*HEADER    TRANSFERASE                             18-MAR-06   2GE9              
*TITLE     SOLUTION STRUCTURES OF THE SH2 DOMAIN OF BRUTON'S TYROSINE            
*TITLE    2 KINASE                                                               
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TYROSINE-PROTEIN KINASE BTK;                               
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: SH2 DOMAIN;                                                
*COMPND   5 SYNONYM: BRUTON'S TYROSINE KINASE, AGAMMAGLOBULINAEMIA               
*COMPND   6 TYROSINE KINASE, ATK, B CELL PROGENITOR KINASE, BPK;                 
*COMPND   7 EC: 2.7.1.112;                                                       
*COMPND   8 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: BTK, AGMX1, ATK, BPK;                                          
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PET21B                                    
*KEYWDS    SH2 DOMAIN, BTK, STRUCTURE                                            
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    J.-W.CHENG, K.-C.HUANG                                                
*REVDAT   1   24-OCT-06 2GE9    0                                                

remarks BTK-SH2   
remarks           
remarks Current input reference distance: 1.80(NOE of...)
remarks Distance cut-off		 : 5.00
!set message=off echo=off end

! All residue number have been added 1.
!                                                               D Dminus Dplus  
remarks :  Intraresidue 
assign (resid    1 and  name HA   )(resid    1 and  name HB  ) 5.00 3.20 0.00 
assign (resid    1 and  name HA   )(resid    1 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    1 and  name HB   )(resid    1 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    2 and  name HN   )(resid    2 and  name HA  ) 5.00 3.20 0.00
assign (resid    2 and  name HN   )(resid    2 and  name HB1  ) 5.00 3.20 0.00
assign (resid    2 and  name HN   )(resid    2 and  name HB2  ) 5.00 3.20 0.00
assign (resid    2 and  name HN   )(resid    2 and  name HG*  ) 5.00 3.20 0.00
assign (resid    2 and  name HA   )(resid    2 and  name HB1  ) 5.00 3.20 0.00
assign (resid    2 and  name HA   )(resid    2 and  name HB2  ) 5.00 3.20 0.00
assign (resid    2 and  name HA   )(resid    2 and  name HG*  ) 5.00 3.20 0.00
assign (resid    2 and  name HB1   )(resid    2 and  name HG*  ) 5.00 3.20 0.00
assign (resid    2 and  name HB2   )(resid    2 and  name HG*  ) 5.00 3.20 0.00
assign (resid    3 and  name HN   )(resid    3 and  name HA  ) 5.00 3.20 0.00
assign (resid    3 and  name HN   )(resid    3 and  name HB*  ) 5.00 3.20 0.00
assign (resid    3 and  name HA   )(resid    3 and  name HB*  ) 5.00 3.20 0.00
assign (resid    4 and  name HN   )(resid    4 and  name HA  ) 5.00 3.20 0.00
assign (resid    4 and  name HN   )(resid    4 and  name HG*  ) 5.00 3.20 0.00
assign (resid    4 and  name HN   )(resid    4 and  name HB*  ) 5.00 3.20 0.00
assign (resid    4 and  name HA   )(resid    4 and  name HG*  ) 5.00 3.20 0.00
assign (resid    4 and  name HB*   )(resid    4 and  name HG*  ) 2.80 1.00 0.00
assign (resid    5 and  name HN   )(resid    5 and  name HB1  ) 5.00 3.20 0.00
assign (resid    5 and  name HN   )(resid    5 and  name HB2  ) 5.00 3.20 0.00
assign (resid    5 and  name HA   )(resid    5 and  name HB1  ) 2.80 1.00 0.00
assign (resid    5 and  name HA   )(resid    5 and  name HB2  ) 2.80 1.00 0.00
assign (resid    6 and  name HN   )(resid    6 and  name HA  ) 5.00 3.20 0.00
assign (resid    6 and  name HN   )(resid    6 and  name HB1  ) 5.00 3.20 0.00
assign (resid    6 and  name HN   )(resid    6 and  name HB2  ) 5.00 3.20 0.00
assign (resid    6 and  name HA   )(resid    6 and  name HB1  ) 2.80 1.00 0.00
assign (resid    6 and  name HA   )(resid    6 and  name HB2  ) 3.60 1.80 0.00
assign (resid    7 and  name HN   )(resid    7 and  name HA  ) 3.60 1.80 0.00
assign (resid    7 and  name HN   )(resid    7 and  name HB*  ) 2.80 1.00 0.00
assign (resid    7 and  name HN   )(resid    7 and  name HG*  ) 5.00 3.20 0.00
assign (resid    7 and  name HA   )(resid    7 and  name HB*  ) 5.00 3.20 0.00
assign (resid    8 and  name HN   )(resid    8 and  name HA  ) 2.80 1.00 0.00
assign (resid    8 and  name HN   )(resid    8 and  name HB*  ) 5.00 3.20 0.00
assign (resid    8 and  name HN   )(resid    8 and  name HG*  ) 2.80 1.00 0.00
assign (resid    8 and  name HA   )(resid    8 and  name HB1  ) 5.00 3.20 0.00
assign (resid    8 and  name HA   )(resid    8 and  name HB2  ) 5.00 3.20 0.00
assign (resid    8 and  name HA   )(resid    8 and  name HG*  ) 2.80 1.00 0.00
assign (resid    8 and  name HB1   )(resid    8 and  name HG*  ) 2.80 1.00 0.00
assign (resid    8 and  name HB2   )(resid    8 and  name HG*  ) 2.80 1.00 0.00
assign (resid    9 and  name HN   )(resid    9 and  name HA  ) 2.80 1.00 0.00
assign (resid    9 and  name HN   )(resid    9 and  name HB*  ) 3.60 1.80 0.00
assign (resid    9 and  name HN   )(resid    9 and  name HE*  ) 2.80 1.00 0.00
assign (resid    9 and  name HN   )(resid    9 and  name HG*  ) 5.00 3.20 0.00
assign (resid    9 and  name HA   )(resid    9 and  name HB*  ) 2.80 1.00 0.00
assign (resid    9 and  name HA   )(resid    9 and  name HE*  ) 5.00 3.20 0.00
assign (resid    10 and  name HN   )(resid    10 and  name HA  ) 2.80 1.00 0.00
assign (resid    10 and  name HN   )(resid    10 and  name HD*  ) 3.60 1.80 0.00
assign (resid    10 and  name HN   )(resid    10 and  name HE*  ) 5.00 3.20 0.00
assign (resid    11 and  name HN   )(resid    11 and  name HA  ) 3.60 1.80 0.00
assign (resid    11 and  name HN   )(resid    11 and  name HB*  ) 3.60 1.80 0.00
assign (resid    11 and  name HN   )(resid    11 and  name HG*  ) 5.00 3.20 0.00
assign (resid    11 and  name HA   )(resid    11 and  name HB*  ) 5.00 3.20 0.00
assign (resid    11 and  name HA   )(resid    11 and  name HG*  ) 3.60 1.80 0.00
assign (resid    11 and  name HB*   )(resid    11 and  name HG*  ) 2.80 1.00 0.00
assign (resid    12 and  name HN   )(resid    12 and  name HB*  ) 3.60 1.80 0.00
assign (resid    12 and  name HN   )(resid    12 and  name HD1  ) 3.60 1.80 0.00
assign (resid    12 and  name HN   )(resid    12 and  name HE1  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    12 and  name HB*  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    12 and  name HD1  ) 5.00 3.20 0.00
assign (resid    13 and  name HA   )(resid    13 and  name HB*  ) 5.00 3.20 0.00
assign (resid    13 and  name HA   )(resid    13 and  name HE*  ) 5.00 3.20 0.00
assign (resid    13 and  name HA   )(resid    13 and  name HD*  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    14 and  name HA  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    14 and  name HB*  ) 5.00 3.20 0.00
assign (resid    14 and  name HA   )(resid    14 and  name HB*  ) 5.00 3.20 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HA  ) 3.60 1.80 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HB*  ) 2.80 1.00 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HG*  ) 5.00 3.20 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HD*  ) 3.60 1.80 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HZ*  ) 5.00 3.20 0.00
assign (resid    15 and  name HN   )(resid    15 and  name HE*  ) 5.00 3.20 0.00
assign (resid    15 and  name HA   )(resid    15 and  name HB*  ) 2.80 1.00 0.00
assign (resid    15 and  name HA   )(resid    15 and  name HG*  ) 5.00 3.20 0.00
assign (resid    15 and  name HA   )(resid    15 and  name HD*  ) 3.60 1.80 0.00
assign (resid    16 and  name HN   )(resid    16 and  name HA  ) 2.80 1.00 0.00
assign (resid    16 and  name HN   )(resid    16 and  name HB*  ) 3.60 1.80 0.00
assign (resid    16 and  name HN   )(resid    16 and  name HD*  ) 3.60 1.80 0.00
assign (resid    16 and  name HA   )(resid    16 and  name HB*  ) 2.80 1.00 0.00
assign (resid    17 and  name HN   )(resid    17 and  name HG*  ) 5.00 3.20 0.00
assign (resid    17 and  name HN   )(resid    17 and  name HE*  ) 5.00 3.20 0.00
assign (resid    17 and  name HN   )(resid    17 and  name HB*  ) 5.00 3.20 0.00
assign (resid    17 and  name HA   )(resid    17 and  name HB*  ) 5.00 3.20 0.00
assign (resid    18 and  name HN   )(resid    18 and  name HA  ) 5.00 3.20 0.00
assign (resid    18 and  name HN   )(resid    18 and  name HB  ) 2.80 1.00 0.00
assign (resid    18 and  name HA   )(resid    18 and  name HB  ) 3.60 1.80 0.00
assign (resid    18 and  name HB   )(resid    18 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    18 and  name HA   )(resid    18 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    19 and  name HN   )(resid    19 and  name HA  ) 5.00 3.20 0.00
assign (resid    19 and  name HN   )(resid    19 and  name HB*  ) 5.00 3.20 0.00
assign (resid    19 and  name HN   )(resid    19 and  name HG*  ) 5.00 3.20 0.00
assign (resid    19 and  name HN   )(resid    19 and  name HD*  ) 5.00 3.20 0.00
assign (resid    19 and  name HA   )(resid    19 and  name HB*  ) 5.00 3.20 0.00
assign (resid    19 and  name HA   )(resid    19 and  name HG*  ) 3.60 1.80 0.00
assign (resid    19 and  name HA   )(resid    19 and  name HD*  ) 5.00 3.20 0.00
assign (resid    20 and  name HN   )(resid    20 and  name HA  ) 3.60 1.80 0.00
assign (resid    20 and  name HN   )(resid    20 and  name HB*  ) 2.80 1.00 0.00
assign (resid    20 and  name HA   )(resid    20 and  name HB*  ) 2.80 1.00 0.00
assign (resid    21 and  name HN   )(resid    21 and  name HA  ) 2.80 1.00 0.00
assign (resid    21 and  name HN   )(resid    21 and  name HB*  ) 3.60 1.80 0.00
assign (resid    21 and  name HN   )(resid    21 and  name HG1  ) 3.60 1.80 0.00
assign (resid    21 and  name HN   )(resid    21 and  name HG2  ) 2.80 1.00 0.00
assign (resid    21 and  name HN   )(resid    21 and  name HE2*  ) 5.00 3.20 0.00
assign (resid    21 and  name HA   )(resid    21 and  name HB*  ) 2.80 1.00 0.00
assign (resid    21 and  name HA   )(resid    21 and  name HG1  ) 3.60 1.80 0.00
assign (resid    21 and  name HA   )(resid    21 and  name HG2  ) 3.60 1.80 0.00
assign (resid    21 and  name HA   )(resid    21 and  name HE2*  ) 5.00 3.20 0.00
assign (resid    22 and  name HN   )(resid    22 and  name HA  ) 2.80 1.00 0.00
assign (resid    22 and  name HN   )(resid    22 and  name HB*  ) 2.80 1.00 0.00
assign (resid    22 and  name HA   )(resid    22 and  name HB*  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    23 and  name HA  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    23 and  name HB1  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    23 and  name HB2  ) 3.60 1.80 0.00
assign (resid    23 and  name HA   )(resid    23 and  name HB1  ) 5.00 3.20 0.00
assign (resid    23 and  name HA   )(resid    23 and  name HB2  ) 5.00 3.20 0.00
assign (resid    23 and  name HN   )(resid    23 and  name HG*  ) 5.00 3.20 0.00
assign (resid    23 and  name HA   )(resid    23 and  name HG*  ) 5.00 3.20 0.00
assign (resid    24 and  name HN   )(resid    24 and  name HA  ) 2.80 1.00 0.00
assign (resid    24 and  name HN   )(resid    24 and  name HB*  ) 3.60 1.80 0.00
assign (resid    24 and  name HN   )(resid    24 and  name HG*  ) 3.60 1.80 0.00
assign (resid    24 and  name HA   )(resid    24 and  name HB*  ) 2.80 1.00 0.00
assign (resid    24 and  name HA   )(resid    24 and  name HG*  ) 5.00 3.20 0.00
assign (resid    24 and  name HB*   )(resid    24 and  name HG*  ) 5.00 3.20 0.00
assign (resid    24 and  name HG*   )(resid    24 and  name HE*  ) 5.00 3.20 0.00
assign (resid    25 and  name HN   )(resid    25 and  name HA  ) 2.80 1.00 0.00
assign (resid    25 and  name HN   )(resid    25 and  name HB*  ) 3.60 1.80 0.00
assign (resid    25 and  name HN   )(resid    25 and  name HG  ) 2.80 1.00 0.00
assign (resid    25 and  name HN   )(resid    25 and  name HD**  ) 5.00 3.20 0.00
assign (resid    25 and  name HA   )(resid    25 and  name HB*  ) 5.00 3.20 0.00
assign (resid    25 and  name HA   )(resid    25 and  name HG  ) 5.00 3.20 0.00
assign (resid    25 and  name HA   )(resid    25 and  name HD**  ) 5.00 3.20 0.00
assign (resid    26 and  name HN   )(resid    26 and  name HA  ) 3.60 1.80 0.00
assign (resid    26 and  name HN   )(resid    26 and  name HB*  ) 5.00 3.20 0.00
assign (resid    26 and  name HB*   )(resid    26 and  name HD**  ) 5.00 3.20 0.00
assign (resid    27 and  name HN   )(resid    27 and  name HA  ) 5.00 3.20 0.00
assign (resid    27 and  name HN   )(resid    27 and  name HB*  ) 3.60 1.80 0.00
assign (resid    27 and  name HN   )(resid    27 and  name HD*  ) 5.00 3.20 0.00
assign (resid    27 and  name HA   )(resid    27 and  name HB*  ) 5.00 3.20 0.00
assign (resid    27 and  name HA   )(resid    27 and  name HD*  ) 5.00 3.20 0.00
assign (resid    28 and  name HN   )(resid    28 and  name HA  ) 5.00 3.20 0.00
assign (resid    28 and  name HN   )(resid    28 and  name HB*  ) 5.00 3.20 0.00
assign (resid    28 and  name HN   )(resid    28 and  name HG1  ) 5.00 3.20 0.00
assign (resid    28 and  name HN   )(resid    28 and  name HG2  ) 5.00 3.20 0.00
assign (resid    28 and  name HA   )(resid    28 and  name HB*  ) 5.00 3.20 0.00
assign (resid    28 and  name HA   )(resid    28 and  name HG*  ) 5.00 3.20 0.00
assign (resid    28 and  name HB*   )(resid    28 and  name HG*  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    29 and  name HA  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    29 and  name HB1  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    29 and  name HB2  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    29 and  name HG*  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    29 and  name HB1  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    29 and  name HB2  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    29 and  name HG*  ) 5.00 3.20 0.00
assign (resid    29 and  name HB1   )(resid    29 and  name HG*  ) 5.00 3.20 0.00
assign (resid    29 and  name HB2   )(resid    29 and  name HG*  ) 5.00 3.20 0.00
assign (resid    30 and  name HN   )(resid    30 and  name HA1  ) 2.80 1.00 0.00
assign (resid    30 and  name HN   )(resid    30 and  name HA2  ) 2.80 1.00 0.00
assign (resid    30 and  name HA1   )(resid    30 and  name HA2  ) 3.60 1.80 0.00
assign (resid    31 and  name HN   )(resid    31 and  name HA  ) 5.00 3.20 0.00
assign (resid    31 and  name HN   )(resid    31 and  name HB*  ) 3.60 1.80 0.00
assign (resid    31 and  name HN   )(resid    31 and  name HG*  ) 2.80 1.00 0.00
assign (resid    31 and  name HA   )(resid    31 and  name HB*  ) 3.60 1.80 0.00
assign (resid    31 and  name HA   )(resid    31 and  name HG*  ) 3.60 1.80 0.00
assign (resid    31 and  name HA   )(resid    31 and  name HD*  ) 3.60 1.80 0.00
assign (resid    32 and  name HN   )(resid    32 and  name HA  ) 3.60 1.80 0.00
assign (resid    32 and  name HN   )(resid    32 and  name HB*  ) 3.60 1.80 0.00
assign (resid    32 and  name HA   )(resid    32 and  name HB*  ) 3.60 1.80 0.00
assign (resid    33 and  name HN   )(resid    33 and  name HA1  ) 2.80 1.00 0.00
assign (resid    33 and  name HN   )(resid    33 and  name HA2  ) 2.80 1.00 0.00
assign (resid    33 and  name HA1   )(resid    33 and  name HA2  ) 3.60 1.80 0.00
assign (resid    34 and  name HN   )(resid    34 and  name HA1  ) 3.60 1.80 0.00
assign (resid    34 and  name HN   )(resid    34 and  name HA2  ) 3.60 1.80 0.00
assign (resid    34 and  name HA1   )(resid    34 and  name HA2  ) 5.00 3.20 0.00
assign (resid    35 and  name HN   )(resid    35 and  name HB*  ) 2.80 1.00 0.00
assign (resid    35 and  name HN   )(resid    35 and  name HD*  ) 5.00 3.20 0.00
assign (resid    35 and  name HA   )(resid    35 and  name HB1  ) 5.00 3.20 0.00
assign (resid    35 and  name HA   )(resid    35 and  name HB2  ) 5.00 3.20 0.00
assign (resid    36 and  name HN   )(resid    36 and  name HA  ) 5.00 3.20 0.00
assign (resid    36 and  name HN   )(resid    36 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    36 and  name HN   )(resid    36 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    36 and  name HA   )(resid    36 and  name HG11  ) 3.60 1.80 0.00
assign (resid    36 and  name HA   )(resid    36 and  name HG12  ) 3.60 1.80 0.00
assign (resid    36 and  name HA   )(resid    36 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    36 and  name HA   )(resid    36 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    37 and  name HN   )(resid    37 and  name HA  ) 5.00 3.20 0.00
assign (resid    37 and  name HN   )(resid    37 and  name HB  ) 5.00 3.20 0.00
assign (resid    37 and  name HN   )(resid    37 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    37 and  name HA   )(resid    37 and  name HB  ) 5.00 3.20 0.00
assign (resid    37 and  name HA   )(resid    37 and  name HG**  ) 5.00 3.20 0.00
assign (resid    37 and  name HB   )(resid    37 and  name HG**  ) 5.00 3.20 0.00
assign (resid    38 and  name HN   )(resid    38 and  name HB*  ) 3.60 1.80 0.00
assign (resid    38 and  name HA   )(resid    38 and  name HB*  ) 3.60 1.80 0.00
assign (resid    38 and  name HA   )(resid    38 and  name HG*  ) 5.00 3.20 0.00
assign (resid    39 and  name HN   )(resid    39 and  name HA  ) 5.00 3.20 0.00
assign (resid    39 and  name HN   )(resid    39 and  name HB1  ) 2.80 1.00 0.00
assign (resid    39 and  name HN   )(resid    39 and  name HB2  ) 2.80 1.00 0.00
assign (resid    39 and  name HA   )(resid    39 and  name HB1  ) 5.00 3.20 0.00
assign (resid    39 and  name HA   )(resid    39 and  name HB2  ) 5.00 3.20 0.00
assign (resid    40 and  name HN   )(resid    40 and  name HA  ) 5.00 3.20 0.00
assign (resid    40 and  name HN   )(resid    40 and  name HB*  ) 5.00 3.20 0.00
assign (resid    40 and  name HA   )(resid    40 and  name HB1  ) 3.60 1.80 0.00
assign (resid    40 and  name HA   )(resid    40 and  name HB2  ) 3.60 1.80 0.00
assign (resid    42 and  name HN   )(resid    42 and  name HA  ) 5.00 3.20 0.00
assign (resid    42 and  name HN   )(resid    42 and  name HB*  ) 3.60 1.80 0.00
assign (resid    42 and  name HN   )(resid    42 and  name HG*  ) 2.80 1.00 0.00
assign (resid    42 and  name HA   )(resid    42 and  name HB*   ) 3.60 1.80 0.00
assign (resid    42 and  name HA   )(resid    42 and  name HG*  ) 2.80 1.00 0.00
assign (resid    42 and  name HB*   )(resid    42 and  name HG*  ) 5.00 3.20 0.00
assign (resid    43 and  name HN   )(resid    43 and  name HA  ) 3.60 1.80 0.00
assign (resid    43 and  name HN   )(resid    43 and  name HB*  ) 3.60 1.80 0.00
assign (resid    43 and  name HA   )(resid    43 and  name HB*  ) 2.80 1.00 0.00
assign (resid    44 and  name HN   )(resid    44 and  name HA1  ) 3.60 1.80 0.00
assign (resid    44 and  name HN   )(resid    44 and  name HA2  ) 3.60 1.80 0.00
assign (resid    44 and  name HA1   )(resid    44 and  name HA2  ) 2.80 1.00 0.00
assign (resid    45 and  name HN   )(resid    45 and  name HA  ) 5.00 3.20 0.00
assign (resid    45 and  name HN   )(resid    45 and  name HB*  ) 3.60 1.80 0.00
assign (resid    45 and  name HN   )(resid    45 and  name HD*  ) 3.60 1.80 0.00
assign (resid    45 and  name HA   )(resid    45 and  name HB*  ) 3.60 1.80 0.00
assign (resid    45 and  name HA   )(resid    45 and  name HD*  ) 5.00 3.20 0.00
assign (resid    46 and  name HN   )(resid    46 and  name HB1  ) 5.00 3.20 0.00
assign (resid    46 and  name HN   )(resid    46 and  name HB2  ) 5.00 3.20 0.00
assign (resid    46 and  name HA   )(resid    46 and  name HB1  ) 5.00 3.20 0.00
assign (resid    46 and  name HA   )(resid    46 and  name HB2  ) 5.00 3.20 0.00
assign (resid    46 and  name HN   )(resid    46 and  name HD*  ) 5.00 3.20 0.00
assign (resid    46 and  name HA   )(resid    46 and  name HD*  ) 5.00 3.20 0.00
assign (resid    47 and  name HN   )(resid    47 and  name HA  ) 5.00 3.20 0.00
assign (resid    47 and  name HN   )(resid    47 and  name HB  ) 5.00 3.20 0.00
assign (resid    47 and  name HA   )(resid    47 and  name HB  ) 5.00 3.20 0.00
assign (resid    47 and  name HA   )(resid    47 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    47 and  name HB   )(resid    47 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    48 and  name HN   )(resid    48 and  name HB  ) 5.00 3.20 0.00
assign (resid    48 and  name HN   )(resid    48 and  name HG**  ) 5.00 3.20 0.00
assign (resid    48 and  name HA   )(resid    48 and  name HB  ) 5.00 3.20 0.00
assign (resid    48 and  name HA   )(resid    48 and  name HG**  ) 3.60 1.80 0.00
assign (resid    48 and  name HB   )(resid    48 and  name HG**  ) 5.00 3.20 0.00
assign (resid    49 and  name HN   )(resid    49 and  name HA  ) 5.00 3.20 0.00
assign (resid    49 and  name HN   )(resid    49 and  name HB*  ) 2.80 1.00 0.00
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assign (resid    113 and  name HA   )(resid    113 and  name HE*  ) 5.00 3.20 0.00
assign (resid    113 and  name HB1   )(resid    113 and  name HG*  ) 5.00 3.20 0.00
assign (resid    113 and  name HB2   )(resid    113 and  name HG*  ) 5.00 3.20 0.00
assign (resid    113 and  name HG*   )(resid    113 and  name HD1  ) 5.00 3.20 0.00
assign (resid    113 and  name HG*   )(resid    113 and  name HD2  ) 5.00 3.20 0.00 
assign (resid    114 and  name HN   )(resid    114 and  name HA  ) 5.00 3.20 0.00
assign (resid    114 and  name HN   )(resid    114 and  name HB1  ) 3.60 1.80 0.00
assign (resid    114 and  name HN   )(resid    114 and  name HB2  ) 5.00 3.20 0.00
assign (resid    114 and  name HA   )(resid    114 and  name HB1  ) 2.80 1.00 0.00
assign (resid    114 and  name HA   )(resid    114 and  name HB2  ) 2.80 1.00 0.00
assign (resid    115 and  name HN   )(resid    115 and  name HA  ) 5.00 3.20 0.00
assign (resid    115 and  name HN   )(resid    115 and  name HB*  ) 5.00 3.20 0.00



