO  41   3.819   8.913  -4.965
  287   2HG   PRO  41          HG1       PRO  41   3.271  10.040  -3.709
  288   1HD   PRO  41          HD2       PRO  41   1.566   8.368  -4.916
  289   2HD   PRO  41          HD1       PRO  41   1.080  10.016  -4.468
  290    H    SER  42           HN       SER  42   4.652   9.035  -6.684
  291    HA   SER  42           HA       SER  42   6.194   9.433  -8.881
  292   1HB   SER  42          HB2       SER  42   7.060   7.189  -8.597
  293   2HB   SER  42          HB1       SER  42   6.730   7.885  -7.012
  294    HG   SER  42           HG       SER  42   5.920   5.608  -7.765
  295    H    ASP  43           HN       ASP  43   4.604   6.307  -9.097
  296    HA   ASP  43           HA       ASP  43   2.903   6.949 -11.268
  297   1HB   ASP  43          HB2       ASP  43   5.224   7.205 -12.286
  298   2HB   ASP  43          HB1       ASP  43   5.394   5.462 -12.092
  299    H    TYR  44           HN       TYR  44   2.851   5.383  -8.831
  300    HA   TYR  44           HA       TYR  44   2.485   2.681  -9.917
  301   1HB   TYR  44          HB2       TYR  44   2.169   2.275  -7.272
  302   2HB   TYR  44          HB1       TYR  44   3.720   2.177  -8.088
  303    HD1  TYR  44           HD1      TYR  44   1.697   5.101  -6.909
  304    HD2  TYR  44           HD2      TYR  44   5.351   2.939  -6.658
  305    HE1  TYR  44           HE1      TYR  44   2.595   6.802  -5.376
  306    HE2  TYR  44           HE2      TYR  44   6.258   4.635  -5.127
  307    HH   TYR  44           HH       TYR  44   5.334   7.508  -4.810
  308    HA   PRO  45           HA       PRO  45  -1.813   4.246  -9.587
  309   1HB   PRO  45          HB2       PRO  45  -2.765   2.805 -11.673
  310   2HB   PRO  45          HB1       PRO  45  -1.925   4.347 -11.878
  311   1HG   PRO  45          HG2       PRO  45  -0.861   1.559 -12.159
  312   2HG   PRO  45          HG1       PRO  45  -0.608   2.963 -13.214
  313   1HD   PRO  45          HD2       PRO  45   1.226   2.174 -11.394
  314   2HD   PRO  45          HD1       PRO  45   0.985   3.880 -11.822
  315    H    LYS  46           HN       LYS  46  -1.147   2.557  -7.633
  316    HA   LYS  46           HA       LYS  46  -2.283  -0.045  -7.854
  317   1HB   LYS  46          HB2       LYS  46  -0.928  -0.156  -6.076
  318   2HB   LYS  46          HB1       LYS  46  -0.961   1.576  -5.847
  319   1HG   LYS  46          HG2       LYS  46  -2.145   1.273  -4.008
  320   2HG   LYS  46          HG1       LYS  46  -3.459   0.621  -4.973
  321   1HD   LYS  46          HD2       LYS  46  -2.278  -1.605  -4.870
  322   2HD   LYS  46          HD1       LYS  46  -1.209  -0.885  -3.666
  323   1HE   LYS  46          HE2       LYS  46  -2.698  -1.334  -2.096
  324   2HE   LYS  46          HE1       LYS  46  -3.849  -0.276  -2.904
  325   1HZ   LYS  46          HZ1       LYS  46  -5.057  -2.021  -3.493
  326   2HZ   LYS  46          HZ2       LYS  46  -4.044  -3.010  -2.570
  327   3HZ   LYS  46          HZ3       LYS  46  -3.730  -2.782  -4.216
  Start of MODEL   17
    1   1H    LYS   1          HT1       LYS   1  -7.888   1.960  -1.814
    2   2H    LYS   1          HT2       LYS   1  -7.629   0.342  -1.302
    3   3H    LYS   1          HT3       LYS   1  -8.945   0.717  -2.339
    4    HA   LYS   1           HA       LYS   1  -7.314  -0.266  -3.644
    5   1HB   LYS   1          HB2       LYS   1  -8.268   2.366  -3.972
    6   2HB   LYS   1          HB1       LYS   1  -6.585   2.400  -4.477
    7   1HG   LYS   1          HG2       LYS   1  -8.748   0.597  -5.540
    8   2HG   LYS   1          HG1       LYS   1  -7.991   1.957  -6.374
    9   1HD   LYS   1          HD2       LYS   1  -6.596  -0.566  -5.481
   10   2HD   LYS   1          HD1       LYS   1  -7.080  -0.184  -7.134
   11   1HE   LYS   1          HE2       LYS   1  -5.615   1.809  -7.057
   12   2HE   LYS   1          HE1       LYS   1  -5.083   1.320  -5.448
   13   1HZ   LYS   1          HZ1       LYS   1  -4.856  -0.682  -7.545
   14   2HZ   LYS   1          HZ2       LYS   1  -3.802  -0.322  -6.274
   15   3HZ   LYS   1          HZ3       LYS   1  -3.808   0.639  -7.665
   16    H    SER   2           HN       SER   2  -5.915   2.583  -2.021
   17    HA   SER   2           HA       SER   2  -3.813   3.036  -1.288
   18   1HB   SER   2          HB2       SER   2  -4.224   0.275  -0.761
   19   2HB   SER   2          HB1       SER   2  -2.557   0.488  -1.289
   20    HG   SER   2           HG       SER   2  -3.810   2.028   0.736
   21    H    CYS   3           HN       CYS   3  -1.470   2.886  -1.874
   22    HA   CYS   3           HA       CYS   3  -1.145   2.341  -4.751
   23   1HB   CYS   3          HB2       CYS   3  -1.260   4.755  -4.361
   24   2HB   CYS   3          HB1       CYS   3   0.021   4.638  -3.162
   25    H    CYS   4           HN       CYS   4   0.969   1.690  -5.439
   26    HA   CYS   4           HA       CYS   4   2.960   1.121  -3.412
   27   1HB   CYS   4          HB2       CYS   4   1.430  -1.056  -4.820
   28   2HB   CYS   4          HB1       CYS   4   3.037  -1.328  -4.159
   29    HA   PRO   5           HA       PRO   5   5.631   1.624  -6.896
   30   1HB   PRO   5          HB2       PRO   5   7.891   0.493  -5.997
   31   2HB   PRO   5          HB1       PRO   5   7.252   1.979  -5.282
   32   1HG   PRO   5          HG2       PRO   5   7.052  -0.837  -4.293
   33   2HG   PRO   5          HG1       PRO   5   7.383   0.647  -3.382
   34   1HD   PRO   5          HD2       PRO   5   4.920  -0.555  -3.509
   35   2HD   PRO   5          HD1       PRO   5   5.163   1.174  -3.205
   36    H    ASN   6           HN       ASN   6   5.106  -1.586  -5.603
   37    HA   ASN   6           HA       ASN   6   4.971  -2.745  -8.197
   38   1HB   ASN   6          HB2       ASN   6   6.849  -4.439  -7.681
   39   2HB   ASN   6          HB1       ASN   6   7.314  -2.840  -8.254
   40   1HD2  ASN   6          HD21      ASN   6   9.377  -3.447  -7.286
   41   2HD2  ASN   6          HD22      ASN   6   9.623  -3.155  -5.602
   42    H    THR   7           HN       THR   7   4.838  -5.251  -7.956
   43    HA   THR   7           HA       THR   7   2.698  -5.831  -6.258
   44    HB   THR   7           HB       THR   7   2.925  -7.198  -8.156
   45    HG1  THR   7           HG1      THR   7   2.927  -9.228  -7.287
   46   1HG2  THR   7          HG21      THR   7   4.960  -8.778  -8.312
   47   2HG2  THR   7          HG22      THR   7   5.757  -7.573  -7.300
   48   3HG2  THR   7          HG23      THR   7   5.111  -7.113  -8.875
   49    H    THR   8           HN       THR   8   6.150  -6.124  -5.771
   50    HA   THR   8           HA       THR   8   6.167  -7.859  -3.581
   51    HB   THR   8           HB       THR   8   8.316  -6.587  -2.972
   52    HG1  THR   8           HG1      THR   8   7.567  -4.683  -4.207
   53   1HG2  THR   8          HG21      THR   8   8.156  -8.658  -4.434
   54   2HG2  THR   8          HG22      THR   8   9.590  -7.647  -4.615
   55   3HG2  THR   8          HG23      THR   8   8.292  -7.557  -5.805
   56    H    GLY   9           HN       GLY   9   5.064  -4.615  -3.812
   57   1HA   GLY   9          HA2       GLY   9   5.153  -4.291  -0.891
   58   2HA   GLY   9          HA1       GLY   9   4.866  -3.001  -2.053
   59    H    ARG  10           HN       ARG  10   2.993  -4.382  -3.649
   60    HA   ARG  10           HA       ARG  10   0.599  -3.766  -2.336
   61   1HB   ARG  10          HB2       ARG  10   0.753  -3.730  -4.748
   62   2HB   ARG  10          HB1       ARG  10   1.172  -5.437  -4.790
   63   1HG   ARG  10          HG2       ARG  10  -1.046  -5.420  -5.414
   64   2HG   ARG  10          HG1       ARG  10  -1.122  -5.805  -3.694
   65   1HD   ARG  10          HD2       ARG  10  -2.794  -4.123  -4.364
   66   2HD   ARG  10          HD1       ARG  10  -1.656  -3.512  -3.163
   67    HE   ARG  10           HE       ARG  10  -0.881  -2.920  -5.860
   68   1HH1  ARG  10          HH11      ARG  10  -2.839  -1.882  -3.165
   69   2HH1  ARG  10          HH12      ARG  10  -2.870  -0.225  -3.664
   70   1HH2  ARG  10          HH21      ARG  10  -0.921  -0.739  -6.517
   71   2HH2  ARG  10          HH22      ARG  10  -1.781   0.423  -5.566
   72    H    ASN  11           HN       ASN  11   2.442  -6.722  -2.654
   73    HA   ASN  11           HA       ASN  11   0.489  -8.545  -1.790
   74   1HB   ASN  11          HB2       ASN  11   3.501  -8.580  -1.752
   75   2HB   ASN  11          HB1       ASN  11   2.531  -9.938  -1.220
   76   1HD2  ASN  11          HD21      ASN  11   4.392  -9.297  -3.570
   77   2HD2  ASN  11          HD22      ASN  11   3.519  -9.887  -4.939
   78    H    ILE  12           HN       ILE  12   3.279  -7.275   0.068
   79    HA   ILE  12           HA       ILE  12   2.422  -8.267   2.526
   80    HB   ILE  12           HB       ILE  12   4.160  -5.898   1.860
   81   1HG1  ILE  12          HG12      ILE  12   5.685  -7.678   3.238
   82   2HG1  ILE  12          HG11      ILE  12   4.544  -8.765   2.454
   83   1HG2  ILE  12          HG21      ILE  12   3.146  -6.790   4.514
   84   2HG2  ILE  12          HG22      ILE  12   3.481  -5.163   3.921
   85   3HG2  ILE  12          HG23      ILE  12   4.811  -6.220   4.393
   86   1HD1  ILE  12          HD11      ILE  12   6.687  -7.105   1.299
   87   2HD1  ILE  12          HD12      ILE  12   5.205  -7.261   0.357
   88   3HD1  ILE  12          HD13      ILE  12   6.103  -8.703   0.832
   89    H    TYR  13           HN       TYR  13   1.733  -5.131   1.024
   90    HA   TYR  13           HA       TYR  13   0.262  -4.100   3.189
   91   1HB   TYR  13          HB2       TYR  13   1.195  -2.991   0.986
   92   2HB   TYR  13          HB1       TYR  13  -0.413  -3.363   0.382
   93    HD1  TYR  13           HD1      TYR  13  -2.413  -2.433   1.643
   94    HD2  TYR  13           HD2      TYR  13   1.570  -1.122   2.356
   95    HE1  TYR  13           HE1      TYR  13  -3.281  -0.397   2.716
   96    HE2  TYR  13           HE2      TYR  13   0.714   0.917   3.431
   97    HH   TYR  13           HH       TYR  13  -1.323   1.694   4.544
   98    H    ASN  14           HN       ASN  14  -0.613  -6.089   0.421
   99    HA   ASN  14           HA       ASN  14  -3.414  -5.983   0.839
  100   1HB   ASN  14          HB2       ASN  14  -1.547  -7.601  -0.814
  101   2HB   ASN  14          HB1       ASN  14  -3.147  -8.262  -0.520
  102   1HD2  ASN  14          HD21      ASN  14  -2.075  -4.921  -0.966
  103   2HD2  ASN  14          HD22      ASN  14  -3.079  -4.600  -2.335
  104    H    THR  15           HN       THR  15  -1.075  -8.645   1.445
  105    HA   THR  15           HA       THR  15  -2.863 -10.252   2.878
  106    HB   THR  15           HB       THR  15  -0.933 -11.381   2.287
  107    HG1  THR  15           HG1      THR  15  -0.418 -12.218   4.141
  108   1HG2  THR  15          HG21      THR  15   1.305 -10.275   3.432
  109   2HG2  THR  15          HG22      THR  15   0.426  -8.875   2.818
  110   3HG2  THR  15          HG23      THR  15   0.856 -10.193   1.728
  111    H    CYS  16           HN       CYS  16  -0.672  -7.700   3.981
  112    HA   CYS  16           HA       CYS  16  -1.019  -7.931   6.725
  113   1HB   CYS  16          HB2       CYS  16   0.599  -6.382   5.984
  114   2HB   CYS  16          HB1       CYS  16  -0.535  -5.577   4.908
  115    H    ARG  17           HN       ARG  17  -2.889  -5.984   4.408
  116    HA   ARG  17           HA       ARG  17  -4.824  -5.045   6.212
  117   1HB   ARG  17          HB2       ARG  17  -4.416  -5.115   3.336
  118   2HB   ARG  17          HB1       ARG  17  -6.113  -5.325   3.751
  119   1HG   ARG  17          HG2       ARG  17  -4.710  -3.154   5.163
  120   2HG   ARG  17          HG1       ARG  17  -4.930  -2.933   3.426
  121   1HD   ARG  17          HD2       ARG  17  -7.389  -3.786   4.102
  122   2HD   ARG  17          HD1       ARG  17  -6.922  -2.995   5.607
  123    HE   ARG  17           HE       ARG  17  -7.180  -0.985   4.565
  124   1HH1  ARG  17          HH11      ARG  17  -6.797  -3.444   2.120
  125   2HH1  ARG  17          HH12      ARG  17  -7.103  -2.361   0.804
  126   1HH2  ARG  17          HH21      ARG  17  -7.582   0.441   2.836
  127   2HH2  ARG  17          HH22      ARG  17  -7.548  -0.154   1.210