! Interresidue constraints (sequential)
assign (resid    1 and  name HA   )(resid    2 and  name HN  ) 5.00 3.20 0.00
assign (resid    1 and  name HA   )(resid    2 and  name HB*  ) 5.00 3.20 0.00
assign (resid    1 and  name HB   )(resid    2 and  name HN  ) 5.00 3.20 0.00
assign (resid    1 and  name HG2*   )(resid    2 and  name HN  ) 5.00 3.20 0.00
assign (resid    2 and  name HA   )(resid    3 and  name HN  ) 5.00 3.20 0.00
assign (resid    2 and  name HB1   )(resid    3 and  name HN  ) 5.00 3.20 0.00
assign (resid    2 and  name HB2   )(resid    3 and  name HN  ) 5.00 3.20 0.00
assign (resid    2 and  name HG*   )(resid    3 and  name HN  ) 5.00 3.20 0.00
assign (resid    3 and  name HN   )(resid    4 and  name HA  ) 5.00 3.20 0.00
assign (resid    3 and  name HB*   )(resid    4 and  name HN  ) 5.00 3.20 0.00
assign (resid    3 and  name HA   )(resid    4 and  name HG*  ) 3.60 1.80 0.00
assign (resid    3 and  name HA   )(resid    4 and  name HB*  ) 5.00 3.20 0.00
assign (resid    4 and  name HA   )(resid    5 and  name HN  ) 5.00 3.20 0.00
assign (resid    4 and  name HB1   )(resid    5 and  name HN  ) 5.00 3.20 0.00
assign (resid    4 and  name HB2   )(resid    5 and  name HN  ) 5.00 3.20 0.00
assign (resid    4 and  name HG*   )(resid    5 and  name HA  ) 5.00 3.20 0.00
assign (resid    5 and  name HN   )(resid    6 and  name HN  ) 5.00 3.20 0.00
assign (resid    5 and  name HB1   )(resid    6 and  name HN  ) 5.00 3.20 0.00
assign (resid    5 and  name HB2   )(resid    6 and  name HN  ) 5.00 3.20 0.00
assign (resid    6 and  name HA   )(resid    7 and  name HN  ) 2.80 1.00 0.00
assign (resid    7 and  name HN   )(resid    8 and  name HN  ) 3.60 1.80 0.00
assign (resid    7 and  name HN   )(resid    6 and  name HB*  ) 5.00 3.20 0.00
assign (resid    8 and  name HN   )(resid    7 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    8 and  name HN   )(resid    7 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    8 and  name HN   )(resid    9 and  name HG*  ) 5.00 3.20 0.00
assign (resid    8 and  name HA   )(resid    9 and  name HN  ) 5.00 3.20 0.00
assign (resid    9 and  name HN   )(resid    10 and  name HN  ) 5.00 3.20 0.00
assign (resid    9 and  name HE*   )(resid    10 and  name HN  ) 5.00 3.20 0.00
assign (resid    10 and  name HN   )(resid    11 and  name HN  ) 3.60 1.80 0.00
assign (resid    10 and  name HN   )(resid    9 and  name HA  ) 5.00 3.20 0.00
assign (resid    10 and  name HN   )(resid    9 and  name HB*  ) 5.00 3.20 0.00
assign (resid    11 and  name HN   )(resid    12 and  name HN  ) 5.00 3.20 0.00
assign (resid    11 and  name HN   )(resid    12 and  name HD1  ) 5.00 3.20 0.00
assign (resid    11 and  name HA   )(resid    12 and  name HN  ) 3.60 1.80 0.00
assign (resid    11 and  name HB*   )(resid    12 and  name HN  ) 5.00 3.20 0.00
assign (resid    11 and  name HG*   )(resid    12 and  name HN  ) 5.00 3.20 0.00
assign (resid    11 and  name HG*   )(resid    12 and  name HA  ) 5.00 3.20 0.00
assign (resid    12 and  name HN   )(resid    13 and  name HN  ) 2.80 1.00 0.00
assign (resid    13 and  name HA   )(resid    12 and  name HE3  ) 3.60 1.80 0.00
assign (resid    13 and  name HA   )(resid    12 and  name HZ3  ) 3.60 1.80 0.00
assign (resid    13 and  name HA   )(resid    14 and  name HN  ) 3.60 1.80 0.00
assign (resid    14 and  name HN   )(resid    15 and  name HN  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    13 and  name HB*  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    13 and  name HD*  ) 3.60 1.80 0.00
assign (resid    14 and  name HA   )(resid    15 and  name HN  ) 2.80 1.00 0.00
assign (resid    14 and  name HB*   )(resid    15 and  name HN  ) 3.60 1.80 0.00
assign (resid    15 and  name HN   )(resid    16 and  name HN  ) 5.00 3.20 0.00
assign (resid    15 and  name HA   )(resid    16 and  name HN  ) 2.80 1.00 0.00
assign (resid    15 and  name HB*   )(resid    16 and  name HN  ) 5.00 3.20 0.00
assign (resid    15 and  name HG*   )(resid    16 and  name HN  ) 5.00 3.20 0.00
assign (resid    15 and  name HD*   )(resid    16 and  name HN  ) 5.00 3.20 0.00
assign (resid    16 and  name HN   )(resid    17 and  name HN  ) 2.80 1.00 0.00
assign (resid    16 and  name HN   )(resid    15 and  name HZ*  ) 5.00 3.20 0.00
assign (resid    16 and  name HA   )(resid    17 and  name HN  ) 3.60 1.80 0.00
assign (resid    16 and  name HB*   )(resid    17 and  name HN  ) 5.00 3.20 0.00
assign (resid    17 and  name HN   )(resid    18 and  name HN  ) 5.00 3.20 0.00
assign (resid    18 and  name HN   )(resid    17 and  name HA  ) 2.80 1.00 0.00
assign (resid    18 and  name HN   )(resid    17 and  name HG*  ) 3.60 1.80 0.00
assign (resid    18 and  name HA   )(resid    19 and  name HN  ) 2.80 1.00 0.00
assign (resid    18 and  name HG2*   )(resid    19 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HN   )(resid    20 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HB*   )(resid    20 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HG*   )(resid    20 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HD*   )(resid    20 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HG*   )(resid    20 and  name HB1  ) 2.80 1.00 0.00
assign (resid    19 and  name HG*   )(resid    20 and  name HB2  ) 3.60 1.80 0.00
assign (resid    20 and  name HN   )(resid    21 and  name HN  ) 5.00 3.20 0.00
assign (resid    20 and  name HN   )(resid    21 and  name HG*  ) 5.00 3.20 0.00
assign (resid    20 and  name HB*   )(resid    21 and  name HN  ) 5.00 3.20 0.00
assign (resid    21 and  name HN   )(resid    22 and  name HN  ) 2.80 1.00 0.00
assign (resid    21 and  name HB*   )(resid    22 and  name HN  ) 5.00 3.20 0.00
assign (resid    21 and  name HB*   )(resid    22 and  name HA  ) 5.00 3.20 0.00
assign (resid    21 and  name HG*   )(resid    22 and  name HN  ) 5.00 3.20 0.00
assign (resid    22 and  name HN   )(resid    23 and  name HN  ) 5.00 3.20 0.00
assign (resid    22 and  name HA   )(resid    23 and  name HN  ) 3.60 1.80 0.00
assign (resid    22 and  name HB*   )(resid    23 and  name HN  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    24 and  name HN  ) 3.60 1.80 0.00
assign (resid    23 and  name HG*   )(resid    22 and  name HB*  ) 5.00 3.20 0.00
assign (resid    24 and  name HN   )(resid    25 and  name HN  ) 3.60 1.80 0.00
assign (resid    24 and  name HN   )(resid    23 and  name HB*  ) 2.80 1.00 0.00
assign (resid    24 and  name HB*   )(resid    25 and  name HN  ) 3.60 1.80 0.00
assign (resid    24 and  name HB*   )(resid    25 and  name HA  ) 5.00 3.20 0.00
assign (resid    24 and  name HG*   )(resid    25 and  name HN  ) 5.00 3.20 0.00
assign (resid    24 and  name HG*   )(resid    25 and  name HA  ) 5.00 3.20 0.00
assign (resid    25 and  name HN   )(resid    26 and  name HN  ) 3.60 1.80 0.00
assign (resid    26 and  name HN   )(resid    25 and  name HD**  ) 5.00 3.20 0.00
assign (resid    26 and  name HB*   )(resid    27 and  name HA  ) 5.00 3.20 0.00
assign (resid    27 and  name HN   )(resid    26 and  name HN  ) 5.00 3.20 0.00
assign (resid    27 and  name HN   )(resid    28 and  name HN  ) 5.00 3.20 0.00
assign (resid    27 and  name HB*   )(resid    28 and  name HN  ) 2.80 1.00 0.00
assign (resid    27 and  name HD*   )(resid    28 and  name HN  ) 5.00 3.20 0.00
assign (resid    28 and  name HG*   )(resid    29 and  name HA  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    28 and  name HN  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    30 and  name HN  ) 3.60 1.80 0.00
assign (resid    29 and  name HN   )(resid    30 and  name HA1  ) 5.00 3.20 0.00
assign (resid    29 and  name HN   )(resid    30 and  name HA2  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    30 and  name HN  ) 3.60 1.80 0.00
assign (resid    29 and  name HB*   )(resid    30 and  name HN  ) 3.60 1.80 0.00
assign (resid    30 and  name HN   )(resid    31 and  name HB*  ) 6.00 4.20 0.00
assign (resid    30 and  name HA1   )(resid    31 and  name HN  ) 5.00 3.20 0.00
assign (resid    30 and  name HA2   )(resid    31 and  name HN  ) 5.00 3.20 0.00
assign (resid    30 and  name HA*   )(resid    31 and  name HA  ) 5.00 3.20 0.00
assign (resid    31 and  name HN   )(resid    30 and  name HN  ) 5.00 3.20 0.00
assign (resid    31 and  name HA   )(resid    32 and  name HN  ) 2.80 1.00 0.00
assign (resid    31 and  name HA   )(resid    32 and  name HG*  ) 5.00 3.20 0.00
assign (resid    31 and  name HB*   )(resid    32 and  name HN  ) 5.00 3.20 0.00
assign (resid    31 and  name HG*   )(resid    32 and  name HN  ) 6.00 4.20 0.00
assign (resid    32 and  name HA   )(resid    33 and  name HN  ) 3.60 1.80 0.00
assign (resid    33 and  name HN   )(resid    34 and  name HN  ) 5.00 3.20 0.00
assign (resid    33 and  name HA1   )(resid    34 and  name HN  ) 5.00 3.20 0.00
assign (resid    34 and  name HA1   )(resid    35 and  name HN  ) 3.60 1.80 0.00
assign (resid    34 and  name HA2   )(resid    35 and  name HN  ) 3.60 1.80 0.00
assign (resid    36 and  name HN   )(resid    35 and  name HD*  ) 3.60 1.80 0.00
assign (resid    36 and  name HA   )(resid    37 and  name HN  ) 5.00 3.20 0.00
assign (resid    37 and  name HN   )(resid    36 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    37 and  name HN   )(resid    36 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    37 and  name HA   )(resid    38 and  name HN  ) 3.60 1.80 0.00
assign (resid    37 and  name HG1*   )(resid    38 and  name HN  ) 5.00 3.20 0.00
assign (resid    37 and  name HG1*   )(resid    38 and  name HA  ) 5.00 3.20 0.00
assign (resid    38 and  name HA   )(resid    39 and  name HN  ) 2.80 1.00 0.00
assign (resid    38 and  name HG*   )(resid    39 and  name HN  ) 5.00 3.20 0.00
assign (resid    39 and  name HB1   )(resid    40 and  name HN  ) 5.00 3.20 0.00
assign (resid    39 and  name HB2   )(resid    40 and  name HN  ) 5.00 3.20 0.00
assign (resid    40 and  name HN   )(resid    39 and  name HA  ) 5.00 3.20 0.00
assign (resid    42 and  name HN   )(resid    41 and  name HA  ) 5.00 3.20 0.00
assign (resid    42 and  name HN   )(resid    41 and  name HB*  ) 3.60 1.80 0.00
assign (resid    42 and  name HA   )(resid    43 and  name HN  ) 5.00 3.20 0.00
assign (resid    42 and  name HB*   )(resid    43 and  name HN  ) 5.00 3.20 0.00
assign (resid    42 and  name HG*   )(resid    43 and  name HN  ) 6.00 4.20 0.00
assign (resid    43 and  name HN   )(resid    44 and  name HN  ) 2.80 1.00 0.00
assign (resid    43 and  name HA   )(resid    44 and  name HN  ) 3.60 1.80 0.00
assign (resid    43 and  name HB*   )(resid    44 and  name HN  ) 3.60 1.80 0.00
assign (resid    44 and  name HN   )(resid    45 and  name HN  ) 2.80 1.00 0.00
assign (resid    44 and  name HN   )(resid    45 and  name HD*  ) 5.00 3.20 0.00
assign (resid    44 and  name HA1   )(resid    45 and  name HN  ) 5.00 3.20 0.00
assign (resid    44 and  name HA2   )(resid    45 and  name HN  ) 3.60 1.80 0.00
assign (resid    46 and  name HN   )(resid    45 and  name HA  ) 5.00 3.20 0.00
assign (resid    46 and  name HA   )(resid    47 and  name HN  ) 3.60 1.80 0.00
assign (resid    46 and  name HB1   )(resid    47 and  name HN  ) 5.00 3.20 0.00
assign (resid    46 and  name HB2   )(resid    47 and  name HN  ) 5.00 3.20 0.00
assign (resid    47 and  name HA   )(resid    48 and  name HN  ) 3.60 1.80 0.00
assign (resid    47 and  name HG2*   )(resid    48 and  name HN  ) 5.00 3.20 0.00
assign (resid    48 and  name HA   )(resid    49 and  name HN  ) 5.00 3.20 0.00
assign (resid    48 and  name HG1*   )(resid    49 and  name HN  ) 6.00 4.20 0.00
assign (resid    49 and  name HA   )(resid    50 and  name HN  ) 3.60 1.80 0.00
assign (resid    49 and  name HB*   )(resid    50 and  name HN  ) 5.00 3.20 0.00
assign (resid    49 and  name HA   )(resid    50 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    50 and  name HA   )(resid    51 and  name HN  ) 5.00 3.20 0.00
assign (resid    51 and  name HA   )(resid    52 and  name HN  ) 2.80 1.00 0.00
assign (resid    52 and  name HN   )(resid    51 and  name HD*  ) 3.60 1.80 0.00
assign (resid    52 and  name HA   )(resid    53 and  name HN  ) 2.80 1.00 0.00
assign (resid    52 and  name HB*   )(resid    53 and  name HN  ) 5.00 3.20 0.00
assign (resid    55 and  name HN   )(resid    54 and  name HA  ) 2.80 1.00 0.00
assign (resid    56 and  name HN   )(resid    57 and  name HN  ) 5.00 3.20 0.00
assign (resid    56 and  name HA*   )(resid    57 and  name HN  ) 3.60 1.80 0.00
assign (resid    56 and  name HA1   )(resid    57 and  name HA  ) 5.00 3.20 0.00
assign (resid    56 and  name HA2   )(resid    57 and  name HA  ) 5.00 3.20 0.00
assign (resid    57 and  name HN   )(resid    58 and  name HD*  ) 5.00 3.20 0.00
assign (resid    57 and  name HA   )(resid    58 and  name HG*  ) 5.00 3.20 0.00
assign (resid    57 and  name HA   )(resid    58 and  name HD*  ) 2.80 1.00 0.00
assign (resid    57 and  name HB1   )(resid    58 and  name HD1  ) 5.00 3.20 0.00
assign (resid    57 and  name HB1   )(resid    58 and  name HD2  ) 5.00 3.20 0.00
assign (resid    57 and  name HB2   )(resid    58 and  name HD1  ) 5.00 3.20 0.00
assign (resid    57 and  name HB2   )(resid    58 and  name HD2  ) 5.00 3.20 0.00
assign (resid    59 and  name HN   )(resid    60 and  name HN  ) 2.80 1.00 0.00
assign (resid    59 and  name HN   )(resid    58 and  name HB*  ) 3.60 1.80 0.00
assign (resid    59 and  name HA   )(resid    60 and  name HN  ) 3.60 1.80 0.00
assign (resid    59 and  name HG*   )(resid    60 and  name HN  ) 5.00 3.20 0.00
assign (resid    59 and  name HG*   )(resid    60 and  name HA*  ) 5.00 3.20 0.00
assign (resid    59 and  name HG*   )(resid    58 and  name HB*  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    61 and  name HG**  ) 5.00 3.20 0.00
assign (resid    60 and  name HA1   )(resid    61 and  name HN  ) 3.60 1.80 0.00
assign (resid    60 and  name HA2   )(resid    61 and  name HN  ) 2.80 1.00 0.00
assign (resid    61 and  name HA   )(resid    62 and  name HN  ) 2.80 1.00 0.00
assign (resid    61 and  name HA   )(resid    62 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    61 and  name HA   )(resid    62 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    61 and  name HB   )(resid    62 and  name HN  ) 5.00 3.20 0.00
assign (resid    61 and  name HG**   )(resid    62 and  name HN  ) 3.60 1.80 0.00
assign (resid    64 and  name HA   )(resid    65 and  name HN  ) 5.00 3.20 0.00
assign (resid    64 and  name HB*   )(resid    65 and  name HN  ) 5.00 3.20 0.00
assign (resid    65 and  name HB*   )(resid    66 and  name HN  ) 3.60 1.80 0.00
assign (resid    66 and  name HN   )(resid    65 and  name HD*  ) 5.00 3.20 0.00
assign (resid    66 and  name HA   )(resid    67 and  name HN  ) 3.60 1.80 0.00
assign (resid    66 and  name HG**   )(resid    67 and  name HN  ) 5.00 3.20 0.00
assign (resid    67 and  name HA   )(resid    68 and  name HN  ) 3.60 1.80 0.00
assign (resid    67 and  name HG1*   )(resid    68 and  name HN  ) 3.60 1.80 0.00
assign (resid    67 and  name HG1*   )(resid    68 and  name HA  ) 5.00 3.20 0.00
assign (resid    67 and  name HG2*   )(resid    68 and  name HN  ) 5.00 3.20 0.00
assign (resid    68 and  name HA   )(resid    69 and  name HN  ) 2.80 1.00 0.00
assign (resid    68 and  name HB*   )(resid    69 and  name HN  ) 5.00 3.20 0.00
assign (resid    69 and  name HA   )(resid    70 and  name HN  ) 2.80 1.00 0.00
assign (resid    69 and  name HB*   )(resid    70 and  name HN  ) 3.60 1.80 0.00
assign (resid    70 and  name HA   )(resid    71 and  name HD*  ) 5.00 3.20 0.00
assign (resid    70 and  name HB   )(resid    71 and  name HD*  ) 5.00 3.20 0.00
assign (resid    72 and  name HN   )(resid    71 and  name HD*  ) 3.60 1.80 0.00
assign (resid    72 and  name HN   )(resid    73 and  name HN  ) 2.80 1.00 0.00
assign (resid    72 and  name HN   )(resid    71 and  name HB*  ) 5.00 3.20 0.00
assign (resid    72 and  name HA   )(resid    73 and  name HN  ) 3.60 1.80 0.00
assign (resid    72 and  name HB*   )(resid    73 and  name HN  ) 5.00 3.20 0.00
assign (resid    73 and  name HN   )(resid    74 and  name HN  ) 2.80 1.00 0.00
assign (resid    73 and  name HA   )(resid    74 and  name HN  ) 3.60 1.80 0.00
assign (resid    74 and  name HA   )(resid    75 and  name HN  ) 2.80 1.00 0.00
assign (resid    74 and  name HB*   )(resid    75 and  name HN  ) 3.60 1.80 0.00
assign (resid    74 and  name HN   )(resid    75 and  name HN  ) 5.00 3.20 0.00
assign (resid    75 and  name HA   )(resid    76 and  name HN  ) 2.80 1.00 0.00
assign (resid    75 and  name HB1   )(resid    76 and  name HN  ) 3.60 1.80 0.00
assign (resid    75 and  name HB2   )(resid    76 and  name HN  ) 3.60 1.80 0.00
assign (resid    76 and  name HA   )(resid    77 and  name HB*  ) 5.00 3.20 0.00
assign (resid    78 and  name HN   )(resid    77 and  name HB*  ) 3.60 1.80 0.00
assign (resid    78 and  name HA   )(resid    79 and  name HN  ) 2.80 1.00 0.00
assign (resid    78 and  name HA   )(resid    79 and  name HG*  ) 5.00 3.20 0.00
assign (resid    79 and  name HN   )(resid    80 and  name HN  ) 2.80 1.00 0.00
assign (resid    79 and  name HA   )(resid    80 and  name HN  ) 3.60 1.80 0.00
assign (resid    79 and  name HB*   )(resid    80 and  name HN  ) 3.60 1.80 0.00
assign (resid    80 and  name HA   )(resid    81 and  name HN  ) 3.60 1.80 0.00
assign (resid    80 and  name HB*   )(resid    81 and  name HN  ) 2.80 1.00 0.00
assign (resid    81 and  name HN   )(resid    82 and  name HD**  ) 6.00 4.20 0.00
assign (resid    81 and  name HB*   )(resid    82 and  name HN  ) 3.60 1.80 0.00
assign (resid    82 and  name HN   )(resid    83 and  name HN  ) 5.00 3.20 0.00
assign (resid    82 and  name HA   )(resid    83 and  name HN  ) 5.00 3.20 0.00
assign (resid    82 and  name HG   )(resid    83 and  name HN  ) 5.00 3.20 0.00
assign (resid    82 and  name HG   )(resid    83 and  name HA  ) 5.00 3.20 0.00
assign (resid    83 and  name HN   )(resid    82 and  name HB*  ) 5.00 3.20 0.00
assign (resid    83 and  name HB1   )(resid    84 and  name HN  ) 3.60 1.80 0.00
assign (resid    83 and  name HB2   )(resid    84 and  name HN  ) 3.60 1.80 0.00
assign (resid    84 and  name HN   )(resid    83 and  name HD*  ) 6.00 4.20 0.00
assign (resid    84 and  name HN   )(resid    85 and  name HN  ) 5.00 3.20 0.00
assign (resid    84 and  name HN   )(resid    85 and  name HB  ) 6.00 4.20 0.00
assign (resid    85 and  name HN   )(resid    86 and  name HN  ) 5.00 3.20 0.00
assign (resid    85 and  name HA   )(resid    86 and  name HN  ) 2.80 1.00 0.00
assign (resid    85 and  name HA   )(resid    86 and  name HA  ) 6.00 4.20 0.00
assign (resid    85 and  name HB   )(resid    86 and  name HN  ) 5.00 3.20 0.00
assign (resid    86 and  name HN   )(resid    85 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    87 and  name HA   )(resid    88 and  name HN  ) 5.00 3.20 0.00
assign (resid    88 and  name HG*   )(resid    89 and  name HA  ) 5.00 3.20 0.00
assign (resid    88 and  name HN   )(resid    87 and  name HG*  ) 5.00 3.20 0.00
assign (resid    89 and  name HN   )(resid    90 and  name HN  ) 5.00 3.20 0.00
assign (resid    90 and  name HN   )(resid    91 and  name HN  ) 5.00 3.20 0.00
assign (resid    90 and  name HN   )(resid    89 and  name HB*  ) 3.60 1.80 0.00
assign (resid    91 and  name HN   )(resid    90 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    91 and  name HN   )(resid    90 and  name HB  ) 2.80 1.00 0.00
assign (resid    92 and  name HN   )(resid    91 and  name HB1  ) 3.60 1.80 0.00
assign (resid    92 and  name HN   )(resid    91 and  name HB2  ) 3.60 1.80 0.00
assign (resid    92 and  name HA   )(resid    91 and  name HB*  ) 5.00 3.20 0.00
assign (resid    95 and  name HN   )(resid    94 and  name HB*  ) 5.00 3.20 0.00
assign (resid    95 and  name HN   )(resid    96 and  name HN  ) 5.00 3.20 0.00
assign (resid    95 and  name HN   )(resid    96 and  name HB*  ) 5.00 3.20 0.00
assign (resid    98 and  name HN   )(resid    97 and  name HB*  ) 5.00 3.20 0.00
assign (resid    105 and  name HN   )(resid    106 and  name HN  ) 3.60 1.80 0.00
assign (resid    105 and  name HG*   )(resid    106 and  name HN  ) 5.00 3.20 0.00
assign (resid    105 and  name HD*   )(resid    106 and  name HN  ) 5.00 3.20 0.00
assign (resid    106 and  name HA   )(resid    107 and  name HD*  ) 5.00 3.20 0.00
assign (resid    107 and  name HA   )(resid    108 and  name HN  ) 2.80 1.00 0.00
assign (resid    108 and  name HA   )(resid    109 and  name HN  ) 3.60 1.80 0.00
assign (resid    108 and  name HB   )(resid    109 and  name HN  ) 5.00 3.20 0.00
assign (resid    109 and  name HN   )(resid    110 and  name HG*  ) 5.00 3.20 0.00
assign (resid    109 and  name HA   )(resid    110 and  name HN  ) 5.00 3.20 0.00
assign (resid    109 and  name HB*   )(resid    110 and  name HN  ) 5.00 3.20 0.00
assign (resid    109 and  name HB1   )(resid    110 and  name HB*  ) 5.00 3.20 0.00
assign (resid    109 and  name HB2   )(resid    110 and  name HB*  ) 5.00 3.20 0.00
assign (resid    110 and  name HB*   )(resid    111 and  name HN  ) 5.00 3.20 0.00
assign (resid    111 and  name HN   )(resid    110 and  name HG*  ) 5.00 3.20 0.00
assign (resid    111 and  name HA   )(resid    112 and  name HN  ) 5.00 3.20 0.00
assign (resid    111 and  name HA   )(resid    112 and  name HB*  ) 5.00 3.20 0.00
assign (resid    111 and  name HB1   )(resid    112 and  name HN  ) 5.00 3.20 0.00
assign (resid    111 and  name HB2   )(resid    112 and  name HN  ) 5.00 3.20 0.00
assign (resid    111 and  name HG*   )(resid    112 and  name HN  ) 5.00 3.20 0.00
assign (resid    111 and  name HG*   )(resid    110 and  name HD*  ) 5.00 3.20 0.00
assign (resid    112 and  name HN   )(resid    113 and  name HA  ) 5.00 3.20 0.00
assign (resid    113 and  name HA   )(resid    114 and  name HN  ) 2.80 1.00 0.00
assign (resid    113 and  name HA   )(resid    114 and  name HB*  ) 5.00 3.20 0.00
assign (resid    113 and  name HB*   )(resid    114 and  name HN  ) 5.00 3.20 0.00
assign (resid    114 and  name HN   )(resid    115 and  name HB*  ) 5.00 3.20 0.00
assign (resid    114 and  name HB1   )(resid    115 and  name HN  ) 3.60 1.80 0.00
assign (resid    114 and  name HB2   )(resid    115 and  name HN  ) 3.60 1.80 0.00