  128    H    LEU  18           HN       LEU  18  -4.486  -8.045   4.470
  129    HA   LEU  18           HA       LEU  18  -7.075  -9.043   4.667
  130   1HB   LEU  18          HB2       LEU  18  -6.176 -10.863   3.704
  131   2HB   LEU  18          HB1       LEU  18  -4.694  -9.935   3.657
  132    HG   LEU  18           HG       LEU  18  -4.228 -10.952   5.969
  133   1HD1  LEU  18          HD11      LEU  18  -5.951 -12.148   6.765
  134   2HD1  LEU  18          HD12      LEU  18  -5.348 -13.417   5.700
  135   3HD1  LEU  18          HD13      LEU  18  -6.662 -12.369   5.166
  136   1HD2  LEU  18          HD21      LEU  18  -3.571 -13.180   4.713
  137   2HD2  LEU  18          HD22      LEU  18  -2.756 -11.655   4.374
  138   3HD2  LEU  18          HD23      LEU  18  -4.026 -12.233   3.297
  139    H    GLY  19           HN       GLY  19  -4.663  -8.592   7.078
  140   1HA   GLY  19          HA2       GLY  19  -6.033 -10.361   8.962
  141   2HA   GLY  19          HA1       GLY  19  -4.481  -9.581   9.221
  142    H    GLY  20           HN       GLY  20  -6.543  -7.332   7.918
  143   1HA   GLY  20          HA2       GLY  20  -7.677  -5.538   8.773
  144   2HA   GLY  20          HA1       GLY  20  -8.165  -6.596  10.087
  145    H    GLY  21           HN       GLY  21  -4.954  -5.355   9.111
  146   1HA   GLY  21          HA2       GLY  21  -4.623  -4.438  11.876
  147   2HA   GLY  21          HA1       GLY  21  -3.315  -4.834  10.769
  148    H    SER  22           HN       SER  22  -2.521  -2.751  11.481
  149    HA   SER  22           HA       SER  22  -3.861  -0.345  10.763
  150   1HB   SER  22          HB2       SER  22  -1.004   0.004  10.951
  151   2HB   SER  22          HB1       SER  22  -2.279   0.622  11.997
  152    HG   SER  22           HG       SER  22  -2.250  -1.401  13.081
  153    H    ARG  23           HN       ARG  23  -3.352   1.127   9.158
  154    HA   ARG  23           HA       ARG  23  -2.757  -0.031   6.625
  155   1HB   ARG  23          HB2       ARG  23  -4.027   2.296   7.534
  156   2HB   ARG  23          HB1       ARG  23  -2.640   2.855   6.611
  157   1HG   ARG  23          HG2       ARG  23  -4.028   2.676   4.865
  158   2HG   ARG  23          HG1       ARG  23  -3.623   0.961   4.948
  159   1HD   ARG  23          HD2       ARG  23  -5.891   0.787   4.970
  160   2HD   ARG  23          HD1       ARG  23  -5.614   0.968   6.702
  161    HE   ARG  23           HE       ARG  23  -5.927   3.521   5.717
  162   1HH1  ARG  23          HH11      ARG  23  -7.841   0.606   5.841
  163   2HH1  ARG  23          HH12      ARG  23  -9.353   1.450   5.881
  164   1HH2  ARG  23          HH21      ARG  23  -7.914   4.634   5.769
  165   2HH2  ARG  23          HH22      ARG  23  -9.394   3.736   5.839
  166    H    GLU  24           HN       GLU  24  -1.114   2.174   8.780
  167    HA   GLU  24           HA       GLU  24   1.167   2.590   7.141
  168   1HB   GLU  24          HB2       GLU  24   2.124   3.263   9.523
  169   2HB   GLU  24          HB1       GLU  24   0.978   4.286   8.665
  170   1HG   GLU  24          HG2       GLU  24  -0.788   3.680  10.037
  171   2HG   GLU  24          HG1       GLU  24   0.015   2.211  10.587
  172    H    ARG  25           HN       ARG  25   0.299   0.152   9.478
  173    HA   ARG  25           HA       ARG  25   2.802  -0.802  10.208
  174   1HB   ARG  25          HB2       ARG  25   0.463  -1.511  11.028
  175   2HB   ARG  25          HB1       ARG  25   0.477  -2.634   9.676
  176   1HG   ARG  25          HG2       ARG  25   2.309  -3.827  10.554
  177   2HG   ARG  25          HG1       ARG  25   2.663  -2.563  11.733
  178   1HD   ARG  25          HD2       ARG  25   0.215  -3.088  12.538
  179   2HD   ARG  25          HD1       ARG  25   0.519  -4.634  11.746
  180    HE   ARG  25           HE       ARG  25   1.570  -3.765  14.237
  181   1HH1  ARG  25          HH11      ARG  25   2.363  -5.638  11.401
  182   2HH1  ARG  25          HH12      ARG  25   3.496  -6.649  12.233
  183   1HH2  ARG  25          HH21      ARG  25   3.060  -5.093  15.333
  184   2HH2  ARG  25          HH22      ARG  25   3.892  -6.341  14.464
  185    H    CYS  26           HN       CYS  26   0.787  -1.745   7.450
  186    HA   CYS  26           HA       CYS  26   2.707  -3.581   6.409
  187   1HB   CYS  26          HB2       CYS  26   0.903  -2.503   4.388
  188   2HB   CYS  26          HB1       CYS  26   1.110  -4.157   4.943
  189    H    ALA  27           HN       ALA  27   1.897  -0.211   5.773
  190    HA   ALA  27           HA       ALA  27   3.461   0.245   3.527
  191   1HB   ALA  27          HB1       ALA  27   1.850   1.801   4.958
  192   2HB   ALA  27          HB2       ALA  27   3.069   2.463   3.871
  193   3HB   ALA  27          HB3       ALA  27   3.391   2.366   5.603
  194    H    SER  28           HN       SER  28   4.372   0.440   6.957
  195    HA   SER  28           HA       SER  28   7.078   1.130   6.439
  196   1HB   SER  28          HB2       SER  28   7.376   0.364   8.874
  197   2HB   SER  28          HB1       SER  28   6.274   1.711   8.588
  198    HG   SER  28           HG       SER  28   5.765  -0.731   9.635
  199    H    LEU  29           HN       LEU  29   5.291  -1.826   6.584
  200    HA   LEU  29           HA       LEU  29   7.469  -3.605   6.991
  201   1HB   LEU  29          HB2       LEU  29   4.768  -3.852   7.018
  202   2HB   LEU  29          HB1       LEU  29   5.133  -4.561   5.458
  203    HG   LEU  29           HG       LEU  29   4.969  -6.209   7.318
  204   1HD1  LEU  29          HD11      LEU  29   7.391  -7.150   6.803
  205   2HD1  LEU  29          HD12      LEU  29   7.341  -5.890   5.569
  206   3HD1  LEU  29          HD13      LEU  29   6.108  -7.151   5.593
  207   1HD2  LEU  29          HD21      LEU  29   7.654  -5.455   8.294
  208   2HD2  LEU  29          HD22      LEU  29   6.295  -6.181   9.151
  209   3HD2  LEU  29          HD23      LEU  29   6.306  -4.448   8.822
  210    H    SER  30           HN       SER  30   5.562  -2.891   4.059
  211    HA   SER  30           HA       SER  30   7.686  -4.019   2.420
  212   1HB   SER  30          HB2       SER  30   4.846  -3.799   2.181
  213   2HB   SER  30          HB1       SER  30   5.593  -3.006   0.794
  214    HG   SER  30           HG       SER  30   6.883  -4.987   0.610
  215    H    GLY  31           HN       GLY  31   5.846  -0.981   2.645
  216   1HA   GLY  31          HA2       GLY  31   7.215   1.086   2.610
  217   2HA   GLY  31          HA1       GLY  31   8.112   0.350   1.291
  218    H    CYS  32           HN       CYS  32   4.629   0.159   1.634
  219    HA   CYS  32           HA       CYS  32   4.312   1.387  -0.969
  220   1HB   CYS  32          HB2       CYS  32   2.508  -0.101   0.909
  221   2HB   CYS  32          HB1       CYS  32   1.833   0.816  -0.427
  222    H    LYS  33           HN       LYS  33   2.015   2.685  -0.977
  223    HA   LYS  33           HA       LYS  33   1.888   4.586   1.213
  224   1HB   LYS  33          HB2       LYS  33   3.657   5.369  -0.466
  225   2HB   LYS  33          HB1       LYS  33   2.321   5.637  -1.576
  226   1HG   LYS  33          HG2       LYS  33   2.895   7.704  -0.502
  227   2HG   LYS  33          HG1       LYS  33   1.308   7.178   0.062
  228   1HD   LYS  33          HD2       LYS  33   2.672   8.011   1.910
  229   2HD   LYS  33          HD1       LYS  33   2.323   6.293   2.103
  230   1HE   LYS  33          HE2       LYS  33   4.488   5.679   1.789
  231   2HE   LYS  33          HE1       LYS  33   4.813   7.000   0.669
  232   1HZ   LYS  33          HZ1       LYS  33   5.018   8.516   2.469
  233   2HZ   LYS  33          HZ2       LYS  33   5.976   7.174   2.842
  234   3HZ   LYS  33          HZ3       LYS  33   4.473   7.374   3.592
  235    H    ILE  34           HN       ILE  34   0.030   6.032   1.036
  236    HA   ILE  34           HA       ILE  34  -2.201   4.670  -0.226
  237    HB   ILE  34           HB       ILE  34  -2.433   7.195   1.384
  238   1HG1  ILE  34          HG12      ILE  34  -1.090   5.795   2.790
  239   2HG1  ILE  34          HG11      ILE  34  -2.743   5.697   3.388
  240   1HG2  ILE  34          HG21      ILE  34  -4.595   6.091   2.032
  241   2HG2  ILE  34          HG22      ILE  34  -4.240   4.855   0.826
  242   3HG2  ILE  34          HG23      ILE  34  -4.455   6.534   0.331
  243   1HD1  ILE  34          HD11      ILE  34  -1.027   3.594   2.677
  244   2HD1  ILE  34          HD12      ILE  34  -2.310   3.629   1.469
  245   3HD1  ILE  34          HD13      ILE  34  -2.715   3.498   3.180
  246    H    ILE  35           HN       ILE  35  -3.815   5.857  -1.464
  247    HA   ILE  35           HA       ILE  35  -2.664   7.323  -3.581
  248    HB   ILE  35           HB       ILE  35  -5.603   7.445  -2.988
  249   1HG1  ILE  35          HG12      ILE  35  -5.113   5.118  -2.644
  250   2HG1  ILE  35          HG11      ILE  35  -5.807   5.277  -4.253
  251   1HG2  ILE  35          HG21      ILE  35  -5.218   8.647  -4.893
  252   2HG2  ILE  35          HG22      ILE  35  -5.493   7.046  -5.580
  253   3HG2  ILE  35          HG23      ILE  35  -3.848   7.649  -5.379
  254   1HD1  ILE  35          HD11      ILE  35  -3.023   4.618  -3.447
  255   2HD1  ILE  35          HD12      ILE  35  -3.309   5.416  -4.994
  256   3HD1  ILE  35          HD13      ILE  35  -4.062   3.858  -4.653
  257    H    SER  36           HN       SER  36  -3.340   9.485  -4.289
  258    HA   SER  36           HA       SER  36  -4.168  11.337  -2.211
  259   1HB   SER  36          HB2       SER  36  -1.465  11.487  -3.562
  260   2HB   SER  36          HB1       SER  36  -2.196  12.836  -2.694
  261    HG   SER  36           HG       SER  36  -0.937  10.619  -1.728
  262    H    ALA  37           HN       ALA  37  -5.988  11.612  -3.552
  263    HA   ALA  37           HA       ALA  37  -7.220  12.808  -5.060
  264   1HB   ALA  37          HB1       ALA  37  -4.803  14.039  -6.297
  265   2HB   ALA  37          HB2       ALA  37  -5.244  14.491  -4.650
  266   3HB   ALA  37          HB3       ALA  37  -6.386  14.744  -5.969
  267    H    SER  38           HN       SER  38  -6.691  10.241  -5.659
  268    HA   SER  38           HA       SER  38  -6.934   8.801  -7.411
  269   1HB   SER  38          HB2       SER  38  -6.356  10.786  -9.521
  270   2HB   SER  38          HB1       SER  38  -7.622   9.566  -9.438
  271    HG   SER  38           HG       SER  38  -8.700  10.924  -7.930
  272    H    THR  39           HN       THR  39  -4.467  11.250  -8.240
  273    HA   THR  39           HA       THR  39  -2.708   9.268  -9.341
  274    HB   THR  39           HB       THR  39  -2.578  11.448 -10.290
  275    HG1  THR  39           HG1      THR  39  -0.320  11.217  -8.596
  276   1HG2  THR  39          HG21      THR  39  -3.389  12.969  -8.752
  277   2HG2  THR  39          HG22      THR  39  -1.669  13.354  -8.824
  278   3HG2  THR  39          HG23      THR  39  -2.306  12.411  -7.477
  279    H    CYS  40           HN       CYS  40  -0.958   8.299  -8.424
  280    HA   CYS  40           HA       CYS  40  -0.871   7.951  -5.652
  281   1HB   CYS  40          HB2       CYS  40   0.996   7.293  -7.897
  282   2HB   CYS  40          HB1       CYS  40   1.540   7.082  -6.237
  283    HA   PRO  41           HA       PRO  41   1.266  11.418  -3.995
  284   1HB   PRO  41          HB2       PRO  41   2.906  10.132  -2.170
  285   2HB   PRO  41          HB1       PRO  41   1.222  10.575  -1.885
  286   1HG   PRO  41          HG2       PRO  41   2.381   7.944  -2.688
  287   2HG   PRO  41          HG1       PRO  41   1.047   8.292  -1.572
  288   1HD   PRO  41          HD2       PRO  41   0.602   7.402  -4.066
  289   2HD   PRO  41          HD1       PRO  41  -0.480   8.577  -3.289
  290    H    SER  42           HN       SER  42   3.723   8.857  -3.795
  291    HA   SER  42           HA       SER  42   5.844  10.510  -4.561
  292   1HB   SER  42          HB2       SER  42   5.472   7.543  -4.377
  293   2HB   SER  42          HB1       SER  42   6.935   8.184  -5.125
  294    HG   SER  42           HG       SER  42   5.988   8.635  -2.492
  295    H    ASP  43           HN       ASP  43   5.049   7.667  -6.517
  296    HA   ASP  43           HA       ASP  43   4.208   8.910  -8.845
  297   1HB   ASP  43          HB2       ASP  43   7.094   9.129  -8.382
  298   2HB   ASP  43          HB1       ASP  43   6.695   8.402  -9.935
  299    H    TYR  44           HN       TYR  44   3.739   6.518  -7.437
  300    HA   TYR  44           HA       TYR  44   4.851   4.420  -9.139
  301   1HB   TYR  44          HB2       TYR  44   2.997   3.916  -6.835
  302   2HB   TYR  44          HB1       TYR  44   4.242   2.867  -7.500
  303    HD1  TYR  44           HD1      TYR  44   3.523   4.278  -4.610
  304    HD2  TYR  44           HD2      TYR  44   6.609   4.553  -7.524
  305    HE1  TYR  44           HE1      TYR  44   5.085   5.048  -2.874
  306    HE2  TYR  44           HE2      TYR  44   8.180   5.323  -5.797
  307    HH   TYR  44           HH       TYR  44   7.634   6.623  -3.260
  308    HA   PRO  45           HA       PRO  45   0.991   4.212 -11.328
  309   1HB   PRO  45          HB2       PRO  45   1.576   2.223 -12.996
  310   2HB   PRO  45          HB1       PRO  45   2.446   3.761 -13.081
  311   1HG   PRO  45          HG2       PRO  45   3.312   1.153 -11.917
  312   2HG   PRO  45          HG1       PRO  45   4.262   2.358 -12.804
  313   1HD   PRO  45          HD2       PRO  45   4.153   2.068 -10.017
  314   2HD   PRO  45          HD1       PRO  45   4.786   3.472 -10.897
  315    H    LYS  46           HN       LYS  46   1.463   2.480  -8.755
  316    HA   LYS  46           HA       LYS  46  -0.503   0.403  -9.422
  317   1HB   LYS  46          HB2       LYS  46   1.996   0.087  -8.287
  318   2HB   LYS  46          HB1       LYS  46   0.916   0.038  -6.901
  319   1HG   LYS  46          HG2       LYS  46   1.056  -2.179  -7.514
  320   2HG   LYS  46          HG1       LYS  46  -0.432  -1.657  -8.305
  321   1HD   LYS  46          HD2       LYS  46   1.289  -1.103 -10.266
  322   2HD   LYS  46          HD1       LYS  46   2.188  -2.400  -9.477
  323   1HE   LYS  46          HE2       LYS  46   0.843  -3.400 -11.164
  324   2HE   LYS  46          HE1       LYS  46   0.111  -3.796  -9.609
  325   1HZ   LYS  46          HZ1       LYS  46  -1.739  -3.097 -10.653
  326   2HZ   LYS  46          HZ2       LYS  46  -0.902  -2.136 -11.765
  327   3HZ   LYS  46          HZ3       LYS  46  -1.191  -1.561 -10.201
  Start of MODEL   18
    1   1H    LYS   1          HT1       LYS   1  -6.355   4.137   1.735
    2   2H    LYS   1          HT2       LYS   1  -7.502   4.468   0.501
    3   3H    LYS   1          HT3       LYS   1  -6.227   5.574   0.807
    4    HA   LYS   1           HA       LYS   1  -5.760   2.798  -0.028
    5   1HB   LYS   1          HB2       LYS   1  -6.673   5.148  -1.556
    6   2HB   LYS   1          HB1       LYS   1  -5.253   4.361  -2.220
    7   1HG   LYS   1          HG2       LYS   1  -7.356   2.478  -1.508
    8   2HG   LYS   1          HG1       LYS   1  -7.863   3.673  -2.703
    9   1HD   LYS   1          HD2       LYS   1  -6.969   2.116  -4.118
   10   2HD   LYS   1          HD1       LYS   1  -5.514   3.050  -3.774
   11   1HE   LYS   1          HE2       LYS   1  -4.676   1.447  -2.306
   12   2HE   LYS   1          HE1       LYS   1  -6.254   0.698  -2.073
   13   1HZ   LYS   1          HZ1       LYS   1  -4.459   0.462  -4.432
   14   2HZ   LYS   1          HZ2       LYS   1  -6.082   0.010  -4.500
   15   3HZ   LYS   1          HZ3       LYS   1  -5.039  -0.774  -3.437
   16    H    SER   2           HN       SER   2  -3.753   3.020  -1.516
   17    HA   SER   2           HA       SER   2  -1.806   4.970  -1.056
   18   1HB   SER   2          HB2       SER   2  -1.459   2.487   0.548
   19   2HB   SER   2          HB1       SER   2  -0.174   3.630   0.236
   20    HG   SER   2           HG       SER   2  -1.369   3.854   2.274
   21    H    CYS   3           HN       CYS   3   0.389   4.079  -1.791
   22    HA   CYS   3           HA       CYS   3   0.108   1.944  -3.694
   23   1HB   CYS   3          HB2       CYS   3   0.840   4.726  -4.591
   24   2HB   CYS   3          HB1       CYS   3   0.712   3.298  -5.597
   25    H    CYS   4           HN       CYS   4   1.933   1.011  -4.402
   26    HA   CYS   4           HA       CYS   4   4.500   2.000  -3.297
   27   1HB   CYS   4          HB2       CYS   4   3.104  -0.293  -2.564
   28   2HB   CYS   4          HB1       CYS   4   4.345  -0.883  -3.658
   29    HA   PRO   5           HA       PRO   5   6.003   1.705  -7.455
   30   1HB   PRO   5          HB2       PRO   5   8.625   1.111  -6.919
   31   2HB   PRO   5          HB1       PRO   5   7.919   2.728  -6.860
   32   1HG   PRO   5          HG2       PRO   5   8.498   0.828  -4.634
   33   2HG   PRO   5          HG1       PRO   5   8.695   2.589  -4.689
   34   1HD   PRO   5          HD2       PRO   5   6.611   1.419  -3.435
   35   2HD   PRO   5          HD1       PRO   5   6.463   2.981  -4.261
   36    H    ASN   6           HN       ASN   6   5.459  -1.091  -5.711
   37    HA   ASN   6           HA       ASN   6   6.169  -2.687  -8.016
   38   1HB   ASN   6          HB2       ASN   6   7.533  -3.173  -5.363
   39   2HB   ASN   6          HB1       ASN   6   7.563  -4.288  -6.722
   40   1HD2  ASN   6          HD21      ASN   6   8.388  -3.364  -8.774
   41   2HD2  ASN   6          HD22      ASN   6   9.743  -2.297  -8.679
   42    H    THR   7           HN       THR   7   5.108  -4.679  -8.080
   43    HA   THR   7           HA       THR   7   2.730  -4.869  -6.575
   44    HB   THR   7           HB       THR   7   2.571  -6.006  -8.589
   45    HG1  THR   7           HG1      THR   7   1.805  -7.353  -6.938
   46   1HG2  THR   7          HG21      THR   7   4.156  -7.757  -9.346
   47   2HG2  THR   7          HG22      THR   7   5.230  -7.288  -8.027
   48   3HG2  THR   7          HG23      THR   7   4.836  -6.131  -9.302
   49    H    THR   8           HN       THR   8   5.986  -5.834  -6.037
   50    HA   THR   8           HA       THR   8   5.651  -7.831  -4.086
   51    HB   THR   8           HB       THR   8   7.911  -7.118  -3.303
   52    HG1  THR   8           HG1      THR   8   8.081  -5.006  -3.571
   53   1HG2  THR   8          HG21      THR   8   7.788  -8.626  -5.206
   54   2HG2  THR   8          HG22      THR   8   9.154  -7.518  -5.345
   55   3HG2  THR   8          HG23      THR   8   7.696  -7.245  -6.299
   56    H    GLY   9           HN       GLY   9   5.182  -4.431  -4.119
   57   1HA   GLY   9          HA2       GLY   9   5.082  -4.096  -1.246
   58   2HA   GLY   9          HA1       GLY   9   4.687  -2.886  -2.461
   59    H    ARG  10           HN       ARG  10   2.776  -3.895  -3.979
   60    HA   ARG  10           HA       ARG  10   0.392  -3.598  -2.628
   61   1HB   ARG  10          HB2       ARG  10   0.881  -5.513  -4.923
   62   2HB   ARG  10          HB1       ARG  10  -0.712  -5.112  -4.315
   63   1HG   ARG  10          HG2       ARG  10   1.057  -2.924  -5.209
   64   2HG   ARG  10          HG1       ARG  10   0.344  -3.954  -6.424
   65   1HD   ARG  10          HD2       ARG  10  -0.754  -1.710  -5.261
   66   2HD   ARG  10          HD1       ARG  10  -1.553  -2.846  -6.291
   67    HE   ARG  10           HE       ARG  10  -2.073  -3.867  -3.979
   68   1HH1  ARG  10          HH11      ARG  10  -2.056  -0.544  -4.866
   69   2HH1  ARG  10          HH12      ARG  10  -3.258  -0.100  -3.715
   70   1HH2  ARG  10          HH21      ARG  10  -3.790  -3.335  -2.533
   71   2HH2  ARG  10          HH22      ARG  10  -4.276  -1.682  -2.427
   72    H    ASN  11           HN       ASN  11   2.124  -6.634  -3.221
   73    HA   ASN  11           HA       ASN  11   0.384  -8.374  -2.035
   74   1HB   ASN  11          HB2       ASN  11   3.392  -8.515  -1.838
   75   2HB   ASN  11          HB1       ASN  11   2.267  -9.854  -1.783
   76   1HD2  ASN  11          HD21      ASN  11   4.490  -9.407  -3.590
   77   2HD2  ASN  11          HD22      ASN  11   3.828  -9.399  -5.185
   78    H    ILE  12           HN       ILE  12   2.954  -6.537  -0.442
   79    HA   ILE  12           HA       ILE  12   2.435  -7.630   2.103
   80    HB   ILE  12           HB       ILE  12   4.021  -5.251   1.204
   81   1HG1  ILE  12          HG12      ILE  12   5.451  -7.086   2.825
   82   2HG1  ILE  12          HG11      ILE  12   4.499  -8.032   1.684
   83   1HG2  ILE  12          HG21      ILE  12   3.344  -6.033   4.029
   84   2HG2  ILE  12          HG22      ILE  12   3.248  -4.439   3.277
   85   3HG2  ILE  12          HG23      ILE  12   4.820  -5.158   3.630
   86   1HD1  ILE  12          HD11      ILE  12   5.594  -5.974   0.185
   87   2HD1  ILE  12          HD12      ILE  12   6.085  -7.669   0.207
   88   3HD1  ILE  12          HD13      ILE  12   6.882  -6.504   1.265
   89    H    TYR  13           HN       TYR  13   1.519  -4.394   0.745
   90    HA   TYR  13           HA       TYR  13   0.165  -3.766   3.149
   91   1HB   TYR  13          HB2       TYR  13   1.050  -2.434   0.924
   92   2HB   TYR  13          HB1       TYR  13  -0.689  -2.388   0.745
   93    HD1  TYR  13           HD1      TYR  13   1.985  -0.629   1.930
   94    HD2  TYR  13           HD2      TYR  13  -1.893  -1.853   3.168
   95    HE1  TYR  13           HE1      TYR  13   1.907   1.247   3.506
   96    HE2  TYR  13           HE2      TYR  13  -1.982   0.020   4.743
   97    HH   TYR  13           HH       TYR  13   0.254   2.597   4.644
   98    H    ASN  14           HN       ASN  14  -0.722  -5.284   0.147
   99    HA   ASN  14           HA       ASN  14  -3.518  -5.098   0.486
  100   1HB   ASN  14          HB2       ASN  14  -1.854  -6.967  -1.195
  101   2HB   ASN  14          HB1       ASN  14  -3.582  -6.757  -1.323
  102   1HD2  ASN  14          HD21      ASN  14  -1.716  -3.889  -0.651
  103   2HD2  ASN  14          HD22      ASN  14  -1.751  -3.236  -2.233
  104    H    THR  15           HN       THR  15  -1.152  -7.741   1.066
  105    HA   THR  15           HA       THR  15  -3.191  -9.492   2.035
  106    HB   THR  15           HB       THR  15  -1.073 -10.411   1.216
  107    HG1  THR  15           HG1      THR  15  -1.012 -11.975   2.703
  108   1HG2  THR  15          HG21      THR  15   0.369  -9.758   3.711
  109   2HG2  THR  15          HG22      THR  15   0.286  -8.507   2.474
  110   3HG2  THR  15          HG23      THR  15   0.982 -10.080   2.091
  111    H    CYS  16           HN       CYS  16  -0.824  -7.352   3.549
  112    HA   CYS  16           HA       CYS  16  -1.276  -7.836   6.216
  113   1HB   CYS  16          HB2       CYS  16   0.381  -6.252   5.755
  114   2HB   CYS  16          HB1       CYS  16  -0.635  -5.376   4.623
  115    H    ARG  17           HN       ARG  17  -2.974  -5.469   4.178
  116    HA   ARG  17           HA       ARG  17  -4.982  -4.805   6.019
  117   1HB   ARG  17          HB2       ARG  17  -4.483  -4.430   3.140
  118   2HB   ARG  17          HB1       ARG  17  -6.175  -4.400   3.600
  119   1HG   ARG  17          HG2       ARG  17  -4.186  -2.759   5.095
  120   2HG   ARG  17          HG1       ARG  17  -4.835  -2.200   3.554
  121   1HD   ARG  17          HD2       ARG  17  -6.478  -2.991   5.955
  122   2HD   ARG  17          HD1       ARG  17  -6.096  -1.336   5.490
  123    HE   ARG  17           HE       ARG  17  -7.949  -3.150   4.154
  124   1HH1  ARG  17          HH11      ARG  17  -6.317  -0.057   4.154
  125   2HH1  ARG  17          HH12      ARG  17  -7.477   0.688   3.107
  126   1HH2  ARG  17          HH21      ARG  17  -9.464  -2.167   2.778
  127   2HH2  ARG  17          HH22      ARG  17  -9.265  -0.506   2.327
  128    H    LEU  18           HN       LEU  18  -4.875  -7.238   3.432
  129    HA   LEU  18           HA       LEU  18  -7.529  -8.153   3.783
  130   1HB   LEU  18          HB2       LEU  18  -5.122  -9.045   2.337
  131   2HB   LEU  18          HB1       LEU  18  -6.231 -10.323   2.783
  132    HG   LEU  18           HG       LEU  18  -6.895  -7.901   1.114
  133   1HD1  LEU  18          HD11      LEU  18  -7.234  -9.557  -0.669
  134   2HD1  LEU  18          HD12      LEU  18  -6.649 -10.820   0.413
  135   3HD1  LEU  18          HD13      LEU  18  -5.567  -9.523  -0.092
  136   1HD2  LEU  18          HD21      LEU  18  -9.045  -9.257   0.761
  137   2HD2  LEU  18          HD22      LEU  18  -8.869  -8.363   2.269