! Interresidue constraints (2-4)
assign (resid    10 and  name HN   )(resid    13 and  name HB*  ) 5.00 3.20 0.00
assign (resid    14 and  name HB*   )(resid    17 and  name HB*  ) 3.60 1.80 0.00
assign (resid    14 and  name HB*   )(resid    17 and  name HN  ) 3.60 1.80 0.00
assign (resid    15 and  name HN   )(resid    13 and  name HE*  ) 6.00 4.20 0.00
assign (resid    15 and  name HN   )(resid    13 and  name HD*  ) 6.00 4.20 0.00
! secondary helix A
!!backbone 
assign (resid    18 and  name HN   )(resid    22 and  name HN  ) 5.00 3.20 0.00
assign (resid    19 and  name HA   )(resid    22 and  name HN  ) 5.00 3.20 0.00
assign (resid    20 and  name HA   )(resid    23 and  name HN  ) 3.60 1.80 0.00
assign (resid    21 and  name HA   )(resid    24 and  name HN  ) 3.60 1.80 0.00
assign (resid    21 and  name HA   )(resid    25 and  name HN  ) 3.60 1.80 0.00
assign (resid    22 and  name HA   )(resid    25 and  name HN  ) 3.60 1.80 0.00
assign (resid    23 and  name HA   )(resid    26 and  name HN  ) 3.60 1.80 0.00
assign (resid    23 and  name HA   )(resid    27 and  name HN  ) 3.60 1.80 0.00
assign (resid    24 and  name HA   )(resid    27 and  name HN  ) 3.60 1.80 0.00
assign (resid    24 and  name HA   )(resid    28 and  name HN  ) 3.60 1.80 0.00
assign (resid    25 and  name HA   )(resid    28 and  name HN  ) 3.60 1.80 0.00
assign (resid    25 and  name HA   )(resid    29 and  name HN  ) 3.60 1.80 0.00
assign (resid    26 and  name HA   )(resid    29 and  name HN  ) 3.60 1.80 0.00
assign (resid    27 and  name HA   )(resid    30 and  name HA*  ) 5.00 3.20 0.00
assign (resid    27 and  name HA   )(resid    30 and  name HN  ) 5.00 3.20 0.00
!!side-chain
assign (resid    18 and  name HN   )(resid    21 and  name HG*  ) 5.00 3.20 0.00
assign (resid    18 and  name HG2*   )(resid    21 and  name HN  ) 3.60 1.80 0.00
assign (resid    19 and  name HA   )(resid    22 and  name HB*  ) 5.00 3.20 0.00
assign (resid    20 and  name HN   )(resid    18 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    21 and  name HA   )(resid    24 and  name HE2*  ) 5.00 3.20 0.00
assign (resid    22 and  name HA   )(resid    25 and  name HG  ) 1.80 0.00 1.00
assign (resid    22 and  name HA   )(resid    25 and  name HD**  ) 1.80 0.00 1.00
assign (resid    22 and  name HB*   )(resid    25 and  name HD**  ) 6.00 4.20 0.00
assign (resid    22 and  name HB*   )(resid    26 and  name HD**  ) 6.00 4.20 0.00
assign (resid    23 and  name HN   )(resid    26 and  name HD**  ) 6.00 4.20 0.00
assign (resid    26 and  name HA   )(resid    29 and  name HB*  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    31 and  name HD*  ) 5.00 3.20 0.00
assign (resid    29 and  name HA   )(resid    31 and  name HG*  ) 5.00 3.20 0.00
assign (resid    31 and  name HN   )(resid    29 and  name HB*  ) 6.00 4.20 0.00
assign (resid    31 and  name HN   )(resid    29 and  name HG*  ) 6.00 4.20 0.00
! loop AB
assign (resid    34 and  name HN   )(resid    31 and  name HB*  ) 3.60 1.80 0.00
! loop BC
assign (resid    42 and  name HN   )(resid    45 and  name HE*  ) 5.00 3.20 0.00
assign (resid    43 and  name HN   )(resid    41 and  name HN  ) 3.60 1.80 0.00
assign (resid    43 and  name HN   )(resid    45 and  name HE*  ) 5.00 3.20 0.00
assign (resid    44 and  name HN   )(resid    40 and  name HB*  ) 3.60 1.80 0.00
assign (resid    45 and  name HN   )(resid    43 and  name HB*  ) 5.00 3.20 0.00
assign (resid    45 and  name HA   )(resid    43 and  name HB*  ) 5.00 3.20 0.00
!loop CD
assign (resid    53 and  name HN   )(resid    51 and  name HE*  ) 5.00 3.20 0.00
assign (resid    55 and  name HN   )(resid    57 and  name HB*  ) 5.00 3.20 0.00
assign (resid    55 and  name HN   )(resid    58 and  name HG*  ) 5.00 3.20 0.00
assign (resid    57 and  name HN   )(resid    55 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    57 and  name HN   )(resid    61 and  name HG**  ) 3.60 1.80 0.00
assign (resid    57 and  name HB*   )(resid    60 and  name HN  ) 3.60 1.80 0.00
assign (resid    57 and  name HB1   )(resid    61 and  name HB  ) 5.00 3.20 0.00
assign (resid    57 and  name HB1   )(resid    61 and  name HG**  ) 3.60 1.80 0.00
assign (resid    57 and  name HB2   )(resid    61 and  name HB  ) 5.00 3.20 0.00
assign (resid    57 and  name HB2   )(resid    61 and  name HG**  ) 3.60 1.80 0.00
assign (resid    59 and  name HN   )(resid    57 and  name HA  ) 3.60 1.80 0.00
assign (resid    59 and  name HN   )(resid    61 and  name HG2*  ) 6.00 4.20 0.00
assign (resid    60 and  name HN   )(resid    57 and  name HA  ) 5.00 3.20 0.00
! loop DE
assign (resid    70 and  name HN   )(resid    74 and  name HB*  ) 5.00 3.20 0.00
assign (resid    71 and  name HA   )(resid    74 and  name HG*  ) 6.00 4.20 0.00
assign (resid    72 and  name HN   )(resid    70 and  name HG2*  ) 2.80 1.00 0.00
assign (resid    72 and  name HN   )(resid    74 and  name HN  ) 5.00 3.20 0.00
assign (resid    72 and  name HN   )(resid    74 and  name HB*  ) 5.00 3.20 0.00
assign (resid    72 and  name HB*   )(resid    74 and  name HB*  ) 5.00 3.20 0.00
assign (resid    72 and  name HG*   )(resid    74 and  name HB*  ) 5.00 3.20 0.00
assign (resid    74 and  name HN   )(resid    70 and  name HN  ) 3.60 1.80 0.00
assign (resid    74 and  name HN   )(resid    70 and  name HG2*  ) 5.00 3.20 0.00
! loop EF
assign (resid    78 and  name HN   )(resid    76 and  name HD*  ) 5.00 3.20 0.00
assign (resid    78 and  name HA   )(resid    80 and  name HN  ) 5.00 3.20 0.00
assign (resid    79 and  name HA   )(resid    76 and  name HB*  ) 3.60 1.80 0.00
assign (resid    79 and  name HA   )(resid    76 and  name HD*  ) 5.00 3.20 0.00
assign (resid    79 and  name HA   )(resid    76 and  name HE*  ) 5.00 3.20 0.00
assign (resid    79 and  name HA   )(resid    82 and  name HD**  ) 6.00 4.20 0.00
assign (resid    79 and  name HG*   )(resid    76 and  name HE*  ) 5.00 3.20 0.00
assign (resid    79 and  name HG*   )(resid    82 and  name HD**  ) 6.00 4.20 0.00
assign (resid    80 and  name HN   )(resid    76 and  name HE*  ) 6.00 4.20 0.00
assign (resid    80 and  name HN   )(resid    76 and  name HD*  ) 6.00 4.20 0.00
! loop FB
assign (resid    84 and  name HN   )(resid    88 and  name HB*  ) 5.00 3.20 0.00
assign (resid    84 and  name HN   )(resid    88 and  name HG*  ) 3.60 1.80 0.00
assign (resid    85 and  name HN   )(resid    83 and  name HB1  ) 5.00 3.20 0.00
assign (resid    85 and  name HN   )(resid    83 and  name HB2  ) 5.00 3.20 0.00
assign (resid    85 and  name HG2*   )(resid    88 and  name HN  ) 5.00 3.20 0.00
assign (resid    88 and  name HN   )(resid    86 and  name HN  ) 5.00 3.20 0.00
! secondary helix B
assign (resid    88 and  name HN   )(resid    90 and  name HN  ) 5.00 3.20 0.00
assign (resid    88 and  name HA   )(resid    92 and  name HN  ) 5.00 3.20 0.00
assign (resid    89 and  name HN   )(resid    86 and  name HA  ) 5.00 3.20 0.00
assign (resid    89 and  name HA   )(resid    92 and  name HN  ) 5.00 3.20 0.00
assign (resid    89 and  name HA   )(resid    92 and  name HB*  ) 5.00 3.20 0.00
assign (resid    89 and  name HA   )(resid    92 and  name HD*  ) 3.60 1.80 0.00
assign (resid    89 and  name HA   )(resid    92 and  name HE*  ) 5.00 3.20 0.00
assign (resid    91 and  name HN   )(resid    87 and  name HA  ) 5.00 3.20 0.00
assign (resid    91 and  name HB1   )(resid    88 and  name HA  ) 3.60 1.80 0.00
assign (resid    91 and  name HB2   )(resid    88 and  name HA  ) 3.60 1.80 0.00
! C-terminal
assign (resid    108 and  name HN   )(resid    106 and  name HE*  ) 6.00 4.20 0.00
assign (resid    111 and  name HA   )(resid    113 and  name HE*  ) 5.00 3.20 0.00
assign (resid    114 and  name HA   )(resid    110 and  name HD1  ) 5.00 3.20 0.00
assign (resid    114 and  name HA   )(resid    110 and  name HD2  ) 5.00 3.20 0.00




! Interresidue constraints (>4)

! helixA-betaB
assign (resid    19 and  name HN   )(resid    38 and  name HG*  ) 6.00 4.20 0.00
assign (resid    22 and  name HB*   )(resid    36 and  name HB  ) 5.00 3.20 0.00
assign (resid    22 and  name HB*   )(resid    36 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    34 and  name HN   )(resid    26 and  name HD**  ) 1.80 0.00 5.20
assign (resid    35 and  name HN   )(resid    26 and  name HD**  ) 7.00 5.20 0.00

! helixA-betaC
assign (resid    22 and  name HB*   )(resid    49 and  name HB*  ) 2.80 1.00 0.00
assign (resid    51 and  name HN   )(resid    26 and  name HD**  ) 2.80 1.00 0.00

! helixA-betaD1
assign (resid    19 and  name HA   )(resid    64 and  name HB*  ) 5.00 3.20 0.00
assign (resid    22 and  name HB*   )(resid    64 and  name HD1  ) 6.00 4.20 0.00
assign (resid    23 and  name HN   )(resid    62 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    23 and  name HN   )(resid    62 and  name HB  ) 6.00 4.20 0.00
assign (resid    23 and  name HA   )(resid    62 and  name HB  ) 5.00 3.20 0.00
assign (resid    23 and  name HA   )(resid    62 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    64 and  name HE1  ) 3.60 1.80 0.00
assign (resid    23 and  name HN   )(resid    64 and  name HD1  ) 5.00 3.20 0.00
assign (resid    27 and  name HN   )(resid    62 and  name HG1*  ) 5.00 3.20 0.00

! helixA-loopAB

! helixA-loopCD
assign (resid    27 and  name HE*   )(resid    60 and  name HN  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    27 and  name HZ*  ) 5.00 3.20 0.00

! betaB-betaC
assign (resid    34 and  name HN   )(resid    51 and  name HN  ) 2.80 1.00 0.00
assign (resid    34 and  name HN   )(resid    51 and  name HD*  ) 5.00 3.20 0.00
assign (resid    35 and  name HB*   )(resid    50 and  name HA  ) 5.00 3.20 0.00
assign (resid    35 and  name HB*   )(resid    50 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    36 and  name HN   )(resid    49 and  name HN  ) 3.60 1.80 0.00
assign (resid    36 and  name HN   )(resid    49 and  name HB*  ) 3.60 1.80 0.00
assign (resid    36 and  name HN   )(resid    48 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    36 and  name HN   )(resid    50 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    37 and  name HA   )(resid    48 and  name HA  ) 2.80 1.00 0.00
assign (resid    37 and  name HA   )(resid    48 and  name HG2*  ) 6.00 4.20 0.00
assign (resid    37 and  name HG**   )(resid    48 and  name HA  ) 3.60 1.80 0.00
assign (resid    37 and  name HG1*   )(resid    47 and  name HN  ) 3.60 1.80 0.00
assign (resid    38 and  name HG*   )(resid    47 and  name HB  ) 3.60 1.80 0.00
assign (resid    38 and  name HG*   )(resid    47 and  name HN  ) 5.00 3.20 0.00
assign (resid    39 and  name HA   )(resid    46 and  name HA  ) 3.60 1.80 0.00
assign (resid    49 and  name HN   )(resid    36 and  name HG2*  ) 6.00 4.20 0.00
assign (resid    50 and  name HA   )(resid    35 and  name HD*  ) 5.00 3.20 0.00
assign (resid    50 and  name HA   )(resid    36 and  name HN  ) 3.60 1.80 0.00
assign (resid    50 and  name HA   )(resid    36 and  name HD1*  ) 6.00 4.20 0.00
assign (resid    51 and  name HN   )(resid    35 and  name HB*  ) 6.00 4.20 0.00

! betaB-loopAB

! betaB-loopBC

! betaB-betaD1

! betaC-betaD1
assign (resid    46 and  name HN   )(resid    66 and  name HG1*  ) 5.00 3.20 0.00
assign (resid    47 and  name HA   )(resid    66 and  name HA  ) 2.80 1.00 0.00
assign (resid    47 and  name HA   )(resid    66 and  name HB  ) 5.00 3.20 0.00
assign (resid    47 and  name HA   )(resid    66 and  name HG2*  ) 3.60 1.80 0.00
assign (resid    47 and  name HA   )(resid    67 and  name HN  ) 3.60 1.80 0.00
assign (resid    47 and  name HA   )(resid    67 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    47 and  name HG2*   )(resid    64 and  name HA  ) 5.00 3.20 0.00
assign (resid    47 and  name HG2*   )(resid    64 and  name HB*  ) 2.80 1.00 0.00
assign (resid    47 and  name HG2*   )(resid    65 and  name HN  ) 5.00 3.20 0.00
assign (resid    48 and  name HN   )(resid    66 and  name HA  ) 2.80 1.00 0.00
assign (resid    48 and  name HN   )(resid    64 and  name HB*  ) 5.00 3.20 0.00
assign (resid    48 and  name HN   )(resid    65 and  name HB*  ) 3.60 1.80 0.00
assign (resid    48 and  name HG1*   )(resid    65 and  name HN  ) 5.00 3.20 0.00
assign (resid    49 and  name HA   )(resid    64 and  name HA  ) 2.80 1.00 0.00
assign (resid    49 and  name HA   )(resid    64 and  name HB*  ) 5.00 3.20 0.00
assign (resid    49 and  name HB*   )(resid    64 and  name HA  ) 5.00 3.20 0.00
assign (resid    50 and  name HN   )(resid    63 and  name HN  ) 3.60 1.80 0.00
assign (resid    50 and  name HN   )(resid    64 and  name HD1  ) 5.00 3.20 0.00
assign (resid    50 and  name HN   )(resid    65 and  name HD*  ) 5.00 3.20 0.00
assign (resid    50 and  name HN   )(resid    62 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    51 and  name HA   )(resid    62 and  name HA  ) 1.80 0.00 1.00
assign (resid    65 and  name HN   )(resid    49 and  name HA  ) 3.60 1.80 0.00

! betaC-loopAB
assign (resid    31 and  name HN   )(resid    51 and  name HE*  ) 5.00 3.20 0.00
assign (resid    31 and  name HN   )(resid    51 and  name HZ  ) 5.00 3.20 0.00
assign (resid    32 and  name HA   )(resid    51 and  name HE*  ) 5.00 3.20 0.00

! betaC-loopBC
assign (resid    40 and  name HN   )(resid    46 and  name HA  ) 3.60 1.80 0.00
assign (resid    40 and  name HN   )(resid    46 and  name HE*  ) 6.00 4.20 0.00

! betaC-loopCD
assign (resid    61 and  name HN   )(resid    51 and  name HD*  ) 6.00 4.20 0.00
assign (resid    61 and  name HN   )(resid    51 and  name HE*  ) 6.00 4.20 0.00

! betaC-helixB
assign (resid    46 and  name HN   )(resid    86 and  name HD1*  ) 2.80 1.00 0.00
assign (resid    86 and  name HN   )(resid    46 and  name HD*  ) 5.00 3.20 0.00
assign (resid    86 and  name HN   )(resid    46 and  name HE*  ) 5.00 3.20 0.00

! betaD1-betaE
assign (resid    76 and  name HN   )(resid    67 and  name HG1*  ) 3.60 1.80 0.00
assign (resid    76 and  name HN   )(resid    67 and  name HG2*  ) 6.00 4.20 0.00

! betaD1-loopAB

! betaD1-loopBC

! betaD1-loopCD
assign (resid    52 and  name HN   )(resid    62 and  name HA  ) 3.60 1.80 0.00

! betaD1-loopEF
assign (resid    65 and  name HA   )(resid    77 and  name HD**  ) 3.60 1.80 0.00
assign (resid    77 and  name HA   )(resid    66 and  name HB  ) 5.00 3.20 0.00

! betaD2-loopBC
assign (resid    68 and  name HA   )(resid    43 and  name HB*  ) 5.00 3.20 0.00

! betaD2-betaE
assign (resid    68 and  name HN   )(resid    76 and  name HD*  ) 5.00 3.20 0.00
assign (resid    69 and  name HA   )(resid    75 and  name HA  ) 2.80 1.00 0.00
assign (resid    69 and  name HB*   )(resid    75 and  name HA  ) 5.00 3.20 0.00
assign (resid    69 and  name HN   )(resid    76 and  name HD*  ) 6.00 4.20 0.00
assign (resid    69 and  name HN   )(resid    76 and  name HE*  ) 6.00 4.20 0.00
assign (resid    76 and  name HN   )(resid    68 and  name HN  ) 2.80 1.00 0.00
assign (resid    76 and  name HN   )(resid    69 and  name HB*  ) 6.00 4.20 0.00

! betaD2-loopBC
assign (resid    69 and  name HN   )(resid    45 and  name HZ*  ) 5.00 3.20 0.00
assign (resid    69 and  name HN   )(resid    43 and  name HB*  ) 3.60 1.80 0.00

! betaD2-loopEF
assign (resid    77 and  name HA   )(resid    68 and  name HB*  ) 3.60 1.80 0.00

! betaE-betaF
assign (resid    75 and  name HN   )(resid    82 and  name HG  ) 3.60 1.80 0.00
assign (resid    75 and  name HN   )(resid    84 and  name HA  ) 3.60 1.80 0.00
assign (resid    82 and  name HA   )(resid    76 and  name HB*  ) 2.80 1.00 0.00

! betaE-helixB
assign (resid    76 and  name HN   )(resid    89 and  name HD1*  ) 3.60 1.80 0.00
assign (resid    76 and  name HA   )(resid    89 and  name HG  ) 5.00 3.20 0.00
assign (resid    76 and  name HA   )(resid    89 and  name HD**  ) 2.80 1.00 0.00

! betaE-loopDE
assign (resid    70 and  name HN   )(resid    75 and  name HD*  ) 5.00 3.20 0.00
assign (resid    70 and  name HN   )(resid    76 and  name HD*  ) 6.00 4.20 0.00
assign (resid    75 and  name HN   )(resid    70 and  name HG2*  ) 5.00 3.20 0.00

! betaE-loopEF
assign (resid    81 and  name HN   )(resid    76 and  name HB*  ) 3.60 1.80 0.00
assign (resid    81 and  name HN   )(resid    76 and  name HD*  ) 6.00 4.20 0.00

! betaE-loopFB
assign (resid    85 and  name HN   )(resid    75 and  name HD*  ) 5.00 3.20 0.00
assign (resid    85 and  name HA   )(resid    75 and  name HD*  ) 3.60 1.80 0.00
assign (resid    85 and  name HA   )(resid    75 and  name HE*  ) 3.60 1.80 0.00

! betaE-hekixB
assign (resid    86 and  name HN   )(resid    75 and  name HE*  ) 3.60 1.80 2.80
assign (resid    86 and  name HN   )(resid    75 and  name HD*  ) 3.60 1.80 2.80

! betaF-helixB
assign (resid    82 and  name HA   )(resid    89 and  name HG  ) 5.00 3.20 0.00
assign (resid    83 and  name HN   )(resid    89 and  name HD**  ) 3.60 1.80 0.00
assign (resid    89 and  name HN   )(resid    83 and  name HB*  ) 3.60 1.80 0.00

! loopAB-loopCD
assign (resid    32 and  name HA   )(resid    52 and  name HB*  ) 5.00 3.20 0.00
assign (resid    32 and  name HA   )(resid    53 and  name HB*  ) 5.00 3.20 0.00
assign (resid    33 and  name HA*   )(resid    52 and  name HB*  ) 5.00 3.20 0.00
assign (resid    32 and  name HB*   )(resid    52 and  name HB*  ) 3.60 1.80 0.00
assign (resid    52 and  name HB*   )(resid    33 and  name HN  ) 2.80 1.00 0.00
assign (resid    52 and  name HA   )(resid    33 and  name HN  ) 3.60 1.80 0.00
assign (resid    53 and  name HN   )(resid    32 and  name HA  ) 2.80 1.00 0.00
assign (resid    53 and  name HN   )(resid    32 and  name HB*  ) 3.60 1.80 0.00
assign (resid    53 and  name HN   )(resid    33 and  name HA*  ) 6.00 4.20 0.00


! loopBC-loopBC
assign (resid    40 and  name HN   )(resid    45 and  name HG*  ) 5.00 3.20 0.00
assign (resid    40 and  name HB*   )(resid    45 and  name HE*  ) 5.00 3.20 0.00
assign (resid    40 and  name HB1   )(resid    45 and  name HB*  ) 5.00 3.20 0.00
assign (resid    40 and  name HB2   )(resid    45 and  name HB*  ) 5.00 3.20 0.00
assign (resid    45 and  name HN   )(resid    40 and  name HB*  ) 2.80 1.00 0.00

! loopCD-loopCD
assign (resid    52 and  name HN   )(resid    61 and  name HN  ) 3.60 1.80 0.00
assign (resid    52 and  name HN   )(resid    61 and  name HG**  ) 5.00 3.20 0.00
assign (resid    52 and  name HB*   )(resid    61 and  name HB  ) 3.60 1.80 0.00
assign (resid    52 and  name HB*   )(resid    61 and  name HG**  ) 5.00 3.20 0.00
assign (resid    52 and  name HB*   )(resid    61 and  name HN  ) 5.00 3.20 0.00
assign (resid    53 and  name HA   )(resid    59 and  name HA  ) 3.60 1.80 0.00
assign (resid    53 and  name HA   )(resid    60 and  name HA*  ) 3.60 1.80 0.00
assign (resid    53 and  name HA   )(resid    61 and  name HN  ) 3.60 1.80 0.00
assign (resid    54 and  name HA   )(resid    58 and  name HA  ) 2.80 1.00 0.00
assign (resid    60 and  name HN   )(resid    53 and  name HA  ) 3.60 1.80 0.00
assign (resid    60 and  name HN   )(resid    53 and  name HB*  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    53 and  name HD*  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    53 and  name HE*  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    53 and  name HG*  ) 5.00 3.20 0.00
assign (resid    60 and  name HN   )(resid    57 and  name HB*  ) 5.00 3.20 0.00

! loopDE-loopFB
assign (resid    74 and  name HG*   )(resid    84 and  name HA  ) 5.00 3.20 0.00 


assign (resid    7 and  name HD2*   )(resid    86 and  name HN  ) 5.00 3.20 0.00
assign (resid    11 and  name HB*   )(resid    107 and  name HA  ) 3.60 1.80 0.00
assign (resid    11 and  name HB*   )(resid    108 and  name HA  ) 3.60 1.80 0.00
assign (resid    11 and  name HG*   )(resid    107 and  name HA  ) 5.00 3.20 0.00
assign (resid    11 and  name HG*   )(resid    108 and  name HN  ) 5.00 3.20 0.00
assign (resid    11 and  name HG*   )(resid    108 and  name HA  ) 3.60 1.80 0.00
assign (resid    12 and  name HN   )(resid    35 and  name HD1  ) 5.00 3.20 0.00
assign (resid    12 and  name HN   )(resid    107 and  name HA  ) 5.00 3.20 0.00
assign (resid    12 and  name HN   )(resid    107 and  name HB*  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    107 and  name HB*  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    107 and  name HA  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    36 and  name HA  ) 5.00 3.20 0.00
assign (resid    12 and  name HA   )(resid    36 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    13 and  name HA   )(resid    37 and  name HB  ) 2.80 1.00 0.00
assign (resid    14 and  name HB*   )(resid    36 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    36 and  name HG2*  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    39 and  name HN  ) 5.00 3.20 0.00
assign (resid    14 and  name HN   )(resid    37 and  name HB  ) 5.00 3.20 0.00
assign (resid    15 and  name HA   )(resid    38 and  name HB*  ) 5.00 3.20 0.00
assign (resid    15 and  name HA   )(resid    39 and  name HN  ) 3.60 1.80 0.00
assign (resid    16 and  name HN   )(resid    38 and  name HB*  ) 3.60 1.80 0.00
assign (resid    16 and  name HN   )(resid    39 and  name HN  ) 2.80 1.00 0.00
assign (resid    17 and  name HN   )(resid    38 and  name HB*  ) 2.80 1.00 0.00
assign (resid    17 and  name HB*   )(resid    110 and  name HE2*  ) 5.00 3.20 0.00
assign (resid    22 and  name HN   )(resid    17 and  name HG*  ) 5.00 3.20 0.00
assign (resid    22 and  name HB*   )(resid    17 and  name HG*  ) 5.00 3.20 0.00
assign (resid    25 and  name HB*   )(resid    111 and  name HB*  ) 5.00 3.20 0.00
assign (resid    25 and  name HB1   )(resid    113 and  name HE*  ) 3.60 1.80 0.00
assign (resid    25 and  name HB2   )(resid    113 and  name HE*  ) 2.80 1.00 0.00
assign (resid    26 and  name HA   )(resid    108 and  name HG**  ) 5.00 3.20 0.00
assign (resid    29 and  name HB1   )(resid    113 and  name HA  ) 5.00 3.20 0.00
assign (resid    29 and  name HB*   )(resid    108 and  name HA  ) 6.00 4.20 0.00
assign (resid    29 and  name HG*   )(resid    108 and  name HA  ) 5.00 3.20 0.00
assign (resid    29 and  name HG*   )(resid    113 and  name HA  ) 5.00 3.20 0.00
assign (resid    29 and  name HB2   )(resid    113 and  name HA  ) 3.60 1.80 0.00
assign (resid    32 and  name HN   )(resid    106 and  name HB*  ) 6.00 4.20 0.00
aassign (resid    34 and  name HN   )(resid    106 and  name HN  ) 5.00 3.20 0.00
assign (resid    34 and  name HN   )(resid    106 and  name HB2  ) 5.00 3.20 0.00
assign (resid    34 and  name HN   )(resid    106 and  name HD*  ) 6.00 4.20 0.00
assign (resid    35 and  name HN   )(resid    106 and  name HN  ) 2.80 1.00 0.00
assign (resid    35 and  name HN   )(resid    106 and  name HB2  ) 5.00 3.20 0.00
assign (resid    35 and  name HN   )(resid    106 and  name HD*  ) 5.00 3.20 0.00
assign (resid    35 and  name HN   )(resid    108 and  name HN  ) 5.00 3.20 0.00
assign (resid    35 and  name HN   )(resid    108 and  name HG**  ) 6.00 4.20 0.00
assign (resid    35 and  name HB*   )(resid    104 and  name HG  ) 3.60 1.80 0.00
assign (resid    35 and  name HB*   )(resid    104 and  name HD**  ) 3.60 1.80 0.00
assign (resid    35 and  name HB*   )(resid    106 and  name HN  ) 2.80 1.00 0.00
assign (resid    36 and  name HA   )(resid    12 and  name HB*  ) 2.80 1.00 0.00
assign (resid    38 and  name HA   )(resid    13 and  name HE*  ) 5.00 3.20 0.00
assign (resid    86 and  name HN   )(resid    4 and  name HG*  ) 5.00 3.20 0.00
assign (resid    88 and  name HB*   )(resid    2 and  name HB*  ) 5.00 3.20 0.00
assign (resid    95 and  name HN   )(resid    103 and  name HD**  ) 5.00 3.20 0.00
assign (resid    106 and  name HN   )(resid    34 and  name HA*  ) 3.60 1.80 0.00
assign (resid    109 and  name HA   )(resid    36 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    109 and  name HA   )(resid    25 and  name HD**  ) 6.00 4.20 0.00
assign (resid    110 and  name HN   )(resid    25 and  name HD**  ) 6.00 4.20 0.00
assign (resid    110 and  name HA   )(resid    25 and  name HD**  ) 6.00 4.20 0.00
assign (resid    110 and  name HA   )(resid    36 and  name HD1*  ) 5.00 3.20 0.00
assign (resid    110 and  name HG*   )(resid    25 and  name HD**  ) 6.00 4.20 0.00


















remarks H-bond constraints 
assign (resid    22 and  name HN   )(resid    18 and  name O    ) 1.90 0.60 0.30
assign (resid    22 and  name N    )(resid    18 and  name O    ) 2.70 0.60 0.30
assign (resid    23 and  name HN   )(resid    19 and  name O    ) 1.90 0.60 0.30
assign (resid    23 and  name N    )(resid    19 and  name O    ) 2.70 0.60 0.30
assign (resid    24 and  name HN   )(resid    20 and  name O    ) 1.90 0.60 0.30
assign (resid    24 and  name N    )(resid    20 and  name O    ) 2.70 0.60 0.30
assign (resid    25 and  name HN   )(resid    21 and  name O    ) 1.90 0.60 0.30
assign (resid    25 and  name N    )(resid    21 and  name O    ) 2.70 0.60 0.30
assign (resid    26 and  name HN   )(resid    22 and  name O    ) 1.90 0.60 0.30
assign (resid    26 and  name N    )(resid    22 and  name O    ) 2.70 0.60 0.30
assign (resid    27 and  name HN   )(resid    23 and  name O    ) 1.90 0.60 0.30
assign (resid    27 and  name N    )(resid    23 and  name O    ) 2.70 0.60 0.30
assign (resid    28 and  name HN   )(resid    24 and  name O    ) 1.90 0.60 0.30
assign (resid    28 and  name N    )(resid    24 and  name O    ) 2.70 0.60 0.30
assign (resid    34 and  name HN   )(resid    51 and  name O    ) 1.90 0.60 0.30
assign (resid    34 and  name N    )(resid    51 and  name O    ) 2.70 0.60 0.30
assign (resid    36 and  name HN   )(resid    49 and  name O    ) 1.90 0.60 0.30
assign (resid    36 and  name N    )(resid    49 and  name O    ) 2.70 0.60 0.30
assign (resid    38 and  name HN   )(resid    47 and  name O    ) 1.90 0.60 0.30
assign (resid    38 and  name N    )(resid    47 and  name O    ) 2.70 0.60 0.30
assign (resid    47 and  name HN   )(resid    38 and  name O    ) 1.90 0.60 0.30
assign (resid    47 and  name N    )(resid    38 and  name O    ) 2.70 0.60 0.30
assign (resid    48 and  name HN   )(resid    65 and  name O    ) 1.90 0.60 0.30
assign (resid    48 and  name N    )(resid    65 and  name O    ) 2.70 0.60 0.30
assign (resid    49 and  name HN   )(resid    36 and  name O    ) 1.90 0.60 0.30
assign (resid    49 and  name N    )(resid    36 and  name O    ) 2.70 0.60 0.30
assign (resid    50 and  name HN   )(resid    63 and  name O    ) 1.90 0.60 0.30
assign (resid    50 and  name N    )(resid    63 and  name O    ) 2.70 0.60 0.30
assign (resid    51 and  name HN   )(resid    34 and  name O    ) 1.90 0.60 0.30
assign (resid    51 and  name N    )(resid    34 and  name O    ) 2.70 0.60 0.30
assign (resid    63 and  name HN   )(resid    50 and  name O    ) 1.90 0.60 0.30
assign (resid    63 and  name N    )(resid    50 and  name O    ) 2.70 0.60 0.30
assign (resid    65 and  name HN   )(resid    48 and  name O    ) 1.90 0.60 0.30
assign (resid    65 and  name N    )(resid    48 and  name O    ) 2.70 0.60 0.30
assign (resid    67 and  name HN   )(resid    46 and  name O    ) 1.90 0.60 0.30
assign (resid    67 and  name N    )(resid    46 and  name O    ) 2.70 0.60 0.30
assign (resid    68 and  name HN   )(resid    76 and  name O    ) 1.90 0.60 0.30
assign (resid    68 and  name N    )(resid    76 and  name O    ) 2.70 0.60 0.30
assign (resid    75 and  name HN   )(resid    83 and  name O    ) 1.90 0.60 0.30
assign (resid    75 and  name N    )(resid    83 and  name O    ) 2.70 0.60 0.30
assign (resid    76 and  name HN   )(resid    68 and  name O    ) 1.90 0.60 0.30
assign (resid    76 and  name N    )(resid    68 and  name O    ) 2.70 0.60 0.30
assign (resid    83 and  name HN   )(resid    75 and  name O    ) 1.90 0.60 0.30
assign (resid    83 and  name N    )(resid    75 and  name O    ) 2.70 0.60 0.30
assign (resid    89 and  name HN   )(resid    85 and  name O    ) 1.90 0.60 0.30
assign (resid    89 and  name N    )(resid    85 and  name O    ) 2.70 0.60 0.30
assign (resid    90 and  name HN   )(resid    86 and  name O    ) 1.90 0.60 0.30
assign (resid    90 and  name N    )(resid    86 and  name O    ) 2.70 0.60 0.30
assign (resid    91 and  name HN   )(resid    87 and  name O    ) 1.90 0.60 0.30
assign (resid    91 and  name N    )(resid    87 and  name O    ) 2.70 0.60 0.30
assign (resid    92 and  name HN   )(resid    88 and  name O    ) 1.90 0.60 0.30
assign (resid    92 and  name N    )(resid    88 and  name O    ) 2.70 0.60 0.30
!set message=on echo=on end


remarks JHNHA restrants
restraints dihedral

! S 6 Phi   -91.59

   assign (resid 5 and name C)
	  (resid 6 and name N) 
	  (resid 6 and name CA)
	  (resid 6 and name C) 1  -130.03   -53.15 2 