  138   3HD2  LEU  18          HD23      LEU  18  -8.590 -10.104   2.240
  139    H    GLY  19           HN       GLY  19  -4.760  -8.487   5.724
  140   1HA   GLY  19          HA2       GLY  19  -5.795 -10.934   6.977
  141   2HA   GLY  19          HA1       GLY  19  -4.164 -10.307   7.162
  142    H    GLY  20           HN       GLY  20  -6.496  -7.851   7.295
  143   1HA   GLY  20          HA2       GLY  20  -7.513  -6.736   9.038
  144   2HA   GLY  20          HA1       GLY  20  -7.138  -8.099  10.077
  145    H    GLY  21           HN       GLY  21  -5.108  -5.880   8.194
  146   1HA   GLY  21          HA2       GLY  21  -3.789  -5.099  10.708
  147   2HA   GLY  21          HA1       GLY  21  -2.860  -5.515   9.278
  148    H    SER  22           HN       SER  22  -4.018  -3.035  11.034
  149    HA   SER  22           HA       SER  22  -5.059  -1.139   9.375
  150   1HB   SER  22          HB2       SER  22  -2.885  -0.262  11.224
  151   2HB   SER  22          HB1       SER  22  -4.479   0.438  10.954
  152    HG   SER  22           HG       SER  22  -3.712  -1.653  12.627
  153    H    ARG  23           HN       ARG  23  -4.013   0.769   8.379
  154    HA   ARG  23           HA       ARG  23  -2.283  -0.010   6.356
  155   1HB   ARG  23          HB2       ARG  23  -3.513   2.486   7.296
  156   2HB   ARG  23          HB1       ARG  23  -2.041   2.695   6.373
  157   1HG   ARG  23          HG2       ARG  23  -2.984   1.545   4.489
  158   2HG   ARG  23          HG1       ARG  23  -4.419   1.118   5.424
  159   1HD   ARG  23          HD2       ARG  23  -3.640   3.706   4.198
  160   2HD   ARG  23          HD1       ARG  23  -5.222   2.943   4.304
  161    HE   ARG  23           HE       ARG  23  -4.048   4.777   6.173
  162   1HH1  ARG  23          HH11      ARG  23  -6.439   2.254   5.771
  163   2HH1  ARG  23          HH12      ARG  23  -7.326   2.710   7.190
  164   1HH2  ARG  23          HH21      ARG  23  -5.207   5.361   8.023
  165   2HH2  ARG  23          HH22      ARG  23  -6.624   4.470   8.469
  166    H    GLU  24           HN       GLU  24  -1.665   1.397   9.465
  167    HA   GLU  24           HA       GLU  24   1.014   2.179   8.966
  168   1HB   GLU  24          HB2       GLU  24   1.103   1.975  11.581
  169   2HB   GLU  24          HB1       GLU  24   0.113   3.224  10.835
  170   1HG   GLU  24          HG2       GLU  24  -1.855   2.180  11.359
  171   2HG   GLU  24          HG1       GLU  24  -1.115   0.584  11.431
  172    H    ARG  25           HN       ARG  25  -0.465  -0.799  10.072
  173    HA   ARG  25           HA       ARG  25   1.841  -2.090  10.983
  174   1HB   ARG  25          HB2       ARG  25  -0.524  -2.876  11.304
  175   2HB   ARG  25          HB1       ARG  25  -0.519  -3.410   9.630
  176   1HG   ARG  25          HG2       ARG  25   0.513  -5.304  10.154
  177   2HG   ARG  25          HG1       ARG  25   1.762  -4.448  11.060
  178   1HD   ARG  25          HD2       ARG  25   0.812  -4.933  13.023
  179   2HD   ARG  25          HD1       ARG  25  -0.793  -4.494  12.449
  180    HE   ARG  25           HE       ARG  25  -1.225  -6.710  12.144
  181   1HH1  ARG  25          HH11      ARG  25   2.236  -6.274  12.169
  182   2HH1  ARG  25          HH12      ARG  25   2.576  -7.972  12.143
  183   1HH2  ARG  25          HH21      ARG  25  -0.779  -8.949  12.118
  184   2HH2  ARG  25          HH22      ARG  25   0.866  -9.490  12.113
  185    H    CYS  26           HN       CYS  26   0.346  -2.120   7.752
  186    HA   CYS  26           HA       CYS  26   2.411  -3.712   6.594
  187   1HB   CYS  26          HB2       CYS  26   1.020  -2.059   4.643
  188   2HB   CYS  26          HB1       CYS  26   1.091  -3.806   4.789
  189    H    ALA  27           HN       ALA  27   1.791  -0.225   6.792
  190    HA   ALA  27           HA       ALA  27   3.744   0.617   4.990
  191   1HB   ALA  27          HB1       ALA  27   2.137   2.185   5.845
  192   2HB   ALA  27          HB2       ALA  27   3.754   2.754   6.256
  193   3HB   ALA  27          HB3       ALA  27   2.750   1.989   7.488
  194    H    SER  28           HN       SER  28   4.026  -0.250   8.409
  195    HA   SER  28           HA       SER  28   6.774   0.459   8.624
  196   1HB   SER  28          HB2       SER  28   6.639  -1.113  10.662
  197   2HB   SER  28          HB1       SER  28   5.606   0.316  10.673
  198    HG   SER  28           HG       SER  28   4.468  -1.588  11.262
  199    H    LEU  29           HN       LEU  29   5.027  -2.388   7.628
  200    HA   LEU  29           HA       LEU  29   7.183  -4.225   7.734
  201   1HB   LEU  29          HB2       LEU  29   4.452  -4.348   7.281
  202   2HB   LEU  29          HB1       LEU  29   5.148  -4.848   5.753
  203    HG   LEU  29           HG       LEU  29   6.014  -6.101   8.345
  204   1HD1  LEU  29          HD11      LEU  29   3.765  -7.025   6.565
  205   2HD1  LEU  29          HD12      LEU  29   3.569  -6.304   8.162
  206   3HD1  LEU  29          HD13      LEU  29   4.388  -7.856   7.991
  207   1HD2  LEU  29          HD21      LEU  29   6.029  -7.061   5.485
  208   2HD2  LEU  29          HD22      LEU  29   6.634  -7.952   6.881
  209   3HD2  LEU  29          HD23      LEU  29   7.425  -6.458   6.378
  210    H    SER  30           HN       SER  30   5.701  -2.505   4.968
  211    HA   SER  30           HA       SER  30   7.997  -3.339   3.354
  212   1HB   SER  30          HB2       SER  30   5.249  -3.353   2.819
  213   2HB   SER  30          HB1       SER  30   5.906  -2.060   1.819
  214    HG   SER  30           HG       SER  30   7.387  -3.545   0.968
  215    H    GLY  31           HN       GLY  31   5.917  -0.412   3.413
  216   1HA   GLY  31          HA2       GLY  31   6.914   1.774   3.868
  217   2HA   GLY  31          HA1       GLY  31   8.395   1.183   3.127
  218    H    CYS  32           HN       CYS  32   4.996   1.776   2.418
  219    HA   CYS  32           HA       CYS  32   5.607   2.201  -0.415
  220   1HB   CYS  32          HB2       CYS  32   3.048   1.708   1.107
  221   2HB   CYS  32          HB1       CYS  32   3.135   1.978  -0.629
  222    H    LYS  33           HN       LYS  33   3.341   3.702  -1.028
  223    HA   LYS  33           HA       LYS  33   3.956   6.277   0.236
  224   1HB   LYS  33          HB2       LYS  33   4.849   5.881  -2.123
  225   2HB   LYS  33          HB1       LYS  33   3.178   5.927  -2.653
  226   1HG   LYS  33          HG2       LYS  33   4.492   8.062  -2.895
  227   2HG   LYS  33          HG1       LYS  33   2.943   8.191  -2.063
  228   1HD   LYS  33          HD2       LYS  33   5.446   7.756  -0.486
  229   2HD   LYS  33          HD1       LYS  33   5.058   9.369  -1.085
  230   1HE   LYS  33          HE2       LYS  33   2.704   8.286   0.061
  231   2HE   LYS  33          HE1       LYS  33   4.024   8.016   1.198
  232   1HZ   LYS  33          HZ1       LYS  33   4.554  10.381   1.055
  233   2HZ   LYS  33          HZ2       LYS  33   2.969  10.139   1.591
  234   3HZ   LYS  33          HZ3       LYS  33   3.256  10.623  -0.002
  235    H    ILE  34           HN       ILE  34   2.227   6.724   1.462
  236    HA   ILE  34           HA       ILE  34  -0.402   5.832   0.880
  237    HB   ILE  34           HB       ILE  34   0.727   6.552   3.150
  238   1HG1  ILE  34          HG12      ILE  34  -1.938   7.410   3.537
  239   2HG1  ILE  34          HG11      ILE  34  -1.981   6.209   2.253
  240   1HG2  ILE  34          HG21      ILE  34  -0.734   9.082   2.437
  241   2HG2  ILE  34          HG22      ILE  34   1.018   8.908   2.377
  242   3HG2  ILE  34          HG23      ILE  34   0.167   8.738   3.912
  243   1HD1  ILE  34          HD11      ILE  34  -1.921   4.638   3.812
  244   2HD1  ILE  34          HD12      ILE  34  -1.692   5.846   5.072
  245   3HD1  ILE  34          HD13      ILE  34  -0.293   5.169   4.238
  246    H    ILE  35           HN       ILE  35  -1.984   6.718  -0.266
  247    HA   ILE  35           HA       ILE  35  -1.626   8.812  -2.075
  248    HB   ILE  35           HB       ILE  35  -4.338   8.104  -0.982
  249   1HG1  ILE  35          HG12      ILE  35  -3.200   5.994  -1.404
  250   2HG1  ILE  35          HG11      ILE  35  -4.423   6.279  -2.636
  251   1HG2  ILE  35          HG21      ILE  35  -4.581   9.800  -2.529
  252   2HG2  ILE  35          HG22      ILE  35  -4.812   8.356  -3.506
  253   3HG2  ILE  35          HG23      ILE  35  -3.269   9.204  -3.544
  254   1HD1  ILE  35          HD11      ILE  35  -1.996   7.403  -3.544
  255   2HD1  ILE  35          HD12      ILE  35  -2.906   6.046  -4.202
  256   3HD1  ILE  35          HD13      ILE  35  -1.667   5.768  -2.975
  257    H    SER  36           HN       SER  36  -2.945  10.798  -2.224
  258    HA   SER  36           HA       SER  36  -3.617  12.073   0.311
  259   1HB   SER  36          HB2       SER  36  -1.184  12.594  -0.356
  260   2HB   SER  36          HB1       SER  36  -1.877  13.527  -1.680
  261    HG   SER  36           HG       SER  36  -1.393  14.614   0.439
  262    H    ALA  37           HN       ALA  37  -5.299  11.060  -1.590
  263    HA   ALA  37           HA       ALA  37  -7.135  13.047  -2.070
  264   1HB   ALA  37          HB1       ALA  37  -5.180  12.717  -4.313
  265   2HB   ALA  37          HB2       ALA  37  -5.884  14.194  -3.652
  266   3HB   ALA  37          HB3       ALA  37  -6.860  13.125  -4.658
  267    H    SER  38           HN       SER  38  -5.732  10.399  -3.984
  268    HA   SER  38           HA       SER  38  -7.490   8.409  -3.333
  269   1HB   SER  38          HB2       SER  38  -8.749  10.383  -5.047
  270   2HB   SER  38          HB1       SER  38  -8.738   8.792  -5.809
  271    HG   SER  38           HG       SER  38  -9.981   8.008  -4.245
  272    H    THR  39           HN       THR  39  -6.417   9.777  -6.450
  273    HA   THR  39           HA       THR  39  -5.644   7.221  -7.470
  274    HB   THR  39           HB       THR  39  -4.939   9.991  -8.467
  275    HG1  THR  39           HG1      THR  39  -7.100   9.848  -8.614
  276   1HG2  THR  39          HG21      THR  39  -4.871   7.339  -9.883
  277   2HG2  THR  39          HG22      THR  39  -3.489   8.361  -9.486
  278   3HG2  THR  39          HG23      THR  39  -4.688   8.913 -10.657
  279    H    CYS  40           HN       CYS  40  -3.521   6.440  -7.900
  280    HA   CYS  40           HA       CYS  40  -1.690   6.668  -5.851
  281   1HB   CYS  40          HB2       CYS  40  -1.388   5.784  -8.708
  282   2HB   CYS  40          HB1       CYS  40  -0.041   5.729  -7.573
  283    HA   PRO  41           HA       PRO  41   0.619  10.353  -6.495
  284   1HB   PRO  41          HB2       PRO  41   3.095   9.590  -5.651
  285   2HB   PRO  41          HB1       PRO  41   1.750   9.914  -4.553
  286   1HG   PRO  41          HG2       PRO  41   2.833   7.307  -5.509
  287   2HG   PRO  41          HG1       PRO  41   2.200   7.746  -3.915
  288   1HD   PRO  41          HD2       PRO  41   0.782   6.332  -5.778
  289   2HD   PRO  41          HD1       PRO  41   0.038   7.344  -4.527
  290    H    SER  42           HN       SER  42   3.287   8.112  -7.126
  291    HA   SER  42           HA       SER  42   4.073   9.512  -9.452
  292   1HB   SER  42          HB2       SER  42   5.856   7.982  -9.603
  293   2HB   SER  42          HB1       SER  42   5.500   8.029  -7.877
  294    HG   SER  42           HG       SER  42   5.624   5.906  -9.303
  295    H    ASP  43           HN       ASP  43   2.844   6.199  -9.100
  296    HA   ASP  43           HA       ASP  43   0.896   6.229 -11.041
  297   1HB   ASP  43          HB2       ASP  43   2.032   5.050 -12.948
  298   2HB   ASP  43          HB1       ASP  43   2.510   6.733 -12.745
  299    H    TYR  44           HN       TYR  44   3.227   4.494  -9.175
  300    HA   TYR  44           HA       TYR  44   2.403   1.869  -9.803
  301   1HB   TYR  44          HB2       TYR  44   3.539   1.328  -7.596
  302   2HB   TYR  44          HB1       TYR  44   4.540   2.081  -8.825
  303    HD1  TYR  44           HD1      TYR  44   2.477   2.969  -5.818
  304    HD2  TYR  44           HD2      TYR  44   5.830   3.915  -8.257
  305    HE1  TYR  44           HE1      TYR  44   3.127   4.742  -4.243
  306    HE2  TYR  44           HE2      TYR  44   6.492   5.679  -6.679