! E 11 Phi   -74.56

   assign (resid 10 and name C)
	  (resid 11 and name N) 
	  (resid 11 and name CA)
	  (resid 11 and name C) 1  -105.06   -44.06 2 

! Y 13 Phi  -105.81

   assign (resid 12 and name C)
	  (resid 13 and name N) 
	  (resid 13 and name CA)
	  (resid 13 and name C) 1  -148.01   -63.61 2 

! M 17 Phi   -91.72

   assign (resid 16 and name C)
	  (resid 17 and name N) 
	  (resid 17 and name CA)
	  (resid 17 and name C) 1  -132.38   -51.06 2 

! T 18 Phi   -90.21

   assign (resid 17 and name C)
	  (resid 18 and name N) 
	  (resid 18 and name CA)
	  (resid 18 and name C) 1  -102.01   -78.41 2 

! R 19 Phi   -62.25

   assign (resid 18 and name C)
	  (resid 19 and name N) 
	  (resid 19 and name CA)
	  (resid 19 and name C) 1   -74.95   -49.55 2 

! S 20 Phi   -64.63

   assign (resid 19 and name C)
	  (resid 20 and name N) 
	  (resid 20 and name CA)
	  (resid 20 and name C) 1   -74.43   -54.83 2 

! Q 21 Phi   -66.54

   assign (resid 20 and name C)
	  (resid 21 and name N) 
	  (resid 21 and name CA)
	  (resid 21 and name C) 1   -79.64   -53.44 2 

! A 22 Phi   -67.40

   assign (resid 21 and name C)
	  (resid 22 and name N) 
	  (resid 22 and name CA)
	  (resid 22 and name C) 1   -88.08   -46.72 2 

! E 23 Phi   -67.40

   assign (resid 22 and name C)
	  (resid 23 and name N) 
	  (resid 23 and name CA)
	  (resid 23 and name C) 1   -76.14   -58.66 2 

! Q 24 Phi   -68.27

   assign (resid 23 and name C)
	  (resid 24 and name N) 
	  (resid 24 and name CA)
	  (resid 24 and name C) 1   -80.49   -56.05 2 

! L 26 Phi   -64.02

   assign (resid 25 and name C)
	  (resid 26 and name N) 
	  (resid 26 and name CA)
	  (resid 26 and name C) 1   -83.82   -44.22 2 

! K 27 Phi   -64.79

   assign (resid 26 and name C)
	  (resid 27 and name N) 
	  (resid 27 and name CA)
	  (resid 27 and name C) 1   -80.19   -49.39 2 

! Q 28 Phi   -62.36

   assign (resid 27 and name C)
	  (resid 28 and name N) 
	  (resid 28 and name CA)
	  (resid 28 and name C) 1   -72.58   -52.14 2 

! E 29 Phi   -67.96

   assign (resid 28 and name C)
	  (resid 29 and name N) 
	  (resid 29 and name CA)
	  (resid 29 and name C) 1   -78.58   -57.34 2 

! K 31 Phi   -96.69

   assign (resid 30 and name C)
	  (resid 31 and name N) 
	  (resid 31 and name CA)
	  (resid 31 and name C) 1  -129.87   -63.51 2 

! F 35 Phi  -126.66

   assign (resid 34 and name C)
	  (resid 35 and name N) 
	  (resid 35 and name CA)
	  (resid 35 and name C) 1  -165.98   -87.34 2 

! I 36 Phi  -133.69

   assign (resid 35 and name C)
	  (resid 36 and name N) 
	  (resid 36 and name CA)
	  (resid 36 and name C) 1  -182.39   -84.99 2 

! V 37 Phi  -111.65

   assign (resid 36 and name C)
	  (resid 37 and name N) 
	  (resid 37 and name CA)
	  (resid 37 and name C) 1  -142.41   -80.89 2 

! S 40 Phi   -90.56

   assign (resid 39 and name C)
	  (resid 40 and name N) 
	  (resid 40 and name CA)
	  (resid 40 and name C) 1  -119.72   -61.40 2 

! K 45 Phi  -107.33

   assign (resid 44 and name C)
	  (resid 45 and name N) 
	  (resid 45 and name CA)
	  (resid 45 and name C) 1  -152.53   -62.13 2 

! Y 46 Phi  -113.75

   assign (resid 45 and name C)
	  (resid 46 and name N) 
	  (resid 46 and name CA)
	  (resid 46 and name C) 1  -146.63   -80.87 2 

! T 47 Phi  -121.84

   assign (resid 46 and name C)
	  (resid 47 and name N) 
	  (resid 47 and name CA)
	  (resid 47 and name C) 1  -150.38   -93.30 2 

! V 48 Phi  -113.58

   assign (resid 47 and name C)
	  (resid 48 and name N) 
	  (resid 48 and name CA)
	  (resid 48 and name C) 1  -145.38   -81.78 2 

! S 49 Phi  -113.30

   assign (resid 48 and name C)
	  (resid 49 and name N) 
	  (resid 49 and name CA)
	  (resid 49 and name C) 1  -146.52   -80.08 2 

! V 50 Phi  -129.76

   assign (resid 49 and name C)
	  (resid 50 and name N) 
	  (resid 50 and name CA)
	  (resid 50 and name C) 1  -152.92  -106.60 2 

! F 51 Phi  -109.78

   assign (resid 50 and name C)
	  (resid 51 and name N) 
	  (resid 51 and name CA)
	  (resid 51 and name C) 1  -135.58   -83.98 2 

! A 52 Phi  -120.67

   assign (resid 51 and name C)
	  (resid 52 and name N) 
	  (resid 52 and name CA)
	  (resid 52 and name C) 1  -155.25   -86.09 2 

! S 54 Phi   -90.92

   assign (resid 53 and name C)
	  (resid 54 and name N) 
	  (resid 54 and name CA)
	  (resid 54 and name C) 1  -136.88   -44.96 2 

! V 61 Phi  -124.52

   assign (resid 60 and name C)
	  (resid 61 and name N) 
	  (resid 61 and name CA)
	  (resid 61 and name C) 1  -157.16   -91.88 2 

! I 62 Phi  -114.22

   assign (resid 61 and name C)
	  (resid 62 and name N) 
	  (resid 62 and name CA)
	  (resid 62 and name C) 1  -143.50   -84.94 2 

! H 64 Phi  -102.50

   assign (resid 63 and name C)
	  (resid 64 and name N) 
	  (resid 64 and name CA)
	  (resid 64 and name C) 1  -124.98   -80.02 2 

! Y 65 Phi  -109.58

   assign (resid 64 and name C)
	  (resid 65 and name N) 
	  (resid 65 and name CA)
	  (resid 65 and name C) 1  -149.96   -69.20 2 

! V 66 Phi   -94.94

   assign (resid 65 and name C)
	  (resid 66 and name N) 
	  (resid 66 and name CA)
	  (resid 66 and name C) 1  -132.36   -57.52 2 

! V 67 Phi   -78.01

   assign (resid 66 and name C)
	  (resid 67 and name N) 
	  (resid 67 and name CA)
	  (resid 67 and name C) 1  -103.89   -52.13 2 

! S 69 Phi  -123.80

   assign (resid 68 and name C)
	  (resid 69 and name N) 
	  (resid 69 and name CA)
	  (resid 69 and name C) 1  -159.32   -88.28 2 

! T 70 Phi  -103.50

   assign (resid 69 and name C)
	  (resid 70 and name N) 
	  (resid 70 and name CA)
	  (resid 70 and name C) 1  -134.00   -73.00 2 

! Q 74 Phi  -119.96

   assign (resid 73 and name C)
	  (resid 74 and name N) 
	  (resid 74 and name CA)
	  (resid 74 and name C) 1  -168.26   -71.66 2 

! Y 75 Phi  -121.86

   assign (resid 74 and name C)
	  (resid 75 and name N) 
	  (resid 75 and name CA)
	  (resid 75 and name C) 1  -176.96   -66.76 2 

! Y 76 Phi  -126.80

   assign (resid 75 and name C)
	  (resid 76 and name N) 
	  (resid 76 and name CA)
	  (resid 76 and name C) 1  -162.40   -91.20 2 

! L 77 Phi  -102.10

   assign (resid 76 and name C)
	  (resid 77 and name N) 
	  (resid 77 and name CA)
	  (resid 77 and name C) 1  -153.72   -50.48 2 

! H 81 Phi   -91.44

   assign (resid 80 and name C)
	  (resid 81 and name N) 
	  (resid 81 and name CA)
	  (resid 81 and name C) 1  -160.30   -22.58 2 

! L 82 Phi  -101.76

   assign (resid 81 and name C)
	  (resid 82 and name N) 
	  (resid 82 and name CA)
	  (resid 82 and name C) 1  -134.98   -68.54 2 

! T 85 Phi  -119.72

   assign (resid 84 and name C)
	  (resid 85 and name N) 
	  (resid 85 and name CA)
	  (resid 85 and name C) 1  -165.62   -73.82 2 

! E 88 Phi   -69.23

   assign (resid 87 and name C)
	  (resid 88 and name N) 
	  (resid 88 and name CA)
	  (resid 88 and name C) 1   -80.55   -57.91 2 

! L 89 Phi   -68.76

   assign (resid 88 and name C)
	  (resid 89 and name N) 
	  (resid 89 and name CA)
	  (resid 89 and name C) 1   -83.52   -54.00 2 

! I 90 Phi   -65.75

   assign (resid 89 and name C)
	  (resid 90 and name N) 
	  (resid 90 and name CA)
	  (resid 90 and name C) 1   -81.71   -49.79 2 

! N 91 Phi   -62.12

   assign (resid 90 and name C)
	  (resid 91 and name N) 
	  (resid 91 and name CA)
	  (resid 91 and name C) 1   -72.48   -51.76 2 

! Y 92 Phi   -65.13

   assign (resid 91 and name C)
	  (resid 92 and name N) 
	  (resid 92 and name CA)
	  (resid 92 and name C) 1   -80.13   -50.13 2 

! H 93 Phi   -71.24

   assign (resid 92 and name C)
	  (resid 93 and name N) 
	  (resid 93 and name CA)
	  (resid 93 and name C) 1   -98.26   -44.22 2 

! Q 94 Phi   -89.01

   assign (resid 93 and name C)
	  (resid 94 and name N) 
	  (resid 94 and name CA)
	  (resid 94 and name C) 1  -123.05   -54.97 2 

! V 108 Phi  -101.00

assign (resid 107 and name C)
       (resid 108 and name N) 
       (resid 108 and name CA)
       (resid 108 and name C) 1  -154.76   -47.24 2 

! S 109 Phi  -102.48

assign (resid 108 and name C)
       (resid 109 and name N) 
       (resid 109 and name CA)
       (resid 109 and name C) 1  -151.26   -53.70 2 


! S 6 Psi   127.17

   assign (resid 6 and name N)
	  (resid 6 and name CA) 
	  (resid 6 and name C)
	  (resid 7 and name N) 1    85.35   168.99 2 

! E 11 Psi   -22.92

   assign (resid 11 and name N)
	  (resid 11 and name CA) 
	  (resid 11 and name C)
	  (resid 12 and name N) 1   -58.00    12.16 2 

! Y 13 Psi   124.41

   assign (resid 13 and name N)
	  (resid 13 and name CA) 
	  (resid 13 and name C)
	  (resid 14 and name N) 1    92.87   155.95 2 

! M 17 Psi   122.84

   assign (resid 17 and name N)
	  (resid 17 and name CA) 
	  (resid 17 and name C)
	  (resid 18 and name N) 1    80.74   164.94 2 

! T 18 Psi   154.06

   assign (resid 18 and name N)
	  (resid 18 and name CA) 
	  (resid 18 and name C)
	  (resid 19 and name N) 1    96.72   211.40 2 

! R 19 Psi   -36.63

   assign (resid 19 and name N)
	  (resid 19 and name CA) 
	  (resid 19 and name C)
	  (resid 20 and name N) 1   -53.07   -20.19 2 

! S 20 Psi   -35.55

   assign (resid 20 and name N)
	  (resid 20 and name CA) 
	  (resid 20 and name C)
	  (resid 21 and name N) 1   -46.13   -24.97 2 

! Q 21 Psi   -41.34

   assign (resid 21 and name N)
	  (resid 21 and name CA) 
	  (resid 21 and name C)
	  (resid 22 and name N) 1   -55.38   -27.30 2 

! A 22 Psi   -38.30

   assign (resid 22 and name N)
	  (resid 22 and name CA) 
	  (resid 22 and name C)
	  (resid 23 and name N) 1   -53.50   -23.10 2 

! E 23 Psi   -44.76

   assign (resid 23 and name N)
	  (resid 23 and name CA) 
	  (resid 23 and name C)
	  (resid 24 and name N) 1   -58.86   -30.66 2 

! Q 24 Psi   -35.53

   assign (resid 24 and name N)
	  (resid 24 and name CA) 
	  (resid 24 and name C)
	  (resid 25 and name N) 1   -52.13   -18.93 2 

! L 26 Psi   -43.98

   assign (resid 26 and name N)
	  (resid 26 and name CA) 
	  (resid 26 and name C)
	  (resid 27 and name N) 1   -61.98   -25.98 2 

! K 27 Psi   -41.61

   assign (resid 27 and name N)
	  (resid 27 and name CA) 
	  (resid 27 and name C)
	  (resid 28 and name N) 1   -60.01   -23.21 2 

! Q 28 Psi   -41.70

   assign (resid 28 and name N)
	  (resid 28 and name CA) 
	  (resid 28 and name C)
	  (resid 29 and name N) 1   -60.62   -22.78 2 

! E 29 Psi   -32.57

   assign (resid 29 and name N)
	  (resid 29 and name CA) 
	  (resid 29 and name C)
	  (resid 30 and name N) 1   -51.49   -13.65 2 

! K 31 Psi   142.76

   assign (resid 31 and name N)
	  (resid 31 and name CA) 
	  (resid 31 and name C)
	  (resid 32 and name N) 1   101.06   184.46 2 

! F 35 Psi   146.19

   assign (resid 35 and name N)
	  (resid 35 and name CA) 
	  (resid 35 and name C)
	  (resid 36 and name N) 1   119.03   173.35 2 

! I 36 Psi   134.11

   assign (resid 36 and name N)
	  (resid 36 and name CA) 
	  (resid 36 and name C)
	  (resid 37 and name N) 1    86.61   181.61 2 

! V 37 Psi   123.51

   assign (resid 37 and name N)
	  (resid 37 and name CA) 
	  (resid 37 and name C)
	  (resid 38 and name N) 1   108.11   138.91 2 

! S 40 Psi   136.61

   assign (resid 40 and name N)
	  (resid 40 and name CA) 
	  (resid 40 and name C)
	  (resid 41 and name N) 1    89.39   183.83 2 

! K 45 Psi   145.99

   assign (resid 45 and name N)
	  (resid 45 and name CA) 
	  (resid 45 and name C)
	  (resid 46 and name N) 1   108.17   183.81 2 

! Y 46 Psi   131.76

   assign (resid 46 and name N)
	  (resid 46 and name CA) 
	  (resid 46 and name C)
	  (resid 47 and name N) 1    92.14   171.38 2 

! T 47 Psi   130.12

   assign (resid 47 and name N)
	  (resid 47 and name CA) 
	  (resid 47 and name C)
	  (resid 48 and name N) 1   100.82   159.42 2 

! V 48 Psi   128.87

   assign (resid 48 and name N)
	  (resid 48 and name CA) 
	  (resid 48 and name C)
	  (resid 49 and name N) 1   109.11   148.63 2 

! S 49 Psi   131.71

   assign (resid 49 and name N)
	  (resid 49 and name CA) 
	  (resid 49 and name C)
	  (resid 50 and name N) 1   108.65   154.77 2 

! V 50 Psi   136.85

   assign (resid 50 and name N)
	  (resid 50 and name CA) 
	  (resid 50 and name C)
	  (resid 51 and name N) 1   103.47   170.23 2 

! F 51 Psi   124.97

   assign (resid 51 and name N)
	  (resid 51 and name CA) 
	  (resid 51 and name C)
	  (resid 52 and name N) 1   100.85   149.09 2 

! A 52 Psi   145.18

   assign (resid 52 and name N)
	  (resid 52 and name CA) 
	  (resid 52 and name C)
	  (resid 53 and name N) 1   117.56   172.80 2 

! S 54 Psi   120.61

   assign (resid 54 and name N)
	  (resid 54 and name CA) 
	  (resid 54 and name C)
	  (resid 55 and name N) 1    82.07   159.15 2 

! V 61 Psi   149.70

   assign (resid 61 and name N)
	  (resid 61 and name CA) 
	  (resid 61 and name C)
	  (resid 62 and name N) 1   119.50   179.90 2 

! I 62 Psi   134.38

   assign (resid 62 and name N)
	  (resid 62 and name CA) 
	  (resid 62 and name C)
	  (resid 63 and name N) 1   109.66   159.10 2 

! H 64 Psi   129.10

   assign (resid 64 and name N)
	  (resid 64 and name CA) 
	  (resid 64 and name C)
	  (resid 65 and name N) 1   104.50   153.70 2 

! Y 65 Psi   120.00

   assign (resid 65 and name N)
	  (resid 65 and name CA) 
	  (resid 65 and name C)
	  (resid 66 and name N) 1    96.42   143.58 2 

! V 66 Psi   124.11

   assign (resid 66 and name N)
	  (resid 66 and name CA) 
	  (resid 66 and name C)
	  (resid 67 and name N) 1   105.53   142.69 2 

! V 67 Psi   130.21

   assign (resid 67 and name N)
	  (resid 67 and name CA) 
	  (resid 67 and name C)
	  (resid 68 and name N) 1   103.79   156.63 2 

! S 69 Psi   148.80

   assign (resid 69 and name N)
	  (resid 69 and name CA) 
	  (resid 69 and name C)
	  (resid 70 and name N) 1   123.62   173.98 2 

! T 70 Psi   147.90

   assign (resid 70 and name N)
	  (resid 70 and name CA) 
	  (resid 70 and name C)
	  (resid 71 and name N) 1   104.52   191.28 2 

! Q 74 Psi   148.33

   assign (resid 74 and name N)
	  (resid 74 and name CA) 
	  (resid 74 and name C)
	  (resid 75 and name N) 1   116.45   180.21 2 

! Y 75 Psi   138.73

   assign (resid 75 and name N)
	  (resid 75 and name CA) 
	  (resid 75 and name C)
	  (resid 76 and name N) 1    90.13   187.33 2 

! Y 76 Psi   149.66

   assign (resid 76 and name N)
	  (resid 76 and name CA) 
	  (resid 76 and name C)
	  (resid 77 and name N) 1   113.10   186.22 2 

! L 77 Psi   133.48

   assign (resid 77 and name N)
	  (resid 77 and name CA) 
	  (resid 77 and name C)
	  (resid 78 and name N) 1   100.40   166.56 2 

! H 81 Psi   132.98

   assign (resid 81 and name N)
	  (resid 81 and name CA) 
	  (resid 81 and name C)
	  (resid 82 and name N) 1    79.82   186.14 2 

! L 82 Psi   137.82

   assign (resid 82 and name N)
	  (resid 82 and name CA) 
	  (resid 82 and name C)
	  (resid 83 and name N) 1    96.54   179.10 2 

! T 85 Psi   149.69

   assign (resid 85 and name N)
	  (resid 85 and name CA) 
	  (resid 85 and name C)
	  (resid 86 and name N) 1   128.53   170.85 2 

! E 88 Psi   -39.42

   assign (resid 88 and name N)
	  (resid 88 and name CA) 
	  (resid 88 and name C)
	  (resid 89 and name N) 1   -55.26   -23.58 2 

! L 89 Psi   -32.84

   assign (resid 89 and name N)
	  (resid 89 and name CA) 
	  (resid 89 and name C)
	  (resid 90 and name N) 1   -60.54    -5.14 2 

! I 90 Psi   -41.77

   assign (resid 90 and name N)
	  (resid 90 and name CA) 
	  (resid 90 and name C)
	  (resid 91 and name N) 1   -58.57   -24.97 2 

! N 91 Psi   -39.68

   assign (resid 91 and name N)
	  (resid 91 and name CA) 
	  (resid 91 and name C)
	  (resid 92 and name N) 1   -59.68   -19.68 2 

! Y 92 Psi   -41.82

   assign (resid 92 and name N)
	  (resid 92 and name CA) 
	  (resid 92 and name C)
	  (resid 93 and name N) 1   -50.50   -33.14 2 