  307    HH   TYR  44           HH       TYR  44   6.060   6.075  -4.090
  308    HA   PRO  45           HA       PRO  45  -1.461   1.575  -7.525
  309   1HB   PRO  45          HB2       PRO  45  -1.530  -1.128  -7.221
  310   2HB   PRO  45          HB1       PRO  45  -1.929  -0.304  -8.734
  311   1HG   PRO  45          HG2       PRO  45   0.627  -1.622  -7.907
  312   2HG   PRO  45          HG1       PRO  45  -0.221  -1.716  -9.459
  313   1HD   PRO  45          HD2       PRO  45   1.915  -0.111  -9.121
  314   2HD   PRO  45          HD1       PRO  45   0.550   0.357 -10.154
  315    H    LYS  46           HN       LYS  46   0.939  -0.752  -6.392
  316    HA   LYS  46           HA       LYS  46   1.380   0.344  -3.860
  317   1HB   LYS  46          HB2       LYS  46  -0.949  -0.689  -3.604
  318   2HB   LYS  46          HB1       LYS  46  -0.082  -2.208  -3.568
  319   1HG   LYS  46          HG2       LYS  46   0.490  -1.906  -1.470
  320   2HG   LYS  46          HG1       LYS  46   1.126  -0.297  -1.817
  321   1HD   LYS  46          HD2       LYS  46  -1.397   0.354  -1.897
  322   2HD   LYS  46          HD1       LYS  46  -1.596  -1.114  -0.933
  323   1HE   LYS  46          HE2       LYS  46   0.380  -0.083   0.429
  324   2HE   LYS  46          HE1       LYS  46  -0.189   1.422  -0.279
  325   1HZ   LYS  46          HZ1       LYS  46  -1.919  -0.467   1.211
  326   2HZ   LYS  46          HZ2       LYS  46  -2.342   1.066   0.658
  327   3HZ   LYS  46          HZ3       LYS  46  -1.203   0.895   1.901
  Start of MODEL   19
    1   1H    LYS   1          HT1       LYS   1  -7.456   1.456  -1.557
    2   2H    LYS   1          HT2       LYS   1  -6.955  -0.167  -1.321
    3   3H    LYS   1          HT3       LYS   1  -8.304   0.180  -2.324
    4    HA   LYS   1           HA       LYS   1  -6.571  -0.280  -3.749
    5   1HB   LYS   1          HB2       LYS   1  -7.753   2.297  -3.518
    6   2HB   LYS   1          HB1       LYS   1  -6.095   2.525  -4.058
    7   1HG   LYS   1          HG2       LYS   1  -7.599   0.409  -5.444
    8   2HG   LYS   1          HG1       LYS   1  -8.172   2.058  -5.704
    9   1HD   LYS   1          HD2       LYS   1  -6.561   1.519  -7.407
   10   2HD   LYS   1          HD1       LYS   1  -5.855   2.711  -6.314
   11   1HE   LYS   1          HE2       LYS   1  -4.210   1.327  -5.716
   12   2HE   LYS   1          HE1       LYS   1  -5.330  -0.007  -5.449
   13   1HZ   LYS   1          HZ1       LYS   1  -4.378  -0.908  -7.238
   14   2HZ   LYS   1          HZ2       LYS   1  -3.649   0.540  -7.710
   15   3HZ   LYS   1          HZ3       LYS   1  -5.244   0.212  -8.154
   16    H    SER   2           HN       SER   2  -5.493   2.385  -1.636
   17    HA   SER   2           HA       SER   2  -3.439   2.981  -0.860
   18   1HB   SER   2          HB2       SER   2  -2.094   1.266   0.073
   19   2HB   SER   2          HB1       SER   2  -3.751   0.672   0.179
   20    HG   SER   2           HG       SER   2  -1.626  -0.312  -1.227
   21    H    CYS   3           HN       CYS   3  -1.038   2.903  -1.305
   22    HA   CYS   3           HA       CYS   3  -0.598   2.629  -4.207
   23   1HB   CYS   3          HB2       CYS   3  -0.680   4.983  -3.415
   24   2HB   CYS   3          HB1       CYS   3   0.681   4.642  -2.353
   25    H    CYS   4           HN       CYS   4   1.312   1.741  -4.909
   26    HA   CYS   4           HA       CYS   4   3.430   1.086  -3.063
   27   1HB   CYS   4          HB2       CYS   4   1.753  -1.084  -4.337
   28   2HB   CYS   4          HB1       CYS   4   3.338  -1.365  -3.628
   29    HA   PRO   5           HA       PRO   5   5.507   1.606  -6.934
   30   1HB   PRO   5          HB2       PRO   5   8.019   1.103  -6.175
   31   2HB   PRO   5          HB1       PRO   5   7.144   2.526  -5.599
   32   1HG   PRO   5          HG2       PRO   5   7.668  -0.068  -4.211
   33   2HG   PRO   5          HG1       PRO   5   7.728   1.579  -3.561
   34   1HD   PRO   5          HD2       PRO   5   5.598  -0.148  -3.256
   35   2HD   PRO   5          HD1       PRO   5   5.482   1.618  -3.152
   36    H    ASN   6           HN       ASN   6   4.753  -1.360  -5.807
   37    HA   ASN   6           HA       ASN   6   5.183  -2.783  -8.091
   38   1HB   ASN   6          HB2       ASN   6   7.229  -4.204  -7.355
   39   2HB   ASN   6          HB1       ASN   6   7.514  -2.639  -8.110
   40   1HD2  ASN   6          HD21      ASN   6   9.526  -2.423  -7.163
   41   2HD2  ASN   6          HD22      ASN   6   9.728  -2.085  -5.480
   42    H    THR   7           HN       THR   7   5.300  -5.227  -7.727
   43    HA   THR   7           HA       THR   7   3.225  -6.005  -6.052
   44    HB   THR   7           HB       THR   7   3.696  -7.447  -7.834
   45    HG1  THR   7           HG1      THR   7   4.209  -9.431  -6.810
   46   1HG2  THR   7          HG21      THR   7   6.012  -8.719  -7.717
   47   2HG2  THR   7          HG22      THR   7   6.521  -7.192  -6.997
   48   3HG2  THR   7          HG23      THR   7   5.808  -7.212  -8.610
   49    H    THR   8           HN       THR   8   6.693  -5.883  -5.434
   50    HA   THR   8           HA       THR   8   6.802  -7.440  -3.128
   51    HB   THR   8           HB       THR   8   8.679  -5.778  -2.469
   52    HG1  THR   8           HG1      THR   8   7.813  -4.177  -4.011
   53   1HG2  THR   8          HG21      THR   8   8.894  -8.031  -3.692
   54   2HG2  THR   8          HG22      THR   8  10.237  -6.889  -3.762
   55   3HG2  THR   8          HG23      THR   8   9.139  -7.045  -5.134
   56    H    GLY   9           HN       GLY   9   5.401  -4.340  -3.645
   57   1HA   GLY   9          HA2       GLY   9   5.170  -3.877  -0.751
   58   2HA   GLY   9          HA1       GLY   9   4.865  -2.683  -2.008
   59    H    ARG  10           HN       ARG  10   3.346  -4.469  -3.667
   60    HA   ARG  10           HA       ARG  10   0.759  -4.001  -2.657
   61   1HB   ARG  10          HB2       ARG  10   1.483  -6.015  -4.784
   62   2HB   ARG  10          HB1       ARG  10  -0.044  -5.171  -4.586
   63   1HG   ARG  10          HG2       ARG  10   2.333  -3.478  -4.970
   64   2HG   ARG  10          HG1       ARG  10   1.828  -4.454  -6.350
   65   1HD   ARG  10          HD2       ARG  10  -0.344  -3.072  -4.950
   66   2HD   ARG  10          HD1       ARG  10   0.827  -2.005  -5.718
   67    HE   ARG  10           HE       ARG  10  -1.201  -3.336  -7.028
   68   1HH1  ARG  10          HH11      ARG  10   2.249  -2.885  -7.391
   69   2HH1  ARG  10          HH12      ARG  10   2.230  -3.191  -9.094
   70   1HH2  ARG  10          HH21      ARG  10  -1.216  -3.720  -9.268
   71   2HH2  ARG  10          HH22      ARG  10   0.267  -3.658 -10.160
   72    H    ASN  11           HN       ASN  11   2.749  -6.931  -2.803
   73    HA   ASN  11           HA       ASN  11   0.863  -8.747  -1.884
   74   1HB   ASN  11          HB2       ASN  11   2.925 -10.008  -1.077
   75   2HB   ASN  11          HB1       ASN  11   2.861  -9.612  -2.778
   76   1HD2  ASN  11          HD21      ASN  11   5.236 -10.182  -2.185
   77   2HD2  ASN  11          HD22      ASN  11   6.242  -8.814  -1.867
   78    H    ILE  12           HN       ILE  12   3.478  -7.309   0.085
   79    HA   ILE  12           HA       ILE  12   2.444  -8.203   2.516
   80    HB   ILE  12           HB       ILE  12   4.171  -5.795   1.950
   81   1HG1  ILE  12          HG12      ILE  12   5.719  -7.551   3.299
   82   2HG1  ILE  12          HG11      ILE  12   4.630  -8.671   2.487
   83   1HG2  ILE  12          HG21      ILE  12   4.718  -6.220   4.500
   84   2HG2  ILE  12          HG22      ILE  12   3.059  -6.819   4.511
   85   3HG2  ILE  12          HG23      ILE  12   3.395  -5.163   4.005
   86   1HD1  ILE  12          HD11      ILE  12   6.847  -7.172   1.436
   87   2HD1  ILE  12          HD12      ILE  12   5.371  -6.866   0.524
   88   3HD1  ILE  12          HD13      ILE  12   5.953  -8.516   0.725
   89    H    TYR  13           HN       TYR  13   1.863  -5.111   0.860
   90    HA   TYR  13           HA       TYR  13   0.260  -4.014   2.900
   91   1HB   TYR  13          HB2       TYR  13   1.338  -2.928   0.784
   92   2HB   TYR  13          HB1       TYR  13  -0.182  -3.365   0.014
   93    HD1  TYR  13           HD1      TYR  13   1.509  -0.988   2.071
   94    HD2  TYR  13           HD2      TYR  13  -2.340  -2.498   1.076
   95    HE1  TYR  13           HE1      TYR  13   0.481   1.054   2.975
   96    HE2  TYR  13           HE2      TYR  13  -3.379  -0.460   1.978
   97    HH   TYR  13           HH       TYR  13  -1.734   2.327   2.575
   98    H    ASN  14           HN       ASN  14  -0.489  -6.037   0.121
   99    HA   ASN  14           HA       ASN  14  -3.303  -5.883   0.390
  100   1HB   ASN  14          HB2       ASN  14  -1.391  -7.576  -1.154
  101   2HB   ASN  14          HB1       ASN  14  -3.052  -8.114  -0.996
  102   1HD2  ASN  14          HD21      ASN  14  -1.525  -4.934  -1.475
  103   2HD2  ASN  14          HD22      ASN  14  -2.453  -4.513  -2.871
  104    H    THR  15           HN       THR  15  -0.988  -8.522   1.190
  105    HA   THR  15           HA       THR  15  -2.917 -10.122   2.475
  106    HB   THR  15           HB       THR  15  -0.949 -11.247   1.919
  107    HG1  THR  15           HG1      THR  15  -0.749 -12.247   3.741
  108   1HG2  THR  15          HG21      THR  15   1.141 -10.224   3.445
  109   2HG2  THR  15          HG22      THR  15   0.388  -8.825   2.681
  110   3HG2  THR  15          HG23      THR  15   0.966 -10.166   1.692
  111    H    CYS  16           HN       CYS  16  -0.807  -7.562   3.652
  112    HA   CYS  16           HA       CYS  16  -1.247  -7.823   6.393
  113   1HB   CYS  16          HB2       CYS  16   0.420  -6.291   5.710
  114   2HB   CYS  16          HB1       CYS  16  -0.674  -5.457   4.617
  115    H    ARG  17           HN       ARG  17  -2.959  -5.778   4.038
  116    HA   ARG  17           HA       ARG  17  -4.980  -4.877   5.764
  117   1HB   ARG  17          HB2       ARG  17  -4.410  -4.847   2.917
  118   2HB   ARG  17          HB1       ARG  17  -6.129  -5.049   3.222
  119   1HG   ARG  17          HG2       ARG  17  -4.789  -2.951   4.797
  120   2HG   ARG  17          HG1       ARG  17  -4.903  -2.663   3.059
  121   1HD   ARG  17          HD2       ARG  17  -7.244  -3.433   4.792
  122   2HD   ARG  17          HD1       ARG  17  -6.815  -1.766   4.410
  123    HE   ARG  17           HE       ARG  17  -7.039  -3.199   2.015
  124   1HH1  ARG  17          HH11      ARG  17  -9.057  -2.053   4.621
  125   2HH1  ARG  17          HH12      ARG  17 -10.471  -1.910   3.630
  126   1HH2  ARG  17          HH21      ARG  17  -8.896  -3.011   0.710
  127   2HH2  ARG  17          HH22      ARG  17 -10.379  -2.454   1.410
  128    H    LEU  18           HN       LEU  18  -4.593  -7.824   3.940
  129    HA   LEU  18           HA       LEU  18  -7.204  -8.774   3.948
  130   1HB   LEU  18          HB2       LEU  18  -6.270 -10.568   2.966
  131   2HB   LEU  18          HB1       LEU  18  -4.764  -9.686   3.080
  132    HG   LEU  18           HG       LEU  18  -4.491 -10.803   5.360
  133   1HD1  LEU  18          HD11      LEU  18  -6.940 -12.077   4.383
  134   2HD1  LEU  18          HD12      LEU  18  -6.311 -11.933   6.025
  135   3HD1  LEU  18          HD13      LEU  18  -5.711 -13.205   4.959
  136   1HD2  LEU  18          HD21      LEU  18  -4.079 -13.081   3.849
  137   2HD2  LEU  18          HD22      LEU  18  -2.939 -11.757   4.079
  138   3HD2  LEU  18          HD23      LEU  18  -3.999 -11.772   2.670
  139    H    GLY  19           HN       GLY  19  -4.894  -8.512   6.495
  140   1HA   GLY  19          HA2       GLY  19  -6.451 -10.262   8.247
  141   2HA   GLY  19          HA1       GLY  19  -4.875  -9.575   8.610
  142    H    GLY  20           HN       GLY  20  -6.761  -7.184   7.282
  143   1HA   GLY  20          HA2       GLY  20  -7.828  -5.353   8.146
  144   2HA   GLY  20          HA1       GLY  20  -8.452  -6.428   9.387
  145    H    GLY  21           HN       GLY  21  -5.124  -5.355   8.645
  146   1HA   GLY  21          HA2       GLY  21  -4.871  -4.608  11.465
  147   2HA   GLY  21          HA1       GLY  21  -3.539  -4.954  10.370
  148    H    SER  22           HN       SER  22  -2.662  -2.960  11.173
  149    HA   SER  22           HA       SER  22  -3.946  -0.471  10.655
  150   1HB   SER  22          HB2       SER  22  -1.092  -0.180  10.806
  151   2HB   SER  22          HB1       SER  22  -2.329   0.344  11.945
  152    HG   SER  22           HG       SER  22  -2.280  -1.775  12.833
  153    H    ARG  23           HN       ARG  23  -3.460   1.072   9.134
  154    HA   ARG  23           HA       ARG  23  -2.920   0.064   6.527
  155   1HB   ARG  23          HB2       ARG  23  -3.963   2.487   7.684
  156   2HB   ARG  23          HB1       ARG  23  -2.778   2.870   6.444
  157   1HG   ARG  23          HG2       ARG  23  -4.021   1.875   4.764
  158   2HG   ARG  23          HG1       ARG  23  -4.948   0.890   5.897
  159   1HD   ARG  23          HD2       ARG  23  -6.339   2.630   6.481
  160   2HD   ARG  23          HD1       ARG  23  -5.158   3.862   6.038
  161    HE   ARG  23           HE       ARG  23  -6.035   3.870   3.934
  162   1HH1  ARG  23          HH11      ARG  23  -6.978   0.901   5.504
  163   2HH1  ARG  23          HH12      ARG  23  -8.017   0.402   4.212
  164   1HH2  ARG  23          HH21      ARG  23  -7.402   3.217   2.233
  165   2HH2  ARG  23          HH22      ARG  23  -8.258   1.716   2.354
  166    H    GLU  24           HN       GLU  24  -1.242   2.171   8.756
  167    HA   GLU  24           HA       GLU  24   1.032   2.618   7.112
  168   1HB   GLU  24          HB2       GLU  24   2.001   3.218   9.516
  169   2HB   GLU  24          HB1       GLU  24   0.881   4.279   8.671
  170   1HG   GLU  24          HG2       GLU  24  -0.908   3.674  10.015
  171   2HG   GLU  24          HG1       GLU  24  -0.131   2.185  10.548
  172    H    ARG  25           HN       ARG  25   0.150   0.090   9.335
  173    HA   ARG  25           HA       ARG  25   2.658  -0.873  10.053
  174   1HB   ARG  25          HB2       ARG  25   0.546  -1.680  11.030
  175   2HB   ARG  25          HB1       ARG  25   0.150  -2.471   9.510
  176   1HG   ARG  25          HG2       ARG  25   1.963  -4.003   9.750
  177   2HG   ARG  25          HG1       ARG  25   2.588  -3.122  11.146
  178   1HD   ARG  25          HD2       ARG  25   1.002  -3.956  12.556
  179   2HD   ARG  25          HD1       ARG  25  -0.205  -4.110  11.281
  180    HE   ARG  25           HE       ARG  25   0.483  -6.259  10.968
  181   1HH1  ARG  25          HH11      ARG  25   3.027  -4.524  12.609
  182   2HH1  ARG  25          HH12      ARG  25   4.009  -5.931  12.838
  183   1HH2  ARG  25          HH21      ARG  25   1.774  -8.110  11.270
  184   2HH2  ARG  25          HH22      ARG  25   3.299  -7.968  12.077
  185    H    CYS  26           HN       CYS  26   0.654  -1.746   7.264
  186    HA   CYS  26           HA       CYS  26   2.590  -3.522   6.158
  187   1HB   CYS  26          HB2       CYS  26   0.796  -2.422   4.156
  188   2HB   CYS  26          HB1       CYS  26   0.973  -4.078   4.712
  189    H    ALA  27           HN       ALA  27   1.744  -0.145   5.635
  190    HA   ALA  27           HA       ALA  27   3.331   0.354   3.397
  191   1HB   ALA  27          HB1       ALA  27   1.584   1.855   4.551
  192   2HB   ALA  27          HB2       ALA  27   2.984   2.622   3.801
  193   3HB   ALA  27          HB3       ALA  27   2.932   2.401   5.550
  194    H    SER  28           HN       SER  28   4.130   0.607   6.850
  195    HA   SER  28           HA       SER  28   6.796   1.475   6.406
  196   1HB   SER  28          HB2       SER  28   7.101   0.840   8.835
  197   2HB   SER  28          HB1       SER  28   5.797   1.983   8.520
  198    HG   SER  28           HG       SER  28   5.687  -0.523   9.563
  199    H    LEU  29           HN       LEU  29   5.250  -1.638   6.714
  200    HA   LEU  29           HA       LEU  29   7.610  -3.165   7.104
  201   1HB   LEU  29          HB2       LEU  29   4.827  -3.636   7.000
  202   2HB   LEU  29          HB1       LEU  29   5.559  -4.693   5.809
  203    HG   LEU  29           HG       LEU  29   6.495  -4.562   8.671
  204   1HD1  LEU  29          HD11      LEU  29   4.665  -6.644   7.509
  205   2HD1  LEU  29          HD12      LEU  29   4.077  -5.247   8.412
  206   3HD1  LEU  29          HD13      LEU  29   5.137  -6.420   9.193
  207   1HD2  LEU  29          HD21      LEU  29   6.966  -6.463   6.385
  208   2HD2  LEU  29          HD22      LEU  29   7.369  -6.839   8.060
  209   3HD2  LEU  29          HD23      LEU  29   8.155  -5.485   7.246
  210    H    SER  30           HN       SER  30   5.592  -2.640   4.195
  211    HA   SER  30           HA       SER  30   7.665  -3.876   2.568
  212   1HB   SER  30          HB2       SER  30   4.852  -3.705   2.388
  213   2HB   SER  30          HB1       SER  30   5.498  -2.824   1.003
  214    HG   SER  30           HG       SER  30   6.870  -4.759   0.706
  215    H    GLY  31           HN       GLY  31   6.374  -0.730   3.287
  216   1HA   GLY  31          HA2       GLY  31   7.605   1.266   2.940
  217   2HA   GLY  31          HA1       GLY  31   8.504   0.460   1.662
  218    H    CYS  32           HN       CYS  32   5.039   0.277   1.893
  219    HA   CYS  32           HA       CYS  32   4.734   1.353  -0.752
  220   1HB   CYS  32          HB2       CYS  32   2.889   0.201   1.315
  221   2HB   CYS  32          HB1       CYS  32   2.233   1.022  -0.091
  222    H    LYS  33           HN       LYS  33   2.555   2.797  -0.869
  223    HA   LYS  33           HA       LYS  33   3.071   5.138   0.838
  224   1HB   LYS  33          HB2       LYS  33   2.954   4.850  -2.047
  225   2HB   LYS  33          HB1       LYS  33   1.806   6.053  -1.475
  226   1HG   LYS  33          HG2       LYS  33   3.980   7.022  -2.072
  227   2HG   LYS  33          HG1       LYS  33   3.573   7.273  -0.372
  228   1HD   LYS  33          HD2       LYS  33   5.027   4.800  -0.762
  229   2HD   LYS  33          HD1       LYS  33   5.925   6.183  -1.390
  230   1HE   LYS  33          HE2       LYS  33   4.671   6.592   1.238
  231   2HE   LYS  33          HE1       LYS  33   5.950   5.379   1.199
  232   1HZ   LYS  33          HZ1       LYS  33   6.334   8.062   0.021
  233   2HZ   LYS  33          HZ2       LYS  33   7.510   6.942   0.496
  234   3HZ   LYS  33          HZ3       LYS  33   6.613   7.773   1.665
  235    H    ILE  34           HN       ILE  34   1.395   5.994   1.909
  236    HA   ILE  34           HA       ILE  34  -1.245   4.802   1.454
  237    HB   ILE  34           HB       ILE  34  -0.286   4.421   3.686
  238   1HG1  ILE  34          HG12      ILE  34  -2.302   5.906   4.834
  239   2HG1  ILE  34          HG11      ILE  34  -2.831   5.775   3.159
  240   1HG2  ILE  34          HG21      ILE  34  -0.667   7.175   4.605
  241   2HG2  ILE  34          HG22      ILE  34   0.688   6.956   3.499
  242   3HG2  ILE  34          HG23      ILE  34   0.602   6.013   4.987
  243   1HD1  ILE  34          HD11      ILE  34  -1.896   3.314   4.523
  244   2HD1  ILE  34          HD12      ILE  34  -3.138   3.526   3.288
  245   3HD1  ILE  34          HD13      ILE  34  -3.472   3.974   4.961
  246    H    ILE  35           HN       ILE  35  -2.501   6.072   0.237
  247    HA   ILE  35           HA       ILE  35  -2.311   8.982   0.597
  248    HB   ILE  35           HB       ILE  35  -3.527   7.412  -1.683
  249   1HG1  ILE  35          HG12      ILE  35  -1.617   8.536  -2.943
  250   2HG1  ILE  35          HG11      ILE  35  -0.944   8.941  -1.367
  251   1HG2  ILE  35          HG21      ILE  35  -3.757  10.209  -0.890
  252   2HG2  ILE  35          HG22      ILE  35  -4.713   9.275  -2.040
  253   3HG2  ILE  35          HG23      ILE  35  -3.185   9.999  -2.544
  254   1HD1  ILE  35          HD11      ILE  35  -1.652   6.110  -1.905
  255   2HD1  ILE  35          HD12      ILE  35  -0.364   6.789  -0.910
  256   3HD1  ILE  35          HD13      ILE  35  -0.210   6.782  -2.667
  257    H    SER  36           HN       SER  36  -5.190   7.739  -0.878
  258    HA   SER  36           HA       SER  36  -6.897   7.184   1.162
  259   1HB   SER  36          HB2       SER  36  -6.236  10.072   1.084
  260   2HB   SER  36          HB1       SER  36  -7.949   9.680   1.233
  261    HG   SER  36           HG       SER  36  -6.100   9.642   3.123
  262    H    ALA  37           HN       ALA  37  -6.628   6.657  -1.580
  263    HA   ALA  37           HA       ALA  37  -9.274   6.747  -2.448
  264   1HB   ALA  37          HB1       ALA  37  -7.548   8.950  -3.539
  265   2HB   ALA  37          HB2       ALA  37  -9.150   9.066  -2.810
  266   3HB   ALA  37          HB3       ALA  37  -8.958   8.339  -4.405
  267    H    SER  38           HN       SER  38  -6.438   7.460  -4.436
  268    HA   SER  38           HA       SER  38  -5.846   4.777  -5.101
  269   1HB   SER  38          HB2       SER  38  -7.986   6.058  -6.609
  270   2HB   SER  38          HB1       SER  38  -6.672   5.507  -7.647
  271    HG   SER  38           HG       SER  38  -8.474   4.052  -6.130
  272    H    THR  39           HN       THR  39  -5.837   8.141  -6.190
  273    HA   THR  39           HA       THR  39  -3.731   8.091  -7.976
  274    HB   THR  39           HB       THR  39  -4.921  10.112  -7.800
  275    HG1  THR  39           HG1      THR  39  -2.820  10.643  -8.158
  276   1HG2  THR  39          HG21      THR  39  -5.887  10.114  -5.673
  277   2HG2  THR  39          HG22      THR  39  -4.803  11.505  -5.683
  278   3HG2  THR  39          HG23      THR  39  -4.322  10.018  -4.867
  279    H    CYS  40           HN       CYS  40  -1.570   7.920  -7.849
  280    HA   CYS  40           HA       CYS  40  -0.421   7.419  -5.206
  281   1HB   CYS  40          HB2       CYS  40   0.238   6.574  -7.979
  282   2HB   CYS  40          HB1       CYS  40   1.578   6.745  -6.850
  283    HA   PRO  41           HA       PRO  41   1.657  11.333  -5.155
  284   1HB   PRO  41          HB2       PRO  41   3.733  10.684  -3.503
  285   2HB   PRO  41          HB1       PRO  41   2.092  11.002  -2.930
  286   1HG   PRO  41          HG2       PRO  41   3.445   8.380  -3.437
  287   2HG   PRO  41          HG1       PRO  41   2.401   8.858  -2.086
  288   1HD   PRO  41          HD2       PRO  41   1.489   7.373  -4.136
  289   2HD   PRO  41          HD1       PRO  41   0.466   8.566  -3.314
  290    H    SER  42           HN       SER  42   3.904   8.559  -5.279
  291    HA   SER  42           HA       SER  42   5.886   9.989  -6.732
  292   1HB   SER  42          HB2       SER  42   5.512   7.218  -5.762
  293   2HB   SER  42          HB1       SER  42   6.547   7.397  -7.178
  294    HG   SER  42           HG       SER  42   7.920   8.653  -6.028
  295    H    ASP  43           HN       ASP  43   4.462   6.949  -7.879
  296    HA   ASP  43           HA       ASP  43   3.101   7.907 -10.098
  297   1HB   ASP  43          HB2       ASP  43   5.789   8.376 -10.465
  298   2HB   ASP  43          HB1       ASP  43   5.557   6.842 -11.297
  299    H    TYR  44           HN       TYR  44   2.945   5.766  -8.183
  300    HA   TYR  44           HA       TYR  44   3.311   3.392  -9.858
  301   1HB   TYR  44          HB2       TYR  44   2.301   3.097  -7.081
  302   2HB   TYR  44          HB1       TYR  44   3.436   2.104  -7.979
  303    HD1  TYR  44           HD1      TYR  44   3.497   3.303  -5.060
  304    HD2  TYR  44           HD2      TYR  44   5.373   4.347  -8.733
  305    HE1  TYR  44           HE1      TYR  44   5.357   4.316  -3.813
  306    HE2  TYR  44           HE2      TYR  44   7.240   5.363  -7.495
  307    HH   TYR  44           HH       TYR  44   7.742   6.266  -5.332
  308    HA   PRO  45           HA       PRO  45  -1.037   3.043 -10.522
  309   1HB   PRO  45          HB2       PRO  45  -1.288   0.471 -11.153
  310   2HB   PRO  45          HB1       PRO  45  -0.298   1.555 -12.137
  311   1HG   PRO  45          HG2       PRO  45   0.546  -0.467 -10.110
  312   2HG   PRO  45          HG1       PRO  45   1.299  -0.048 -11.658
  313   1HD   PRO  45          HD2       PRO  45   2.100   0.883  -9.150
  314   2HD   PRO  45          HD1       PRO  45   2.545   1.600 -10.711
  315    H    LYS  46           HN       LYS  46   0.300   0.901  -8.074
  316    HA   LYS  46           HA       LYS  46  -2.155   1.102  -6.541
  317   1HB   LYS  46          HB2       LYS  46  -2.529  -0.895  -7.911