! H 93 Psi   -33.06

   assign (resid 93 and name N)
	  (resid 93 and name CA) 
	  (resid 93 and name C)
	  (resid 94 and name N) 1   -53.72   -12.40 2 

! Q 94 Psi   -22.66

   assign (resid 94 and name N)
	  (resid 94 and name CA) 
	  (resid 94 and name C)
	  (resid 95 and name N) 1   -60.00    14.68 2 

! V 108 Psi   127.54

assign (resid 108 and name N)
       (resid 108 and name CA) 
       (resid 108 and name C)
       (resid 109 and name N) 1    84.58   170.50 2 

! S 109 Psi   135.65

assign (resid 109 and name N)
       (resid 109 and name CA) 
       (resid 109 and name C)
       (resid 110 and name N) 1    75.49   195.81 2 


end

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    THR   1           1H       THR   1  21.008  -6.802 -10.637
    2    HA   THR   1           HA       THR   1  19.647  -6.295  -8.045
    3    HB   THR   1           HB       THR   1  20.020  -3.858  -8.893
    4    HG1  THR   1           1HG      THR   1  22.001  -3.732 -10.094
    5   1HG2  THR   1          1HG2      THR   1  21.173  -4.192  -6.947
    6   2HG2  THR   1          2HG2      THR   1  22.565  -4.165  -8.030
    7   3HG2  THR   1          3HG2      THR   1  21.883  -5.705  -7.508
    8    H    GLU   2           H        GLU   2  17.831  -4.600  -8.680
    9    HA   GLU   2           HA       GLU   2  16.774  -4.888 -11.413
   10   1HB   GLU   2          2HB       GLU   2  16.275  -6.920  -9.690
   11   2HB   GLU   2          1HB       GLU   2  14.925  -5.856  -9.295
   12   1HG   GLU   2          2HG       GLU   2  13.939  -6.114 -11.348
   13   2HG   GLU   2          1HG       GLU   2  15.485  -6.255 -12.188
   14    H    ALA   3           H        ALA   3  15.454  -3.141 -11.877
   15    HA   ALA   3           HA       ALA   3  14.720  -1.340  -9.594
   16   1HB   ALA   3          1HB       ALA   3  14.984  -0.642 -12.526
   17   2HB   ALA   3          2HB       ALA   3  16.372  -0.654 -11.439
   18   3HB   ALA   3          3HB       ALA   3  15.032   0.453 -11.144
   19    H    GLU   4           H        GLU   4  12.908   0.260 -11.039
   20    HA   GLU   4           HA       GLU   4  10.864  -1.255 -12.401
   21   1HB   GLU   4          2HB       GLU   4   9.245  -1.247 -10.452
   22   2HB   GLU   4          1HB       GLU   4  10.612  -2.343 -10.257
   23   1HG   GLU   4          2HG       GLU   4  10.922  -1.320  -8.258
   24   2HG   GLU   4          1HG       GLU   4  11.589   0.016  -9.194
   25    H    ASP   5           H        ASP   5  11.666   1.546 -10.373
   26    HA   ASP   5           HA       ASP   5   9.449   3.216 -10.882
   27   1HB   ASP   5          2HB       ASP   5  11.094   5.035 -10.430
   28   2HB   ASP   5          1HB       ASP   5  11.267   3.694  -9.298
   29    H    SER   6           H        SER   6   8.666   4.028 -12.785
   30    HA   SER   6           HA       SER   6  10.481   4.940 -14.908
   31   1HB   SER   6          2HB       SER   6   9.272   2.287 -14.854
   32   2HB   SER   6          1HB       SER   6   8.794   3.184 -16.292
   33    HG   SER   6           HG       SER   6  10.900   3.406 -16.856
   34    H    ILE   7           H        ILE   7   8.644   5.035 -16.998
   35    HA   ILE   7           HA       ILE   7   6.997   7.283 -16.296
   36    HB   ILE   7           HB       ILE   7   8.068   6.520 -18.524
   37   1HG1  ILE   7          2HG1      ILE   7   6.559   8.484 -18.265
   38   2HG1  ILE   7          1HG1      ILE   7   6.385   7.700 -19.833
   39   1HG2  ILE   7          1HG2      ILE   7   7.043   4.251 -18.501
   40   2HG2  ILE   7          2HG2      ILE   7   6.674   5.144 -19.976
   41   3HG2  ILE   7          3HG2      ILE   7   5.457   4.992 -18.710
   42   1HD1  ILE   7          1HD1      ILE   7   4.512   6.340 -18.402
   43   2HD1  ILE   7          2HD1      ILE   7   4.160   7.792 -19.335
   44   3HD1  ILE   7          3HD1      ILE   7   4.450   7.908 -17.600
   45    H    GLU   8           H        GLU   8   6.413   3.827 -16.383
   46    HA   GLU   8           HA       GLU   8   3.685   3.495 -16.616
   47   1HB   GLU   8          2HB       GLU   8   5.631   2.326 -14.608
   48   2HB   GLU   8          1HB       GLU   8   4.023   1.663 -14.905
   49   1HG   GLU   8          2HG       GLU   8   4.770   1.677 -17.417
   50   2HG   GLU   8          1HG       GLU   8   6.399   1.752 -16.746
   51    H    MET   9           H        MET   9   1.871   4.059 -15.451
   52    HA   MET   9           HA       MET   9   1.895   4.716 -12.642
   53   1HB   MET   9          2HB       MET   9   1.200   7.178 -13.228
   54   2HB   MET   9          1HB       MET   9   2.909   6.754 -13.213
   55   1HG   MET   9          2HG       MET   9   2.771   7.846 -15.255
   56   2HG   MET   9          1HG       MET   9   2.455   6.194 -15.771
   57   1HE   MET   9          1HE       MET   9  -0.756   5.477 -16.076
   58   2HE   MET   9          2HE       MET   9   0.906   5.320 -16.638
   59   3HE   MET   9          3HE       MET   9  -0.276   6.163 -17.634
   60    H    TYR  10           H        TYR  10   0.307   2.935 -13.993
   61    HA   TYR  10           HA       TYR  10  -2.097   3.738 -15.176
   62   1HB   TYR  10          2HB       TYR  10  -1.210   1.495 -13.396
   63   2HB   TYR  10          1HB       TYR  10  -2.923   1.620 -13.797
   64    HD1  TYR  10           1HD      TYR  10   0.263   0.461 -14.899
   65    HD2  TYR  10           2HD      TYR  10  -3.503   1.957 -16.324
   66    HE1  TYR  10           1HE      TYR  10   0.711  -0.533 -17.126
   67    HE2  TYR  10           2HE      TYR  10  -3.055   0.963 -18.552
   68    HH   TYR  10           HH       TYR  10  -1.456  -1.174 -19.322
   69    H    GLU  11           H        GLU  11  -2.247   2.653 -11.784
   70    HA   GLU  11           HA       GLU  11  -3.599   5.184 -10.998
   71   1HB   GLU  11          2HB       GLU  11  -5.079   3.146 -11.996
   72   2HB   GLU  11          1HB       GLU  11  -4.999   2.655 -10.307
   73   1HG   GLU  11          2HG       GLU  11  -6.280   4.387  -9.600
   74   2HG   GLU  11          1HG       GLU  11  -5.586   5.509 -10.766
   75    H    TRP  12           H        TRP  12  -2.997   1.839  -9.854
   76    HA   TRP  12           HA       TRP  12  -2.944   2.307  -7.104
   77   1HB   TRP  12          2HB       TRP  12  -1.461   0.293  -7.068
   78   2HB   TRP  12          1HB       TRP  12  -2.851   0.102  -8.135
   79    HD1  TRP  12           HD       TRP  12  -2.415  -0.158 -10.688
   80    HE1  TRP  12           1HE      TRP  12  -0.281  -0.417 -12.111
   81    HE3  TRP  12           3HE      TRP  12   1.120   1.050  -7.205
   82    HZ2  TRP  12           2HZ      TRP  12   2.552  -0.147 -11.812
   83    HZ3  TRP  12           3HZ      TRP  12   3.525   1.043  -7.800
   84    HH2  TRP  12           HH       TRP  12   4.245   0.446 -10.097
   85    H    TYR  13           H        TYR  13  -0.469   3.100  -9.484
   86    HA   TYR  13           HA       TYR  13   1.586   3.612  -7.445
   87   1HB   TYR  13          2HB       TYR  13   1.900   2.787  -9.848
   88   2HB   TYR  13          1HB       TYR  13   1.553   4.440 -10.355
   89    HD1  TYR  13           1HD      TYR  13   3.484   3.021  -7.468
   90    HD2  TYR  13           2HD      TYR  13   3.540   5.502 -10.974
   91    HE1  TYR  13           1HE      TYR  13   5.822   3.674  -6.966
   92    HE2  TYR  13           2HE      TYR  13   5.880   6.153 -10.473
   93    HH   TYR  13           HH       TYR  13   7.368   5.505  -7.472
   94    H    SER  14           H        SER  14   2.219   5.642  -6.685
   95    HA   SER  14           HA       SER  14   1.012   8.096  -7.808
   96   1HB   SER  14          2HB       SER  14   0.548   7.244  -4.938
   97   2HB   SER  14          1HB       SER  14  -0.130   8.655  -5.747
   98    HG   SER  14           HG       SER  14  -0.967   6.072  -5.751
   99    H    LYS  15           H        LYS  15   2.441   9.765  -7.556
  100    HA   LYS  15           HA       LYS  15   5.020   9.333  -6.306
  101   1HB   LYS  15          2HB       LYS  15   3.593  11.348  -7.924
  102   2HB   LYS  15          1HB       LYS  15   4.822  12.020  -6.853
  103   1HG   LYS  15          2HG       LYS  15   5.813  11.451  -9.024
  104   2HG   LYS  15          1HG       LYS  15   6.475  10.413  -7.761
  105   1HD   LYS  15          2HD       LYS  15   4.596   8.759  -8.398
  106   2HD   LYS  15          1HD       LYS  15   4.426   9.725  -9.864
  107   1HE   LYS  15          2HE       LYS  15   5.992   8.110 -10.542
  108   2HE   LYS  15          1HE       LYS  15   7.061   9.416  -9.990
  109   1HZ   LYS  15          1HZ       LYS  15   7.456   7.116  -9.002
  110   2HZ   LYS  15          2HZ       LYS  15   6.022   7.366  -8.127
  111   3HZ   LYS  15          3HZ       LYS  15   7.343   8.413  -7.915
  112    H    HIS  16           H        HIS  16   5.014   9.209  -4.089
  113    HA   HIS  16           HA       HIS  16   4.843   9.910  -1.851
  114   1HB   HIS  16          2HB       HIS  16   4.795  12.456  -3.467
  115   2HB   HIS  16          1HB       HIS  16   4.714  12.502  -1.707
  116    HD1  HIS  16           1HD      HIS  16   7.191  13.695  -2.951
  117    HD2  HIS  16           2HD      HIS  16   6.924   9.651  -1.973
  118    HE1  HIS  16           1HE      HIS  16   9.570  12.858  -2.704
  119    H    MET  17           H        MET  17   2.500   8.819  -2.658
  120    HA   MET  17           HA       MET  17   0.246  10.659  -2.310
  121   1HB   MET  17          2HB       MET  17   0.010   8.750  -3.753
  122   2HB   MET  17          1HB       MET  17   0.596   7.654  -2.506
  123   1HG   MET  17          2HG       MET  17  -1.623   7.281  -2.131
  124   2HG   MET  17          1HG       MET  17  -1.540   8.790  -1.228
  125   1HE   MET  17          1HE       MET  17  -1.709  10.941  -2.102
  126   2HE   MET  17          2HE       MET  17  -2.866  11.477  -3.317
  127   3HE   MET  17          3HE       MET  17  -1.231  11.035  -3.803
  128    H    THR  18           H        THR  18  -0.636  11.215  -0.363
  129    HA   THR  18           HA       THR  18   0.565  10.518   2.134
  130    HB   THR  18           HB       THR  18  -2.261  11.510   1.775
  131    HG1  THR  18           1HG      THR  18   0.116  13.018   1.452
  132   1HG2  THR  18          1HG2      THR  18  -0.124  12.592   3.595
  133   2HG2  THR  18          2HG2      THR  18  -1.019  11.137   4.037
  134   3HG2  THR  18          3HG2      THR  18  -1.876  12.658   3.784
  135    H    ARG  19           H        ARG  19   0.153   8.881   3.547
  136    HA   ARG  19           HA       ARG  19  -1.200   6.493   2.911
  137   1HB   ARG  19          2HB       ARG  19  -0.934   6.038   5.299
  138   2HB   ARG  19          1HB       ARG  19   0.472   6.944   4.740
  139   1HG   ARG  19          2HG       ARG  19  -0.735   9.064   5.503
  140   2HG   ARG  19          1HG       ARG  19  -1.915   8.011   6.287
  141   1HD   ARG  19          2HD       ARG  19  -0.403   7.293   7.900
  142   2HD   ARG  19          1HD       ARG  19   1.000   7.530   6.840
  143    HE   ARG  19           HE       ARG  19   0.297  10.070   7.068
  144   1HH1  ARG  19          1HH2      ARG  19   1.628   8.048   9.284
  145   2HH1  ARG  19          2HH2      ARG  19   1.131   8.922  10.695
  146   1HH2  ARG  19          1HH1      ARG  19  -1.020  11.019   8.963
  147   2HH2  ARG  19          2HH1      ARG  19  -0.368  10.604  10.514
  148    H    SER  20           H        SER  20  -2.356   9.361   4.607
  149    HA   SER  20           HA       SER  20  -4.921   8.323   5.372
  150   1HB   SER  20          2HB       SER  20  -4.574  10.192   6.586
  151   2HB   SER  20          1HB       SER  20  -3.304  10.724   5.494
  152    HG   SER  20           HG       SER  20  -4.708  12.183   4.916
  153    H    GLN  21           H        GLN  21  -3.801  10.242   2.572
  154    HA   GLN  21           HA       GLN  21  -6.354  10.648   1.359
  155   1HB   GLN  21          2HB       GLN  21  -3.513  10.417   0.340
  156   2HB   GLN  21          1HB       GLN  21  -4.859  10.822  -0.727
  157   1HG   GLN  21          2HG       GLN  21  -4.732  12.386   1.783
  158   2HG   GLN  21          1HG       GLN  21  -3.414  12.676   0.650
  159   1HE2  GLN  21          1HE2      GLN  21  -6.809  11.827  -0.140
  160   2HE2  GLN  21          2HE2      GLN  21  -7.128  13.256  -0.997
  161    H    ALA  22           H        ALA  22  -4.030   7.978   1.220
  162    HA   ALA  22           HA       ALA  22  -5.353   6.452  -0.814
  163   1HB   ALA  22          1HB       ALA  22  -3.241   6.138   1.219
  164   2HB   ALA  22          2HB       ALA  22  -3.284   5.551  -0.444
  165   3HB   ALA  22          3HB       ALA  22  -4.086   4.637   0.835
  166    H    GLU  23           H        GLU  23  -5.517   6.347   2.745
  167    HA   GLU  23           HA       GLU  23  -7.409   4.250   3.001
  168   1HB   GLU  23          2HB       GLU  23  -6.704   6.706   4.612
  169   2HB   GLU  23          1HB       GLU  23  -7.920   5.560   5.179
  170   1HG   GLU  23          2HG       GLU  23  -6.367   3.823   5.405
  171   2HG   GLU  23          1HG       GLU  23  -5.229   4.568   4.285
  172    H    GLN  24           H        GLN  24  -8.010   7.792   2.829
  173    HA   GLN  24           HA       GLN  24 -10.860   7.500   2.901
  174   1HB   GLN  24          2HB       GLN  24 -10.834   9.876   2.236
  175   2HB   GLN  24          1HB       GLN  24  -9.648   9.561   3.500
  176   1HG   GLN  24          2HG       GLN  24  -7.878   9.401   1.764
  177   2HG   GLN  24          1HG       GLN  24  -9.078   9.796   0.532
  178   1HE2  GLN  24          1HE2      GLN  24  -8.132  11.138   3.757
  179   2HE2  GLN  24          2HE2      GLN  24  -8.144  12.755   3.242
  180    H    LEU  25           H        LEU  25  -8.608   7.977   0.107
  181    HA   LEU  25           HA       LEU  25 -10.801   7.853  -1.769
  182   1HB   LEU  25          2HB       LEU  25  -9.045   7.751  -3.448
  183   2HB   LEU  25          1HB       LEU  25  -8.558   8.887  -2.197
  184    HG   LEU  25           HG       LEU  25  -7.417   6.752  -1.138
  185   1HD1  LEU  25          1HD1      LEU  25  -6.698   5.829  -3.775
  186   2HD1  LEU  25          2HD1      LEU  25  -8.446   5.722  -3.574
  187   3HD1  LEU  25          3HD1      LEU  25  -7.378   4.907  -2.434
  188   1HD2  LEU  25          1HD2      LEU  25  -6.595   8.884  -2.833
  189   2HD2  LEU  25          2HD2      LEU  25  -5.735   7.444  -3.371
  190   3HD2  LEU  25          3HD2      LEU  25  -5.601   7.976  -1.699
  191    H    LEU  26           H        LEU  26  -8.853   5.460  -0.114
  192    HA   LEU  26           HA       LEU  26  -9.514   3.214  -1.831
  193   1HB   LEU  26          2HB       LEU  26  -8.355   3.729   0.865
  194   2HB   LEU  26          1HB       LEU  26  -9.087   2.152   0.635
  195    HG   LEU  26           HG       LEU  26  -7.043   3.327  -1.264
  196   1HD1  LEU  26          1HD1      LEU  26  -6.264   1.030   0.411
  197   2HD1  LEU  26          2HD1      LEU  26  -6.514   2.523   1.316
  198   3HD1  LEU  26          3HD1      LEU  26  -5.350   2.479  -0.007
  199   1HD2  LEU  26          1HD2      LEU  26  -7.129   1.301  -2.391
  200   2HD2  LEU  26          2HD2      LEU  26  -8.799   1.401  -1.834
  201   3HD2  LEU  26          3HD2      LEU  26  -7.636   0.407  -0.958
  202    H    LYS  27           H        LYS  27 -10.703   4.121   1.445
  203    HA   LYS  27           HA       LYS  27 -12.987   2.447   1.508
  204   1HB   LYS  27          2HB       LYS  27 -11.780   4.366   3.083
  205   2HB   LYS  27          1HB       LYS  27 -13.307   5.140   2.659
  206   1HG   LYS  27          2HG       LYS  27 -14.360   2.828   3.290
  207   2HG   LYS  27          1HG       LYS  27 -12.846   2.573   4.158
  208   1HD   LYS  27          2HD       LYS  27 -13.251   4.864   5.234
  209   2HD   LYS  27          1HD       LYS  27 -14.890   4.758   4.589
  210   1HE   LYS  27          2HE       LYS  27 -13.708   2.519   6.250
  211   2HE   LYS  27          1HE       LYS  27 -14.564   3.884   6.992
  212   1HZ   LYS  27          1HZ       LYS  27 -15.674   2.315   4.734
  213   2HZ   LYS  27          2HZ       LYS  27 -16.483   3.445   5.712
  214   3HZ   LYS  27          3HZ       LYS  27 -16.007   1.947   6.356
  215    H    GLN  28           H        GLN  28 -12.593   5.733   0.210
  216    HA   GLN  28           HA       GLN  28 -15.308   6.228  -0.508
  217   1HB   GLN  28          2HB       GLN  28 -13.419   7.862  -0.399
  218   2HB   GLN  28          1HB       GLN  28 -12.760   7.151  -1.872
  219   1HG   GLN  28          2HG       GLN  28 -14.006   8.821  -2.843
  220   2HG   GLN  28          1HG       GLN  28 -15.273   7.599  -2.717
  221   1HE2  GLN  28          1HE2      GLN  28 -14.980  10.786  -2.286
  222   2HE2  GLN  28          2HE2      GLN  28 -15.962  11.027  -0.923
  223    H    GLU  29           H        GLU  29 -12.653   4.754  -2.447
  224    HA   GLU  29           HA       GLU  29 -14.160   4.438  -4.858
  225   1HB   GLU  29          2HB       GLU  29 -11.583   3.987  -4.014
  226   2HB   GLU  29          1HB       GLU  29 -12.176   2.337  -4.192
  227   1HG   GLU  29          2HG       GLU  29 -12.057   4.511  -6.290
  228   2HG   GLU  29          1HG       GLU  29 -11.240   2.955  -6.303
  229    H    GLY  30           H        GLY  30 -13.814   2.425  -1.967
  230   1HA   GLY  30          2HA       GLY  30 -15.363   0.882  -1.101
  231   2HA   GLY  30          1HA       GLY  30 -16.356   1.164  -2.524
  232    H    LYS  31           H        LYS  31 -13.102   0.353  -3.267
  233    HA   LYS  31           HA       LYS  31 -13.981  -2.244  -4.361
  234   1HB   LYS  31          2HB       LYS  31 -11.258  -0.908  -4.330
  235   2HB   LYS  31          1HB       LYS  31 -11.787  -2.187  -5.419
  236   1HG   LYS  31          2HG       LYS  31 -12.740   0.684  -5.320
  237   2HG   LYS  31          1HG       LYS  31 -11.976  -0.155  -6.667
  238   1HD   LYS  31          2HD       LYS  31 -14.715  -0.805  -5.528
  239   2HD   LYS  31          1HD       LYS  31 -14.418   0.089  -7.017
  240   1HE   LYS  31          2HE       LYS  31 -13.947  -1.806  -8.199
  241   2HE   LYS  31          1HE       LYS  31 -13.026  -2.521  -6.862
  242   1HZ   LYS  31          1HZ       LYS  31 -14.974  -3.173  -5.773
  243   2HZ   LYS  31          2HZ       LYS  31 -15.265  -3.569  -7.399
  244   3HZ   LYS  31          3HZ       LYS  31 -15.961  -2.174  -6.722
  245    H    GLU  32           H        GLU  32 -13.984  -3.995  -2.946
  246    HA   GLU  32           HA       GLU  32 -12.485  -4.044  -0.504
  247   1HB   GLU  32          2HB       GLU  32 -13.054  -6.520  -0.593
  248   2HB   GLU  32          1HB       GLU  32 -14.421  -5.410  -0.667
  249   1HG   GLU  32          2HG       GLU  32 -13.364  -5.955  -3.327
  250   2HG   GLU  32          1HG       GLU  32 -13.826  -7.445  -2.506
  251    H    GLY  33           H        GLY  33 -10.289  -3.787  -0.744
  252   1HA   GLY  33          2HA       GLY  33  -8.240  -5.143  -0.848
  253   2HA   GLY  33          1HA       GLY  33  -8.892  -5.874  -2.311
  254    H    GLY  34           H        GLY  34  -9.387  -2.454  -2.003
  255   1HA   GLY  34          2HA       GLY  34  -8.184  -1.740  -4.415
  256   2HA   GLY  34          1HA       GLY  34  -8.333  -0.623  -3.054
  257    H    PHE  35           H        PHE  35  -6.071  -0.920  -4.964
  258    HA   PHE  35           HA       PHE  35  -3.942  -1.458  -2.929
  259   1HB   PHE  35          2HB       PHE  35  -4.344  -3.425  -4.366
  260   2HB   PHE  35          1HB       PHE  35  -4.088  -2.429  -5.797
  261    HD1  PHE  35           1HD      PHE  35  -1.829  -1.236  -6.042
  262    HD2  PHE  35           2HD      PHE  35  -2.521  -4.427  -3.255
  263    HE1  PHE  35           1HE      PHE  35   0.616  -1.641  -5.902
  264    HE2  PHE  35           2HE      PHE  35  -0.078  -4.833  -3.111
  265    HZ   PHE  35           HZ       PHE  35   1.490  -3.440  -4.434
  266    H    ILE  36           H        ILE  36  -2.592   0.280  -2.799
  267    HA   ILE  36           HA       ILE  36  -1.973   1.818  -5.293
  268    HB   ILE  36           HB       ILE  36  -2.407   3.112  -2.590
  269   1HG1  ILE  36          2HG1      ILE  36  -4.439   2.592  -4.780
  270   2HG1  ILE  36          1HG1      ILE  36  -4.535   2.086  -3.096
  271   1HG2  ILE  36          1HG2      ILE  36  -1.142   4.386  -4.256
  272   2HG2  ILE  36          2HG2      ILE  36  -2.721   5.127  -4.011
  273   3HG2  ILE  36          3HG2      ILE  36  -2.422   4.142  -5.443
  274   1HD1  ILE  36          1HD1      ILE  36  -5.712   3.989  -2.743
  275   2HD1  ILE  36          2HD1      ILE  36  -5.236   4.664  -4.301
  276   3HD1  ILE  36          3HD1      ILE  36  -4.173   4.835  -2.904
  277    H    VAL  37           H        VAL  37   0.107   3.103  -4.975
  278    HA   VAL  37           HA       VAL  37   1.819   2.134  -2.750
  279    HB   VAL  37           HB       VAL  37   2.461   1.822  -5.700
  280   1HG1  VAL  37          1HG1      VAL  37   4.469   2.289  -4.404
  281   2HG1  VAL  37          2HG1      VAL  37   4.446   0.573  -4.810
  282   3HG1  VAL  37          3HG1      VAL  37   4.002   1.101  -3.187
  283   1HG2  VAL  37          1HG2      VAL  37   2.440  -0.639  -5.056
  284   2HG2  VAL  37          2HG2      VAL  37   0.859   0.143  -5.057
  285   3HG2  VAL  37          3HG2      VAL  37   1.695  -0.155  -3.533
  286    H    ARG  38           H        ARG  38   3.670   3.505  -2.395
  287    HA   ARG  38           HA       ARG  38   4.014   5.873  -4.148
  288   1HB   ARG  38          2HB       ARG  38   3.703   7.380  -2.164
  289   2HB   ARG  38          1HB       ARG  38   2.231   6.527  -2.624
  290   1HG   ARG  38          2HG       ARG  38   2.156   6.011  -0.399
  291   2HG   ARG  38          1HG       ARG  38   3.289   4.744  -0.863
  292   1HD   ARG  38          2HD       ARG  38   4.253   5.911   1.029
  293   2HD   ARG  38          1HD       ARG  38   5.163   6.421  -0.407
  294    HE   ARG  38           HE       ARG  38   3.308   8.325  -0.434
  295   1HH1  ARG  38          1HH1      ARG  38   2.685   7.260   2.441
  296   2HH1  ARG  38          2HH1      ARG  38   3.485   8.473   3.382
  297   1HH2  ARG  38          1HH2      ARG  38   5.290   9.737   0.704
  298   2HH2  ARG  38          2HH2      ARG  38   4.960   9.875   2.399
  299    H    ASP  39           H        ASP  39   6.021   7.009  -3.694
  300    HA   ASP  39           HA       ASP  39   8.176   5.282  -2.804
  301   1HB   ASP  39          2HB       ASP  39   8.055   7.216  -4.559
  302   2HB   ASP  39          1HB       ASP  39   8.350   8.267  -3.174
  303    H    SER  40           H        SER  40   9.571   5.624  -0.970
  304    HA   SER  40           HA       SER  40   8.201   6.893   1.355
  305   1HB   SER  40          2HB       SER  40   8.999   4.475   1.285
  306   2HB   SER  40          1HB       SER  40  10.645   5.101   1.265
  307    HG   SER  40           HG       SER  40  10.144   4.788   3.382
  308    H    SER  41           H        SER  41  10.799   7.043   2.813
  309    HA   SER  41           HA       SER  41  12.310   9.126   1.331
  310   1HB   SER  41          2HB       SER  41  11.959  10.625   3.392
  311   2HB   SER  41          1HB       SER  41  10.574  10.424   2.323
  312    HG   SER  41           HG       SER  41  10.910   9.673   4.917
  313    H    LYS  42           H        LYS  42  11.915   7.747   4.628
  314    HA   LYS  42           HA       LYS  42  14.588   8.054   5.503
  315   1HB   LYS  42          2HB       LYS  42  12.367   6.090   6.077
  316   2HB   LYS  42          1HB       LYS  42  13.908   5.995   6.930
  317   1HG   LYS  42          2HG       LYS  42  13.374   8.660   7.153
  318   2HG   LYS  42          1HG       LYS  42  11.740   7.995   7.169
  319   1HD   LYS  42          2HD       LYS  42  13.701   6.541   8.842
  320   2HD   LYS  42          1HD       LYS  42  13.320   8.176   9.383
  321   1HE   LYS  42          2HE       LYS  42  10.869   7.590   9.217
  322   2HE   LYS  42          1HE       LYS  42  11.355   5.912   8.898
  323   1HZ   LYS  42          1HZ       LYS  42  12.620   5.901  10.940
  324   2HZ   LYS  42          2HZ       LYS  42  11.010   6.326  11.279
  325   3HZ   LYS  42          3HZ       LYS  42  12.217   7.521  11.244
  326    H    ALA  43           H        ALA  43  13.210   4.910   4.489
  327    HA   ALA  43           HA       ALA  43  15.896   3.918   3.771
  328   1HB   ALA  43          1HB       ALA  43  13.414   2.873   4.644
  329   2HB   ALA  43          2HB       ALA  43  14.873   1.957   4.268
  330   3HB   ALA  43          3HB       ALA  43  13.658   2.232   3.019
  331    H    GLY  44           H        GLY  44  13.252   5.461   2.201
  332   1HA   GLY  44          2HA       GLY  44  13.003   6.065  -0.068
  333   2HA   GLY  44          1HA       GLY  44  14.562   5.288  -0.399
  334    H    LYS  45           H        LYS  45  12.062   3.618   1.353
  335    HA   LYS  45           HA       LYS  45  11.984   1.529  -0.716
  336   1HB   LYS  45          2HB       LYS  45  10.847   0.279   1.051
  337   2HB   LYS  45          1HB       LYS  45  12.264   1.083   1.722
  338   1HG   LYS  45          2HG       LYS  45   9.987   2.857   1.867
  339   2HG   LYS  45          1HG       LYS  45   9.582   1.309   2.607
  340   1HD   LYS  45          2HD       LYS  45  11.870   1.518   3.805
  341   2HD   LYS  45          1HD       LYS  45  11.797   3.217   3.336
  342   1HE   LYS  45          2HE       LYS  45  10.651   3.442   5.314
  343   2HE   LYS  45          1HE       LYS  45   9.277   2.844   4.361
  344   1HZ   LYS  45          1HZ       LYS  45   9.978   0.570   4.908
  345   2HZ   LYS  45          2HZ       LYS  45   9.572   1.457   6.297
  346   3HZ   LYS  45          3HZ       LYS  45  11.203   1.187   5.906
  347    H    TYR  46           H        TYR  46   9.501   0.535  -0.729
  348    HA   TYR  46           HA       TYR  46   7.765   2.834  -1.572
  349   1HB   TYR  46          2HB       TYR  46   7.714  -0.077  -2.434
  350   2HB   TYR  46          1HB       TYR  46   6.777   1.234  -3.140
  351    HD1  TYR  46           1HD      TYR  46   9.345   3.182  -2.746
  352    HD2  TYR  46           2HD      TYR  46   8.617  -0.563  -4.717
  353    HE1  TYR  46           1HE      TYR  46  11.200   3.650  -4.316
  354    HE2  TYR  46           2HE      TYR  46  10.476  -0.095  -6.286
  355    HH   TYR  46           HH       TYR  46  11.835   2.927  -6.676
  356    H    THR  47           H        THR  47   5.504   2.703  -1.001
  357    HA   THR  47           HA       THR  47   4.895   0.776   1.219
  358    HB   THR  47           HB       THR  47   4.014   3.655   0.804
  359    HG1  THR  47           1HG      THR  47   5.726   4.088   1.904
  360   1HG2  THR  47          1HG2      THR  47   3.401   3.048   3.383
  361   2HG2  THR  47          2HG2      THR  47   3.110   1.488   2.615
  362   3HG2  THR  47          3HG2      THR  47   2.248   2.921   2.055
  363    H    VAL  48           H        VAL  48   3.054  -0.446   0.903
  364    HA   VAL  48           HA       VAL  48   1.444   0.149  -1.547
  365    HB   VAL  48           HB       VAL  48   1.833  -2.308   0.184
  366   1HG1  VAL  48          1HG1      VAL  48   0.243  -1.977  -2.377
  367   2HG1  VAL  48          2HG1      VAL  48  -0.442  -2.248  -0.775
  368   3HG1  VAL  48          3HG1      VAL  48   0.535  -3.501  -1.539
  369   1HG2  VAL  48          1HG2      VAL  48   2.610  -1.848  -2.704
  370   2HG2  VAL  48          2HG2      VAL  48   3.139  -3.148  -1.636
  371   3HG2  VAL  48          3HG2      VAL  48   3.702  -1.500  -1.363
  372    H    SER  49           H        SER  49  -0.376   1.311  -1.104
  373    HA   SER  49           HA       SER  49  -1.739   1.047   1.524
  374   1HB   SER  49          2HB       SER  49  -1.836   2.897  -0.854
  375   2HB   SER  49          1HB       SER  49  -3.098   2.951   0.373
  376    HG   SER  49           HG       SER  49  -0.525   3.853   0.447
  377    H    VAL  50           H        VAL  50  -3.149  -0.732   1.548
  378    HA   VAL  50           HA       VAL  50  -4.964  -1.001  -0.831
  379    HB   VAL  50           HB       VAL  50  -4.866  -3.461  -0.348
  380   1HG1  VAL  50          1HG1      VAL  50  -2.178  -3.448  -0.792
  381   2HG1  VAL  50          2HG1      VAL  50  -2.585  -1.783  -1.205
  382   3HG1  VAL  50          3HG1      VAL  50  -3.379  -3.118  -2.038
  383   1HG2  VAL  50          1HG2      VAL  50  -3.730  -4.318   1.435
  384   2HG2  VAL  50          2HG2      VAL  50  -3.926  -2.700   2.106
  385   3HG2  VAL  50          3HG2      VAL  50  -2.426  -3.140   1.294
  386    H    PHE  51           H        PHE  51  -7.189  -1.417  -0.339
  387    HA   PHE  51           HA       PHE  51  -7.866  -1.689   2.569
  388   1HB   PHE  51          2HB       PHE  51  -8.665   0.424   2.574
  389   2HB   PHE  51          1HB       PHE  51  -8.110   0.616   0.917
  390    HD1  PHE  51           1HD      PHE  51 -10.988   0.251   3.076
  391    HD2  PHE  51           2HD      PHE  51  -9.634  -0.139  -0.980
  392    HE1  PHE  51           1HE      PHE  51 -13.335   0.281   2.286
  393    HE2  PHE  51           2HE      PHE  51 -11.979  -0.098  -1.766
  394    HZ   PHE  51           HZ       PHE  51 -13.833   0.108  -0.135
  395    H    ALA  52           H        ALA  52 -10.303  -2.187   2.805
  396    HA   ALA  52           HA       ALA  52 -11.688  -3.314   0.507
  397   1HB   ALA  52          1HB       ALA  52 -11.512  -5.625   1.079
  398   2HB   ALA  52          2HB       ALA  52 -10.772  -5.249   2.635
  399   3HB   ALA  52          3HB       ALA  52  -9.869  -4.987   1.142
  400    H    LYS  53           H        LYS  53 -13.816  -4.205   1.114
  401    HA   LYS  53           HA       LYS  53 -14.798  -3.074   3.717
  402   1HB   LYS  53          2HB       LYS  53 -15.917  -3.478   0.953
  403   2HB   LYS  53          1HB       LYS  53 -17.013  -3.326   2.327
  404   1HG   LYS  53          2HG       LYS  53 -15.342  -1.254   2.835
  405   2HG   LYS  53          1HG       LYS  53 -15.261  -1.287   1.074
  406   1HD   LYS  53          2HD       LYS  53 -17.740  -1.243   0.978
  407   2HD   LYS  53          1HD       LYS  53 -17.791  -1.142   2.738
  408   1HE   LYS  53          2HE       LYS  53 -17.584   1.107   2.579
  409   2HE   LYS  53          1HE       LYS  53 -15.993   0.886   1.822
  410   1HZ   LYS  53          1HZ       LYS  53 -18.629   0.825   0.448
  411   2HZ   LYS  53          2HZ       LYS  53 -17.147   0.459  -0.294
  412   3HZ   LYS  53          3HZ       LYS  53 -17.442   2.026   0.291
  413    H    SER  54           H        SER  54 -13.592  -5.601   3.921
  414    HA   SER  54           HA       SER  54 -15.881  -7.263   4.742
  415   1HB   SER  54          2HB       SER  54 -15.360  -9.085   3.228
  416   2HB   SER  54          1HB       SER  54 -15.538  -7.619   2.267
  417    HG   SER  54           HG       SER  54 -13.286  -7.436   2.239
  418    H    THR  55           H        THR  55 -14.353  -6.479   6.647
  419    HA   THR  55           HA       THR  55 -12.806  -8.795   7.527
  420    HB   THR  55           HB       THR  55 -11.094  -6.413   7.549
  421    HG1  THR  55           1HG      THR  55 -10.686  -6.369   5.389
  422   1HG2  THR  55          1HG2      THR  55 -10.118  -8.469   8.177
  423   2HG2  THR  55          2HG2      THR  55  -9.513  -8.175   6.547
  424   3HG2  THR  55          3HG2      THR  55 -10.832  -9.318   6.805
  425    H    GLY  56           H        GLY  56 -11.214  -6.958   9.368
  426   1HA   GLY  56          2HA       GLY  56 -12.917  -6.844  11.596
  427   2HA   GLY  56          1HA       GLY  56 -11.535  -5.761  11.381
  428    H    ASP  57           H        ASP  57 -12.591  -4.662   8.888
  429    HA   ASP  57           HA       ASP  57 -14.812  -2.958   9.955
  430   1HB   ASP  57          2HB       ASP  57 -12.263  -2.242   9.318
  431   2HB   ASP  57          1HB       ASP  57 -13.046  -2.052   7.749
  432    HA   PRO  58           HA       PRO  58 -16.350  -5.657   6.463
  433   1HB   PRO  58          2HB       PRO  58 -18.957  -4.884   7.411
  434   2HB   PRO  58          1HB       PRO  58 -18.191  -6.474   7.473
  435   1HG   PRO  58          2HG       PRO  58 -18.608  -4.592   9.628
  436   2HG   PRO  58          1HG       PRO  58 -17.969  -6.237   9.712
  437   1HD   PRO  58          2HD       PRO  58 -16.509  -3.845  10.115
  438   2HD   PRO  58          1HD       PRO  58 -15.824  -5.476   9.906
  439    H    GLN  59           H        GLN  59 -16.935  -2.351   7.385
  440    HA   GLN  59           HA       GLN  59 -18.109  -1.805   4.689
  441   1HB   GLN  59          2HB       GLN  59 -18.791   0.362   5.876
  442   2HB   GLN  59          1HB       GLN  59 -19.546  -1.119   6.466
  443   1HG   GLN  59          2HG       GLN  59 -18.365  -1.102   8.442
  444   2HG   GLN  59          1HG       GLN  59 -16.968  -0.302   7.723
  445   1HE2  GLN  59          1HE2      GLN  59 -16.748   1.661   8.835
  446   2HE2  GLN  59          2HE2      GLN  59 -18.013   2.754   9.123
  447    H    GLY  60           H        GLY  60 -15.083  -1.716   6.054
  448   1HA   GLY  60          2HA       GLY  60 -13.915  -0.196   4.031
  449   2HA   GLY  60          1HA       GLY  60 -14.268   0.944   5.319
  450    H    VAL  61           H        VAL  61 -12.149  -1.542   4.249
  451    HA   VAL  61           HA       VAL  61 -10.610  -1.362   6.821
  452    HB   VAL  61           HB       VAL  61 -10.733  -3.541   4.704
  453   1HG1  VAL  61          1HG1      VAL  61  -8.579  -3.732   5.575
  454   2HG1  VAL  61          2HG1      VAL  61  -9.497  -4.784   6.652
  455   3HG1  VAL  61          3HG1      VAL  61  -9.064  -3.154   7.169
  456   1HG2  VAL  61          1HG2      VAL  61 -12.743  -3.296   6.168
  457   2HG2  VAL  61          2HG2      VAL  61 -11.704  -3.569   7.565
  458   3HG2  VAL  61          3HG2      VAL  61 -11.917  -4.841   6.362
  459    H    ILE  62           H        ILE  62  -8.476  -0.805   6.657
  460    HA   ILE  62           HA       ILE  62  -7.258  -0.534   3.956
  461    HB   ILE  62           HB       ILE  62  -6.865   1.759   5.779
  462   1HG1  ILE  62          2HG1      ILE  62  -9.590   1.109   4.612
  463   2HG1  ILE  62          1HG1      ILE  62  -9.199   1.279   6.313
  464   1HG2  ILE  62          1HG2      ILE  62  -6.716   1.133   3.012
  465   2HG2  ILE  62          2HG2      ILE  62  -6.339   2.670   3.788
  466   3HG2  ILE  62          3HG2      ILE  62  -7.967   2.364   3.186
  467   1HD1  ILE  62          1HD1      ILE  62 -10.025   3.371   5.945
  468   2HD1  ILE  62          2HD1      ILE  62  -9.560   3.372   4.243
  469   3HD1  ILE  62          3HD1      ILE  62  -8.346   3.661   5.490
  470    H    ARG  63           H        ARG  63  -4.919  -0.204   4.058
  471    HA   ARG  63           HA       ARG  63  -3.423  -0.252   6.525
  472   1HB   ARG  63          2HB       ARG  63  -4.649  -2.635   5.948
  473   2HB   ARG  63          1HB       ARG  63  -3.089  -2.857   5.156
  474   1HG   ARG  63          2HG       ARG  63  -3.481  -2.021   8.048
  475   2HG   ARG  63          1HG       ARG  63  -3.024  -3.637   7.506
  476   1HD   ARG  63          2HD       ARG  63  -0.939  -2.787   6.559
  477   2HD   ARG  63          1HD       ARG  63  -1.410  -1.120   6.949
  478    HE   ARG  63           HE       ARG  63  -1.633  -2.520   9.360
  479   1HH1  ARG  63          1HH2      ARG  63   0.536  -0.603   7.767
  480   2HH1  ARG  63          2HH2      ARG  63   1.955  -1.198   8.561
  481   1HH2  ARG  63          1HH1      ARG  63   0.314  -3.852  10.074
  482   2HH2  ARG  63          2HH1      ARG  63   1.829  -3.038   9.869
  483    H    HIS  64           H        HIS  64  -1.439   0.580   5.948
  484    HA   HIS  64           HA       HIS  64  -0.666   0.488   3.074
  485   1HB   HIS  64          2HB       HIS  64   0.654   2.025   5.322
  486   2HB   HIS  64          1HB       HIS  64   0.692   2.383   3.597
  487    HD1  HIS  64           1HD      HIS  64  -1.588   3.242   2.523