  318   2HB   LYS  46          HB1       LYS  46  -1.011  -1.541  -7.343
  319   1HG   LYS  46          HG2       LYS  46  -1.819  -1.856  -5.154
  320   2HG   LYS  46          HG1       LYS  46  -3.234  -0.851  -5.459
  321   1HD   LYS  46          HD2       LYS  46  -3.439  -2.832  -7.369
  322   2HD   LYS  46          HD1       LYS  46  -2.813  -3.691  -5.960
  323   1HE   LYS  46          HE2       LYS  46  -4.734  -2.166  -4.814
  324   2HE   LYS  46          HE1       LYS  46  -5.439  -2.435  -6.407
  325   1HZ   LYS  46          HZ1       LYS  46  -6.064  -4.132  -4.752
  326   2HZ   LYS  46          HZ2       LYS  46  -4.442  -4.596  -4.631
  327   3HZ   LYS  46          HZ3       LYS  46  -5.269  -4.789  -6.094
  Start of MODEL   20
    1   1H    LYS   1          HT1       LYS   1  -8.048   0.437  -0.402
    2   2H    LYS   1          HT2       LYS   1  -6.684   1.152   0.355
    3   3H    LYS   1          HT3       LYS   1  -6.672  -0.517  -0.036
    4    HA   LYS   1           HA       LYS   1  -6.693  -0.050  -2.328
    5   1HB   LYS   1          HB2       LYS   1  -8.122   1.996  -2.045
    6   2HB   LYS   1          HB1       LYS   1  -6.687   2.864  -1.523
    7   1HG   LYS   1          HG2       LYS   1  -7.309   3.223  -3.905
    8   2HG   LYS   1          HG1       LYS   1  -5.667   2.625  -3.661
    9   1HD   LYS   1          HD2       LYS   1  -7.741   0.562  -4.036
   10   2HD   LYS   1          HD1       LYS   1  -7.407   1.577  -5.440
   11   1HE   LYS   1          HE2       LYS   1  -4.976   1.065  -5.120
   12   2HE   LYS   1          HE1       LYS   1  -5.448  -0.100  -3.883
   13   1HZ   LYS   1          HZ1       LYS   1  -5.086  -1.090  -6.101
   14   2HZ   LYS   1          HZ2       LYS   1  -6.386  -0.187  -6.698
   15   3HZ   LYS   1          HZ3       LYS   1  -6.647  -1.357  -5.504
   16    H    SER   2           HN       SER   2  -5.089   2.632  -0.648
   17    HA   SER   2           HA       SER   2  -2.915   3.206  -0.435
   18   1HB   SER   2          HB2       SER   2  -3.140   0.498   0.393
   19   2HB   SER   2          HB1       SER   2  -1.597   0.694  -0.431
   20    HG   SER   2           HG       SER   2  -1.322   2.591   0.964
   21    H    CYS   3           HN       CYS   3  -0.706   3.039  -1.415
   22    HA   CYS   3           HA       CYS   3  -0.839   2.153  -4.218
   23   1HB   CYS   3          HB2       CYS   3  -1.144   4.502  -4.357
   24   2HB   CYS   3          HB1       CYS   3   0.072   4.811  -3.127
   25    H    CYS   4           HN       CYS   4   1.027   1.281  -5.078
   26    HA   CYS   4           HA       CYS   4   3.457   1.328  -3.459
   27   1HB   CYS   4          HB2       CYS   4   2.215  -1.260  -4.410
   28   2HB   CYS   4          HB1       CYS   4   3.722  -1.088  -3.515
   29    HA   PRO   5           HA       PRO   5   5.263   1.745  -7.469
   30   1HB   PRO   5          HB2       PRO   5   7.834   1.125  -6.888
   31   2HB   PRO   5          HB1       PRO   5   7.080   2.646  -6.393
   32   1HG   PRO   5          HG2       PRO   5   7.530   0.147  -4.803
   33   2HG   PRO   5          HG1       PRO   5   7.778   1.837  -4.325
   34   1HD   PRO   5          HD2       PRO   5   5.582   0.423  -3.604
   35   2HD   PRO   5          HD1       PRO   5   5.542   2.175  -3.887
   36    H    ASN   6           HN       ASN   6   5.072  -1.256  -5.841
   37    HA   ASN   6           HA       ASN   6   5.161  -2.701  -8.294
   38   1HB   ASN   6          HB2       ASN   6   7.567  -2.668  -6.548
   39   2HB   ASN   6          HB1       ASN   6   7.086  -4.222  -7.220
   40   1HD2  ASN   6          HD21      ASN   6   8.857  -1.473  -7.739
   41   2HD2  ASN   6          HD22      ASN   6   9.080  -1.606  -9.447
   42    H    THR   7           HN       THR   7   5.046  -5.133  -7.856
   43    HA   THR   7           HA       THR   7   2.877  -5.638  -6.161
   44    HB   THR   7           HB       THR   7   3.142  -7.127  -7.954
   45    HG1  THR   7           HG1      THR   7   4.138  -8.611  -5.759
   46   1HG2  THR   7          HG21      THR   7   5.204  -8.654  -8.042
   47   2HG2  THR   7          HG22      THR   7   5.980  -7.409  -7.062
   48   3HG2  THR   7          HG23      THR   7   5.345  -7.006  -8.657
   49    H    THR   8           HN       THR   8   6.319  -5.762  -5.594
   50    HA   THR   8           HA       THR   8   6.378  -7.373  -3.312
   51    HB   THR   8           HB       THR   8   8.376  -5.742  -2.729
   52    HG1  THR   8           HG1      THR   8   7.588  -4.260  -4.428
   53   1HG2  THR   8          HG21      THR   8   8.333  -8.133  -3.836
   54   2HG2  THR   8          HG22      THR   8   9.803  -7.161  -3.777
   55   3HG2  THR   8          HG23      THR   8   8.841  -7.219  -5.255
   56    H    GLY   9           HN       GLY   9   5.084  -4.231  -3.761
   57   1HA   GLY   9          HA2       GLY   9   5.057  -3.733  -0.863
   58   2HA   GLY   9          HA1       GLY   9   4.721  -2.539  -2.112
   59    H    ARG  10           HN       ARG  10   2.935  -3.900  -3.686
   60    HA   ARG  10           HA       ARG  10   0.502  -3.458  -2.388
   61   1HB   ARG  10          HB2       ARG  10   1.380  -4.584  -4.963
   62   2HB   ARG  10          HB1       ARG  10  -0.184  -5.163  -4.412
   63   1HG   ARG  10          HG2       ARG  10   0.575  -2.264  -4.712
   64   2HG   ARG  10          HG1       ARG  10  -0.349  -3.203  -5.886
   65   1HD   ARG  10          HD2       ARG  10  -1.396  -3.323  -3.153
   66   2HD   ARG  10          HD1       ARG  10  -1.419  -1.711  -3.864
   67    HE   ARG  10           HE       ARG  10  -2.453  -3.569  -5.710
   68   1HH1  ARG  10          HH11      ARG  10  -3.280  -2.005  -2.701
   69   2HH1  ARG  10          HH12      ARG  10  -4.987  -2.099  -2.978
   70   1HH2  ARG  10          HH21      ARG  10  -4.698  -3.692  -6.075
   71   2HH2  ARG  10          HH22      ARG  10  -5.792  -3.058  -4.892
   72    H    ASN  11           HN       ASN  11   2.340  -6.442  -2.882
   73    HA   ASN  11           HA       ASN  11   0.427  -8.268  -2.008
   74   1HB   ASN  11          HB2       ASN  11   2.380  -9.738  -1.599
   75   2HB   ASN  11          HB1       ASN  11   2.418  -8.967  -3.165
   76   1HD2  ASN  11          HD21      ASN  11   4.687 -10.036  -2.162
   77   2HD2  ASN  11          HD22      ASN  11   5.786  -8.780  -1.716
   78    H    ILE  12           HN       ILE  12   3.138  -6.891  -0.141
   79    HA   ILE  12           HA       ILE  12   2.363  -8.032   2.298
   80    HB   ILE  12           HB       ILE  12   4.065  -5.657   1.623
   81   1HG1  ILE  12          HG12      ILE  12   5.473  -7.395   3.240
   82   2HG1  ILE  12          HG11      ILE  12   4.428  -8.476   2.325
   83   1HG2  ILE  12          HG21      ILE  12   2.902  -6.309   4.270
   84   2HG2  ILE  12          HG22      ILE  12   3.384  -4.752   3.595
   85   3HG2  ILE  12          HG23      ILE  12   4.606  -5.858   4.222
   86   1HD1  ILE  12          HD11      ILE  12   6.259  -8.384   0.970
   87   2HD1  ILE  12          HD12      ILE  12   6.621  -6.709   1.386
   88   3HD1  ILE  12          HD13      ILE  12   5.290  -7.077   0.293
   89    H    TYR  13           HN       TYR  13   1.565  -4.841   0.944
   90    HA   TYR  13           HA       TYR  13   0.039  -4.021   3.170
   91   1HB   TYR  13          HB2       TYR  13   1.006  -2.722   1.071
   92   2HB   TYR  13          HB1       TYR  13  -0.605  -3.031   0.441
   93    HD1  TYR  13           HD1      TYR  13   1.353  -0.770   2.243
   94    HD2  TYR  13           HD2      TYR  13  -2.559  -2.438   2.160
   95    HE1  TYR  13           HE1      TYR  13   0.510   1.160   3.512
   96    HE2  TYR  13           HE2      TYR  13  -3.413  -0.511   3.427
   97    HH   TYR  13           HH       TYR  13  -1.422   1.663   5.028
   98    H    ASN  14           HN       ASN  14  -0.703  -5.861   0.281
   99    HA   ASN  14           HA       ASN  14  -3.525  -5.795   0.566
  100   1HB   ASN  14          HB2       ASN  14  -1.564  -7.330  -1.064
  101   2HB   ASN  14          HB1       ASN  14  -3.179  -7.992  -0.892
  102   1HD2  ASN  14          HD21      ASN  14  -2.132  -4.626  -1.091
  103   2HD2  ASN  14          HD22      ASN  14  -3.023  -4.249  -2.522
  104    H    THR  15           HN       THR  15  -1.134  -8.383   1.211
  105    HA   THR  15           HA       THR  15  -2.963 -10.120   2.457
  106    HB   THR  15           HB       THR  15  -0.138 -10.147   3.346
  107    HG1  THR  15           HG1      THR  15   0.678 -10.250   1.428
  108   1HG2  THR  15          HG21      THR  15  -1.756 -12.330   2.080
  109   2HG2  THR  15          HG22      THR  15  -1.761 -11.992   3.811
  110   3HG2  THR  15          HG23      THR  15  -0.266 -12.482   3.012
  111    H    CYS  16           HN       CYS  16  -0.826  -7.600   3.716
  112    HA   CYS  16           HA       CYS  16  -1.162  -8.018   6.444
  113   1HB   CYS  16          HB2       CYS  16   0.469  -6.443   5.810
  114   2HB   CYS  16          HB1       CYS  16  -0.653  -5.559   4.787
  115    H    ARG  17           HN       ARG  17  -2.947  -5.708   4.380
  116    HA   ARG  17           HA       ARG  17  -4.888  -5.004   6.262
  117   1HB   ARG  17          HB2       ARG  17  -4.523  -4.745   3.374
  118   2HB   ARG  17          HB1       ARG  17  -6.213  -4.917   3.822
  119   1HG   ARG  17          HG2       ARG  17  -5.390  -3.079   5.633
  120   2HG   ARG  17          HG1       ARG  17  -4.362  -2.686   4.254
  121   1HD   ARG  17          HD2       ARG  17  -6.227  -1.389   3.844
  122   2HD   ARG  17          HD1       ARG  17  -6.572  -2.836   2.897
  123    HE   ARG  17           HE       ARG  17  -7.725  -3.343   5.304
  124   1HH1  ARG  17          HH11      ARG  17  -7.965  -0.729   3.006
  125   2HH1  ARG  17          HH12      ARG  17  -9.608  -0.358   3.411
  126   1HH2  ARG  17          HH21      ARG  17  -9.885  -2.857   5.838
  127   2HH2  ARG  17          HH22      ARG  17 -10.697  -1.566   5.019
  128    H    LEU  18           HN       LEU  18  -4.632  -7.713   4.077
  129    HA   LEU  18           HA       LEU  18  -7.206  -8.758   4.250
  130   1HB   LEU  18          HB2       LEU  18  -4.581  -9.625   3.382
  131   2HB   LEU  18          HB1       LEU  18  -5.481 -10.949   4.093
  132    HG   LEU  18           HG       LEU  18  -6.335  -9.229   1.770
  133   1HD1  LEU  18          HD11      LEU  18  -5.587 -12.145   1.947
  134   2HD1  LEU  18          HD12      LEU  18  -4.634 -10.865   1.196
  135   3HD1  LEU  18          HD13      LEU  18  -6.189 -11.325   0.506
  136   1HD2  LEU  18          HD21      LEU  18  -8.202 -10.983   1.666
  137   2HD2  LEU  18          HD22      LEU  18  -8.335  -9.708   2.877
  138   3HD2  LEU  18          HD23      LEU  18  -7.796 -11.320   3.348
  139    H    GLY  19           HN       GLY  19  -4.707  -8.615   6.598
  140   1HA   GLY  19          HA2       GLY  19  -5.902 -10.735   8.215
  141   2HA   GLY  19          HA1       GLY  19  -4.384  -9.917   8.544
  142    H    GLY  20           HN       GLY  20  -6.569  -7.582   7.711
  143   1HA   GLY  20          HA2       GLY  20  -7.814  -6.059   8.881
  144   2HA   GLY  20          HA1       GLY  20  -8.119  -7.326  10.056
  145    H    GLY  21           HN       GLY  21  -5.079  -5.721   9.075
  146   1HA   GLY  21          HA2       GLY  21  -4.667  -5.081  11.912
  147   2HA   GLY  21          HA1       GLY  21  -3.380  -5.343  10.742
  148    H    SER  22           HN       SER  22  -2.600  -3.303  11.560
  149    HA   SER  22           HA       SER  22  -4.036  -0.885  11.112
  150   1HB   SER  22          HB2       SER  22  -1.193  -0.452  11.180
  151   2HB   SER  22          HB1       SER  22  -2.423   0.013  12.353
  152    HG   SER  22           HG       SER  22  -2.235  -2.045  13.286
  153    H    ARG  23           HN       ARG  23  -3.669   0.713   9.612
  154    HA   ARG  23           HA       ARG  23  -3.178  -0.210   6.959
  155   1HB   ARG  23          HB2       ARG  23  -4.480   1.973   8.121
  156   2HB   ARG  23          HB1       ARG  23  -3.144   2.675   7.219
  157   1HG   ARG  23          HG2       ARG  23  -3.954   1.212   5.272
  158   2HG   ARG  23          HG1       ARG  23  -5.440   1.044   6.209
  159   1HD   ARG  23          HD2       ARG  23  -5.866   3.364   6.136
  160   2HD   ARG  23          HD1       ARG  23  -4.235   3.722   5.570
  161    HE   ARG  23           HE       ARG  23  -5.242   2.175   3.596
  162   1HH1  ARG  23          HH11      ARG  23  -6.410   5.046   5.200
  163   2HH1  ARG  23          HH12      ARG  23  -7.273   5.621   3.814
  164   1HH2  ARG  23          HH21      ARG  23  -6.377   2.931   1.771
  165   2HH2  ARG  23          HH22      ARG  23  -7.255   4.420   1.867
  166    H    GLU  24           HN       GLU  24  -1.508   1.930   9.183
  167    HA   GLU  24           HA       GLU  24   0.682   2.483   7.459
  168   1HB   GLU  24          HB2       GLU  24   0.889   2.716  10.432
  169   2HB   GLU  24          HB1       GLU  24   1.527   3.778   9.184
  170   1HG   GLU  24          HG2       GLU  24  -0.943   4.289   8.667
  171   2HG   GLU  24          HG1       GLU  24  -1.258   3.590  10.254
  172    H    ARG  25           HN       ARG  25  -0.021  -0.091   9.676
  173    HA   ARG  25           HA       ARG  25   2.534  -0.959  10.334
  174   1HB   ARG  25          HB2       ARG  25   0.485  -1.871  11.339
  175   2HB   ARG  25          HB1       ARG  25   0.079  -2.644   9.813
  176   1HG   ARG  25          HG2       ARG  25   1.852  -4.174   9.991
  177   2HG   ARG  25          HG1       ARG  25   2.632  -3.241  11.271
  178   1HD   ARG  25          HD2       ARG  25   0.723  -3.738  12.753
  179   2HD   ARG  25          HD1       ARG  25   0.014  -4.725  11.476
  180    HE   ARG  25           HE       ARG  25   1.464  -6.404  12.024
  181   1HH1  ARG  25          HH11      ARG  25   2.634  -3.422  13.410
  182   2HH1  ARG  25          HH12      ARG  25   3.897  -4.190  14.311
  183   1HH2  ARG  25          HH21      ARG  25   3.125  -7.417  13.209
  184   2HH2  ARG  25          HH22      ARG  25   4.177  -6.458  14.197
  185    H    CYS  26           HN       CYS  26   0.541  -1.828   7.536
  186    HA   CYS  26           HA       CYS  26   2.511  -3.545   6.397
  187   1HB   CYS  26          HB2       CYS  26   0.667  -2.406   4.446
  188   2HB   CYS  26          HB1       CYS  26   0.939  -4.083   4.891
  189    H    ALA  27           HN       ALA  27   1.604  -0.169   5.924
  190    HA   ALA  27           HA       ALA  27   3.173   0.421   3.710
  191   1HB   ALA  27          HB1       ALA  27   1.499   1.865   5.218
  192   2HB   ALA  27          HB2       ALA  27   2.663   2.597   4.112
  193   3HB   ALA  27          HB3       ALA  27   3.034   2.480   5.832
  194    H    SER  28           HN       SER  28   4.035   0.534   7.157
  195    HA   SER  28           HA       SER  28   6.730   1.306   6.683
  196   1HB   SER  28          HB2       SER  28   7.069   0.657   9.075
  197   2HB   SER  28          HB1       SER  28   5.719   1.767   8.839
  198    HG   SER  28           HG       SER  28   5.728  -0.860   9.683
  199    H    LEU  29           HN       LEU  29   5.001  -1.676   6.696
  200    HA   LEU  29           HA       LEU  29   7.181  -3.445   7.106
  201   1HB   LEU  29          HB2       LEU  29   4.495  -3.722   7.067
  202   2HB   LEU  29          HB1       LEU  29   4.885  -4.350   5.480
  203    HG   LEU  29           HG       LEU  29   4.705  -6.090   7.252
  204   1HD1  LEU  29          HD11      LEU  29   5.876  -6.837   5.414
  205   2HD1  LEU  29          HD12      LEU  29   7.044  -7.082   6.712
  206   3HD1  LEU  29          HD13      LEU  29   7.189  -5.684   5.647
  207   1HD2  LEU  29          HD21      LEU  29   6.196  -6.253   9.019
  208   2HD2  LEU  29          HD22      LEU  29   5.844  -4.526   8.963
  209   3HD2  LEU  29          HD23      LEU  29   7.349  -5.141   8.281
  210    H    SER  30           HN       SER  30   5.340  -2.713   4.132
  211    HA   SER  30           HA       SER  30   7.517  -3.792   2.535
  212   1HB   SER  30          HB2       SER  30   4.712  -3.630   2.225
  213   2HB   SER  30          HB1       SER  30   5.422  -2.665   0.930
  214    HG   SER  30           HG       SER  30   6.717  -4.492   0.411
  215    H    GLY  31           HN       GLY  31   6.184  -0.715   3.428
  216   1HA   GLY  31          HA2       GLY  31   7.327   1.329   3.251
  217   2HA   GLY  31          HA1       GLY  31   8.387   0.607   2.049
  218    H    CYS  32           HN       CYS  32   4.889   0.429   1.935
  219    HA   CYS  32           HA       CYS  32   4.855   1.524  -0.709
  220   1HB   CYS  32          HB2       CYS  32   2.746   0.518   1.182
  221   2HB   CYS  32          HB1       CYS  32   2.315   1.292  -0.333
  222    H    LYS  33           HN       LYS  33   2.811   3.081  -1.061
  223    HA   LYS  33           HA       LYS  33   3.246   5.395   0.707
  224   1HB   LYS  33          HB2       LYS  33   3.481   5.140  -2.131
  225   2HB   LYS  33          HB1       LYS  33   2.152   6.235  -1.779
  226   1HG   LYS  33          HG2       LYS  33   4.944   6.504  -0.687
  227   2HG   LYS  33          HG1       LYS  33   4.297   7.396  -2.066
  228   1HD   LYS  33          HD2       LYS  33   3.805   8.943  -0.498
  229   2HD   LYS  33          HD1       LYS  33   2.399   7.914  -0.217
  230   1HE   LYS  33          HE2       LYS  33   3.130   7.269   1.801
  231   2HE   LYS  33          HE1       LYS  33   4.790   7.071   1.239
  232   1HZ   LYS  33          HZ1       LYS  33   3.620   9.745   1.705
  233   2HZ   LYS  33          HZ2       LYS  33   5.252   9.315   1.600
  234   3HZ   LYS  33          HZ3       LYS  33   4.346   8.866   2.955
  235    H    ILE  34           HN       ILE  34   1.539   6.066   1.821
  236    HA   ILE  34           HA       ILE  34  -1.078   4.960   1.188
  237    HB   ILE  34           HB       ILE  34  -0.151   4.883   3.520
  238   1HG1  ILE  34          HG12      ILE  34  -2.374   5.928   4.501
  239   2HG1  ILE  34          HG11      ILE  34  -2.807   6.042   2.797
  240   1HG2  ILE  34          HG21      ILE  34  -0.856   7.802   3.664
  241   2HG2  ILE  34          HG22      ILE  34   0.787   7.229   3.389
  242   3HG2  ILE  34          HG23      ILE  34  -0.054   6.808   4.880
  243   1HD1  ILE  34          HD11      ILE  34  -3.633   3.986   3.189
  244   2HD1  ILE  34          HD12      ILE  34  -2.528   3.677   4.529
  245   3HD1  ILE  34          HD13      ILE  34  -1.967   3.505   2.867
  246    H    ILE  35           HN       ILE  35  -2.503   6.064   0.033
  247    HA   ILE  35           HA       ILE  35  -2.450   9.008   0.163
  248    HB   ILE  35           HB       ILE  35  -3.139   7.425  -2.309
  249   1HG1  ILE  35          HG12      ILE  35  -0.716   9.055  -2.411
  250   2HG1  ILE  35          HG11      ILE  35  -0.597   7.737  -1.249
  251   1HG2  ILE  35          HG21      ILE  35  -4.137   9.711  -1.976
  252   2HG2  ILE  35          HG22      ILE  35  -3.176   9.507  -3.440
  253   3HG2  ILE  35          HG23      ILE  35  -2.496  10.352  -2.049
  254   1HD1  ILE  35          HD11      ILE  35  -1.123   7.563  -4.197
  255   2HD1  ILE  35          HD12      ILE  35  -1.358   6.205  -3.097
  256   3HD1  ILE  35          HD13      ILE  35   0.243   6.918  -3.288
  257    H    SER  36           HN       SER  36  -4.431   6.179  -0.693
  258    HA   SER  36           HA       SER  36  -6.604   5.681  -0.209
  259   1HB   SER  36          HB2       SER  36  -7.665   6.659   1.578
  260   2HB   SER  36          HB1       SER  36  -6.014   7.181   1.910
  261    HG   SER  36           HG       SER  36  -6.486   9.184   1.176
  262    H    ALA  37           HN       ALA  37  -5.550   7.579  -2.396
  263    HA   ALA  37           HA       ALA  37  -8.208   8.479  -3.289
  264   1HB   ALA  37          HB1       ALA  37  -6.514  10.301  -2.600
  265   2HB   ALA  37          HB2       ALA  37  -7.371  10.476  -4.132
  266   3HB   ALA  37          HB3       ALA  37  -5.704   9.899  -4.114
  267    H    SER  38           HN       SER  38  -6.264   6.090  -3.762
  268    HA   SER  38           HA       SER  38  -5.907   4.630  -5.460
  269   1HB   SER  38          HB2       SER  38  -8.078   6.284  -6.435
  270   2HB   SER  38          HB1       SER  38  -7.041   5.757  -7.761
  271    HG   SER  38           HG       SER  38  -8.165   4.047  -5.794
  272    H    THR  39           HN       THR  39  -5.881   7.846  -7.022
  273    HA   THR  39           HA       THR  39  -3.817   7.392  -8.794
  274    HB   THR  39           HB       THR  39  -5.039   9.384  -9.068
  275    HG1  THR  39           HG1      THR  39  -2.580  10.274  -7.987
  276   1HG2  THR  39          HG21      THR  39  -5.947   9.926  -7.001
  277   2HG2  THR  39          HG22      THR  39  -4.832  11.251  -7.336
  278   3HG2  THR  39          HG23      THR  39  -4.369   9.972  -6.214
  279    H    CYS  40           HN       CYS  40  -1.652   7.282  -8.696
  280    HA   CYS  40           HA       CYS  40  -0.425   7.352  -6.052
  281   1HB   CYS  40          HB2       CYS  40   0.422   6.229  -8.713
  282   2HB   CYS  40          HB1       CYS  40   1.565   6.391  -7.382
  283    HA   PRO  41           HA       PRO  41   1.237  11.423  -6.691
  284   1HB   PRO  41          HB2       PRO  41   3.334  11.194  -4.906
  285   2HB   PRO  41          HB1       PRO  41   1.679  11.626  -4.471
  286   1HG   PRO  41          HG2       PRO  41   3.052   8.978  -4.305
  287   2HG   PRO  41          HG1       PRO  41   1.922   9.729  -3.166
  288   1HD   PRO  41          HD2       PRO  41   1.139   7.792  -4.846
  289   2HD   PRO  41          HD1       PRO  41   0.067   9.144  -4.426
  290    H    SER  42           HN       SER  42   4.046   9.395  -5.916
  291    HA   SER  42           HA       SER  42   5.835  10.560  -7.624
  292   1HB   SER  42          HB2       SER  42   5.630   7.864  -6.383
  293   2HB   SER  42          HB1       SER  42   6.808   8.064  -7.679
  294    HG   SER  42           HG       SER  42   6.643   9.815  -5.460
  295    H    ASP  43           HN       ASP  43   4.807   7.273  -8.451
  296    HA   ASP  43           HA       ASP  43   3.515   7.786 -10.853
  297   1HB   ASP  43          HB2       ASP  43   5.400   7.174 -12.452
  298   2HB   ASP  43          HB1       ASP  43   5.460   8.794 -11.764
  299    H    TYR  44           HN       TYR  44   3.391   5.938  -8.715
  300    HA   TYR  44           HA       TYR  44   4.353   3.397  -9.706
  301   1HB   TYR  44          HB2       TYR  44   2.491   3.901  -7.383
  302   2HB   TYR  44          HB1       TYR  44   3.424   2.447  -7.697
  303    HD1  TYR  44           HD1      TYR  44   5.778   4.614  -8.601
  304    HD2  TYR  44           HD2      TYR  44   3.586   3.652  -5.082
  305    HE1  TYR  44           HE1      TYR  44   7.611   5.497  -7.223
  306    HE2  TYR  44           HE2      TYR  44   5.415   4.535  -3.697
  307    HH   TYR  44           HH       TYR  44   8.038   4.850  -4.093
  308    HA   PRO  45           HA       PRO  45   0.719   2.114 -11.796
  309   1HB   PRO  45          HB2       PRO  45   0.736  -0.574 -10.740
  310   2HB   PRO  45          HB1       PRO  45   1.284  -0.007 -12.317
  311   1HG   PRO  45          HG2       PRO  45   2.962  -0.956 -10.378
  312   2HG   PRO  45          HG1       PRO  45   3.454   0.195 -11.631
  313   1HD   PRO  45          HD2       PRO  45   2.713   0.701  -8.773
  314   2HD   PRO  45          HD1       PRO  45   4.008   1.430  -9.749
  315    H    LYS  46           HN       LYS  46   0.651   0.805  -8.484
  316    HA   LYS  46           HA       LYS  46  -2.218   1.425  -8.427
  317   1HB   LYS  46          HB2       LYS  46  -0.801  -1.060  -7.765
  318   2HB   LYS  46          HB1       LYS  46  -2.001  -0.561  -6.583
  319   1HG   LYS  46          HG2       LYS  46  -2.457  -1.069  -9.515
  320   2HG   LYS  46          HG1       LYS  46  -3.003  -2.066  -8.164
  321   1HD   LYS  46          HD2       LYS  46  -4.183   0.128  -7.390
  322   2HD   LYS  46          HD1       LYS  46  -3.996   0.600  -9.080
  323   1HE   LYS  46          HE2       LYS  46  -5.065  -1.645  -9.646
  324   2HE   LYS  46          HE1       LYS  46  -5.521  -1.725  -7.945
  325   1HZ   LYS  46          HZ1       LYS  46  -6.390   0.700  -8.545
  326   2HZ   LYS  46          HZ2       LYS  46  -7.346  -0.684  -8.726
  327   3HZ   LYS  46          HZ3       LYS  46  -6.553  -0.023 -10.067