  488    HD2  HIS  64           2HD      HIS  64  -1.551   3.103   6.686
  489    HE1  HIS  64           1HE      HIS  64  -3.566   4.608   3.298
  490    H    TYR  65           H        TYR  65   0.408  -1.463   2.733
  491    HA   TYR  65           HA       TYR  65   2.298  -2.559   4.696
  492   1HB   TYR  65          2HB       TYR  65   1.879  -3.224   1.774
  493   2HB   TYR  65          1HB       TYR  65   2.596  -4.261   3.000
  494    HD1  TYR  65           1HD      TYR  65   0.070  -4.699   1.139
  495    HD2  TYR  65           2HD      TYR  65   0.582  -3.515   5.239
  496    HE1  TYR  65           1HE      TYR  65  -2.162  -5.625   1.689
  497    HE2  TYR  65           2HE      TYR  65  -1.652  -4.440   5.783
  498    HH   TYR  65           HH       TYR  65  -3.751  -4.972   4.630
  499    H    VAL  66           H        VAL  66   4.380  -1.831   4.830
  500    HA   VAL  66           HA       VAL  66   5.486  -0.352   2.476
  501    HB   VAL  66           HB       VAL  66   6.276  -0.257   5.404
  502   1HG1  VAL  66          1HG1      VAL  66   8.120   0.440   4.055
  503   2HG1  VAL  66          2HG1      VAL  66   7.338   1.928   4.587
  504   3HG1  VAL  66          3HG1      VAL  66   7.071   1.328   2.951
  505   1HG2  VAL  66          1HG2      VAL  66   5.021   2.116   4.198
  506   2HG2  VAL  66          2HG2      VAL  66   4.691   1.339   5.747
  507   3HG2  VAL  66          3HG2      VAL  66   3.937   0.726   4.276
  508    H    VAL  67           H        VAL  67   7.883  -0.585   2.204
  509    HA   VAL  67           HA       VAL  67   8.718  -3.390   2.840
  510    HB   VAL  67           HB       VAL  67   9.449  -1.486   0.597
  511   1HG1  VAL  67          1HG1      VAL  67  10.726  -3.905   1.627
  512   2HG1  VAL  67          2HG1      VAL  67  11.320  -2.741   0.445
  513   3HG1  VAL  67          3HG1      VAL  67  10.272  -4.062  -0.070
  514   1HG2  VAL  67          1HG2      VAL  67   7.615  -2.332  -0.409
  515   2HG2  VAL  67          2HG2      VAL  67   7.292  -3.359   0.986
  516   3HG2  VAL  67          3HG2      VAL  67   8.333  -3.939  -0.314
  517    H    CYS  68           H        CYS  68  10.387  -3.557   4.250
  518    HA   CYS  68           HA       CYS  68  11.943  -1.170   5.003
  519   1HB   CYS  68          2HB       CYS  68  10.999  -2.849   6.626
  520   2HB   CYS  68          1HB       CYS  68  12.089  -4.055   5.942
  521    HG   CYS  68           HG       CYS  68  13.260  -1.449   7.208
  522    H    SER  69           H        SER  69  14.313  -1.173   4.838
  523    HA   SER  69           HA       SER  69  15.381  -3.136   2.841
  524   1HB   SER  69          2HB       SER  69  16.688  -0.945   2.112
  525   2HB   SER  69          1HB       SER  69  15.054  -1.255   1.523
  526    HG   SER  69           HG       SER  69  14.609   0.587   2.426
  527    H    THR  70           H        THR  70  17.319  -3.994   3.403
  528    HA   THR  70           HA       THR  70  18.735  -2.903   5.795
  529    HB   THR  70           HB       THR  70  17.982  -5.268   5.785
  530    HG1  THR  70           1HG      THR  70  20.016  -6.182   6.230
  531   1HG2  THR  70          1HG2      THR  70  19.284  -6.791   4.149
  532   2HG2  THR  70          2HG2      THR  70  19.574  -5.314   3.231
  533   3HG2  THR  70          3HG2      THR  70  17.924  -5.865   3.513
  534    HA   PRO  71           HA       PRO  71  22.019  -1.412   3.281
  535   1HB   PRO  71          2HB       PRO  71  24.130  -2.363   4.990
  536   2HB   PRO  71          1HB       PRO  71  23.447  -0.736   4.903
  537   1HG   PRO  71          2HG       PRO  71  23.144  -2.618   7.018
  538   2HG   PRO  71          1HG       PRO  71  22.357  -1.044   6.864
  539   1HD   PRO  71          2HD       PRO  71  21.193  -3.697   6.537
  540   2HD   PRO  71          1HD       PRO  71  20.367  -2.121   6.578
  541    H    GLN  72           H        GLN  72  21.434  -4.656   3.466
  542    HA   GLN  72           HA       GLN  72  23.935  -5.459   2.064
  543   1HB   GLN  72          2HB       GLN  72  23.055  -6.825   3.919
  544   2HB   GLN  72          1HB       GLN  72  21.513  -6.985   3.087
  545   1HG   GLN  72          2HG       GLN  72  22.963  -8.989   2.797
  546   2HG   GLN  72          1HG       GLN  72  22.589  -8.213   1.262
  547   1HE2  GLN  72          1HE2      GLN  72  24.363  -7.610  -0.022
  548   2HE2  GLN  72          2HE2      GLN  72  25.970  -7.568   0.519
  549    H    SER  73           H        SER  73  21.693  -3.674   0.965
  550    HA   SER  73           HA       SER  73  20.627  -3.374  -1.121
  551   1HB   SER  73          2HB       SER  73  22.969  -4.541  -1.639
  552   2HB   SER  73          1HB       SER  73  21.936  -5.893  -2.094
  553    HG   SER  73           HG       SER  73  21.654  -3.229  -3.041
  554    H    GLN  74           H        GLN  74  19.171  -4.677   0.861
  555    HA   GLN  74           HA       GLN  74  17.586  -6.652  -0.735
  556   1HB   GLN  74          2HB       GLN  74  17.843  -7.096   2.183
  557   2HB   GLN  74          1HB       GLN  74  17.873  -8.266   0.870
  558   1HG   GLN  74          2HG       GLN  74  20.182  -7.298   0.291
  559   2HG   GLN  74          1HG       GLN  74  20.129  -6.530   1.877
  560   1HE2  GLN  74          1HE2      GLN  74  20.581  -9.572   0.201
  561   2HE2  GLN  74          2HE2      GLN  74  20.864 -10.518   1.581
  562    H    TYR  75           H        TYR  75  15.350  -6.940   0.235
  563    HA   TYR  75           HA       TYR  75  14.425  -4.615   1.878
  564   1HB   TYR  75          2HB       TYR  75  13.185  -5.442  -0.759
  565   2HB   TYR  75          1HB       TYR  75  12.758  -4.041   0.215
  566    HD1  TYR  75           1HD      TYR  75  13.964  -2.005   0.054
  567    HD2  TYR  75           2HD      TYR  75  15.483  -5.562  -1.801
  568    HE1  TYR  75           1HE      TYR  75  15.692  -0.666  -1.102
  569    HE2  TYR  75           2HE      TYR  75  17.215  -4.230  -2.953
  570    HH   TYR  75           HH       TYR  75  17.102  -0.854  -3.156
  571    H    TYR  76           H        TYR  76  12.207  -4.939   2.721
  572    HA   TYR  76           HA       TYR  76  10.645  -7.309   2.337
  573   1HB   TYR  76          2HB       TYR  76  11.274  -8.523   4.423
  574   2HB   TYR  76          1HB       TYR  76  12.638  -8.403   3.322
  575    HD1  TYR  76           1HD      TYR  76  11.095  -6.925   6.354
  576    HD2  TYR  76           2HD      TYR  76  14.631  -7.198   3.943
  577    HE1  TYR  76           1HE      TYR  76  12.389  -5.822   8.145
  578    HE2  TYR  76           2HE      TYR  76  15.932  -6.091   5.734
  579    HH   TYR  76           HH       TYR  76  15.134  -4.355   7.779
  580    H    LEU  77           H        LEU  77   8.874  -7.457   3.922
  581    HA   LEU  77           HA       LEU  77   8.350  -4.859   5.325
  582   1HB   LEU  77          2HB       LEU  77   6.783  -6.129   3.610
  583   2HB   LEU  77          1HB       LEU  77   6.423  -7.169   4.988
  584    HG   LEU  77           HG       LEU  77   6.321  -4.257   5.534
  585   1HD1  LEU  77          1HD1      LEU  77   3.975  -5.488   4.109
  586   2HD1  LEU  77          2HD1      LEU  77   5.272  -4.738   3.178
  587   3HD1  LEU  77          3HD1      LEU  77   4.359  -3.783   4.346
  588   1HD2  LEU  77          1HD2      LEU  77   4.954  -6.785   6.333
  589   2HD2  LEU  77          2HD2      LEU  77   4.021  -5.293   6.458
  590   3HD2  LEU  77          3HD2      LEU  77   5.540  -5.459   7.338
  591    H    ALA  78           H        ALA  78   9.503  -7.944   5.718
  592    HA   ALA  78           HA       ALA  78   9.543  -7.810   8.646
  593   1HB   ALA  78          1HB       ALA  78   8.197  -9.678   9.004
  594   2HB   ALA  78          2HB       ALA  78   8.607 -10.390   7.443
  595   3HB   ALA  78          3HB       ALA  78   7.427  -9.083   7.533
  596    H    GLU  79           H        GLU  79  11.691  -8.316   9.050
  597    HA   GLU  79           HA       GLU  79  13.608  -9.020   7.160
  598   1HB   GLU  79          2HB       GLU  79  13.309  -9.281  10.123
  599   2HB   GLU  79          1HB       GLU  79  14.695 -10.075   9.372
  600   1HG   GLU  79          2HG       GLU  79  15.214  -7.895   8.216
  601   2HG   GLU  79          1HG       GLU  79  13.958  -7.145   9.202
  602    H    LYS  80           H        LYS  80  11.214 -11.090   8.517
  603    HA   LYS  80           HA       LYS  80  12.236 -13.666   8.537
  604   1HB   LYS  80          2HB       LYS  80   9.695 -12.332   7.843
  605   2HB   LYS  80          1HB       LYS  80   9.859 -13.962   7.189
  606   1HG   LYS  80          2HG       LYS  80  10.628 -13.520  10.044
  607   2HG   LYS  80          1HG       LYS  80   8.909 -13.551   9.647
  608   1HD   LYS  80          2HD       LYS  80   9.015 -15.759   8.820
  609   2HD   LYS  80          1HD       LYS  80  10.770 -15.704   8.650
  610   1HE   LYS  80          2HE       LYS  80  11.129 -16.195  10.867
  611   2HE   LYS  80          1HE       LYS  80   9.702 -15.282  11.401
  612   1HZ   LYS  80          1HZ       LYS  80   8.290 -16.993  10.440
  613   2HZ   LYS  80          2HZ       LYS  80   9.331 -17.670  11.600
  614   3HZ   LYS  80          3HZ       LYS  80   9.652 -17.874   9.944
  615    H    HIS  81           H        HIS  81  11.425 -11.724   5.663
  616    HA   HIS  81           HA       HIS  81  13.203 -13.422   4.006
  617   1HB   HIS  81          2HB       HIS  81  10.226 -13.038   3.537
  618   2HB   HIS  81          1HB       HIS  81  11.329 -13.747   2.357
  619    HD1  HIS  81           1HD      HIS  81  12.829 -15.842   3.511
  620    HD2  HIS  81           2HD      HIS  81   9.084 -14.977   5.125
  621    HE1  HIS  81           1HE      HIS  81  12.119 -17.895   4.813
  622    H    LEU  82           H        LEU  82  14.125 -12.133   2.353
  623    HA   LEU  82           HA       LEU  82  12.811  -9.550   1.746
  624   1HB   LEU  82          2HB       LEU  82  14.829  -8.321   2.382
  625   2HB   LEU  82          1HB       LEU  82  14.288  -9.296   3.744
  626    HG   LEU  82           HG       LEU  82  16.358 -10.265   1.785
  627   1HD1  LEU  82          1HD1      LEU  82  16.708  -8.054   3.377
  628   2HD1  LEU  82          2HD1      LEU  82  18.010  -9.124   2.862
  629   3HD1  LEU  82          3HD1      LEU  82  17.262  -9.346   4.441
  630   1HD2  LEU  82          1HD2      LEU  82  15.971 -12.155   2.998
  631   2HD2  LEU  82          2HD2      LEU  82  15.080 -11.271   4.237
  632   3HD2  LEU  82          3HD2      LEU  82  16.841 -11.340   4.297
  633    H    PHE  83           H        PHE  83  13.234  -8.823  -0.320
  634    HA   PHE  83           HA       PHE  83  14.997 -10.547  -2.019
  635   1HB   PHE  83          2HB       PHE  83  12.435  -9.026  -2.367
  636   2HB   PHE  83          1HB       PHE  83  13.468  -9.250  -3.783
  637    HD1  PHE  83           1HD      PHE  83  13.216 -11.194  -5.040
  638    HD2  PHE  83           2HD      PHE  83  12.103 -11.219  -0.892
  639    HE1  PHE  83           1HE      PHE  83  12.400 -13.525  -5.274
  640    HE2  PHE  83           2HE      PHE  83  11.286 -13.549  -1.125
  641    HZ   PHE  83           HZ       PHE  83  11.434 -14.702  -3.316
  642    H    SER  84           H        SER  84  15.261  -8.745  -4.178
  643    HA   SER  84           HA       SER  84  17.093  -6.734  -2.957
  644   1HB   SER  84          2HB       SER  84  17.451  -8.589  -4.902
  645   2HB   SER  84          1HB       SER  84  16.974  -7.212  -5.892
  646    HG   SER  84           HG       SER  84  19.059  -7.305  -3.961
  647    H    THR  85           H        THR  85  13.930  -6.714  -3.854
  648    HA   THR  85           HA       THR  85  13.876  -3.824  -4.250
  649    HB   THR  85           HB       THR  85  12.820  -5.434  -6.571
  650    HG1  THR  85           1HG      THR  85  14.863  -6.043  -6.742
  651   1HG2  THR  85          1HG2      THR  85  12.383  -3.391  -7.389
  652   2HG2  THR  85          2HG2      THR  85  14.058  -2.892  -7.153
  653   3HG2  THR  85          3HG2      THR  85  12.892  -2.714  -5.842
  654    H    ILE  86           H        ILE  86  11.609  -3.021  -4.355
  655    HA   ILE  86           HA       ILE  86   9.802  -4.529  -2.711
  656    HB   ILE  86           HB       ILE  86   9.697  -2.046  -4.399
  657   1HG1  ILE  86          2HG1      ILE  86   8.907  -1.469  -1.827
  658   2HG1  ILE  86          1HG1      ILE  86  10.023  -2.809  -1.581
  659   1HG2  ILE  86          1HG2      ILE  86   7.367  -3.282  -2.896
  660   2HG2  ILE  86          2HG2      ILE  86   7.456  -3.013  -4.636
  661   3HG2  ILE  86          3HG2      ILE  86   7.392  -1.638  -3.535
  662   1HD1  ILE  86          1HD1      ILE  86  11.669  -1.268  -1.733
  663   2HD1  ILE  86          2HD1      ILE  86  10.581  -0.058  -2.412
  664   3HD1  ILE  86          3HD1      ILE  86  11.333  -1.257  -3.464
  665    HA   PRO  87           HA       PRO  87   7.257  -5.219  -6.845
  666   1HB   PRO  87          2HB       PRO  87   9.232  -5.346  -8.937
  667   2HB   PRO  87          1HB       PRO  87   7.862  -4.240  -8.798
  668   1HG   PRO  87          2HG       PRO  87  10.673  -3.684  -8.383
  669   2HG   PRO  87          1HG       PRO  87   9.315  -2.554  -8.386
  670   1HD   PRO  87          2HD       PRO  87  10.830  -3.362  -6.131
  671   2HD   PRO  87          1HD       PRO  87   9.314  -2.436  -6.109
  672    H    GLU  88           H        GLU  88  10.650  -6.282  -6.611
  673    HA   GLU  88           HA       GLU  88  10.268  -8.958  -7.579
  674   1HB   GLU  88          2HB       GLU  88  12.398  -7.521  -7.078
  675   2HB   GLU  88          1HB       GLU  88  12.237  -8.152  -5.439
  676   1HG   GLU  88          2HG       GLU  88  13.678  -9.687  -6.538
  677   2HG   GLU  88          1HG       GLU  88  12.102 -10.478  -6.523
  678    H    LEU  89           H        LEU  89  10.013  -7.474  -4.365
  679    HA   LEU  89           HA       LEU  89   9.581  -9.892  -2.859
  680   1HB   LEU  89          2HB       LEU  89   9.687  -7.049  -2.496
  681   2HB   LEU  89          1HB       LEU  89   8.204  -7.633  -1.743
  682    HG   LEU  89           HG       LEU  89  10.796  -9.079  -1.274
  683   1HD1  LEU  89          1HD1      LEU  89  11.320  -7.655   0.581
  684   2HD1  LEU  89          2HD1      LEU  89   9.801  -6.777   0.424
  685   3HD1  LEU  89          3HD1      LEU  89  11.060  -6.589  -0.797
  686   1HD2  LEU  89          1HD2      LEU  89   8.573  -8.610   0.694
  687   2HD2  LEU  89          2HD2      LEU  89   9.673  -9.983   0.565
  688   3HD2  LEU  89          3HD2      LEU  89   8.353  -9.799  -0.591
  689    H    ILE  90           H        ILE  90   7.240  -7.417  -3.998
  690    HA   ILE  90           HA       ILE  90   4.848  -8.690  -3.251
  691    HB   ILE  90           HB       ILE  90   5.517  -7.031  -5.705
  692   1HG1  ILE  90          2HG1      ILE  90   4.154  -5.947  -3.279
  693   2HG1  ILE  90          1HG1      ILE  90   5.882  -6.278  -3.155
  694   1HG2  ILE  90          1HG2      ILE  90   2.917  -7.905  -4.462
  695   2HG2  ILE  90          2HG2      ILE  90   3.378  -7.887  -6.165
  696   3HG2  ILE  90          3HG2      ILE  90   3.015  -6.375  -5.333
  697   1HD1  ILE  90          1HD1      ILE  90   4.595  -4.595  -5.324
  698   2HD1  ILE  90          2HD1      ILE  90   6.324  -4.878  -5.112
  699   3HD1  ILE  90          3HD1      ILE  90   5.428  -3.951  -3.909
  700    H    ASN  91           H        ASN  91   6.602  -9.021  -6.361
  701    HA   ASN  91           HA       ASN  91   4.845 -10.920  -7.563
  702   1HB   ASN  91          2HB       ASN  91   7.086  -9.523  -8.253
  703   2HB   ASN  91          1HB       ASN  91   7.758 -11.144  -8.076
  704   1HD2  ASN  91          1HD2      ASN  91   6.472  -9.154 -10.382
  705   2HD2  ASN  91          2HD2      ASN  91   5.795 -10.313 -11.422
  706    H    TYR  92           H        TYR  92   7.672 -11.339  -5.447
  707    HA   TYR  92           HA       TYR  92   7.749 -14.218  -5.572
  708   1HB   TYR  92          2HB       TYR  92   9.707 -13.589  -4.624
  709   2HB   TYR  92          1HB       TYR  92   9.070 -11.990  -4.261
  710    HD1  TYR  92           1HD      TYR  92   8.669 -11.362  -2.038
  711    HD2  TYR  92           2HD      TYR  92   8.984 -15.525  -3.038
  712    HE1  TYR  92           1HE      TYR  92   8.571 -11.944   0.368
  713    HE2  TYR  92           2HE      TYR  92   8.886 -16.111  -0.631
  714    HH   TYR  92           HH       TYR  92   9.283 -15.111   1.520
  715    H    HIS  93           H        HIS  93   5.703 -11.981  -3.875
  716    HA   HIS  93           HA       HIS  93   4.942 -13.742  -1.692
  717   1HB   HIS  93          2HB       HIS  93   4.792 -11.259  -1.686
  718   2HB   HIS  93          1HB       HIS  93   3.557 -11.347  -2.942
  719    HD1  HIS  93           1HD      HIS  93   3.221 -14.111  -0.593
  720    HD2  HIS  93           2HD      HIS  93   1.902 -10.158  -0.746
  721    HE1  HIS  93           1HE      HIS  93   1.338 -13.919   1.089
  722    H    GLN  94           H        GLN  94   3.427 -12.859  -4.816
  723    HA   GLN  94           HA       GLN  94   1.157 -14.646  -4.431
  724   1HB   GLN  94          2HB       GLN  94   2.214 -12.718  -6.389
  725   2HB   GLN  94          1HB       GLN  94   1.341 -14.061  -7.127
  726   1HG   GLN  94          2HG       GLN  94  -0.558 -12.949  -6.629
  727   2HG   GLN  94          1HG       GLN  94  -0.244 -13.354  -4.941
  728   1HE2  GLN  94          1HE2      GLN  94  -1.306 -10.790  -6.405
  729   2HE2  GLN  94          2HE2      GLN  94  -0.389  -9.546  -5.704
  730    H    HIS  95           H        HIS  95   3.443 -14.728  -7.168
  731    HA   HIS  95           HA       HIS  95   4.344 -16.572  -8.342
  732   1HB   HIS  95          2HB       HIS  95   4.742 -16.880  -5.440
  733   2HB   HIS  95          1HB       HIS  95   4.886 -18.393  -6.336
  734    HD1  HIS  95           1HD      HIS  95   5.944 -14.866  -7.338
  735    HD2  HIS  95           2HD      HIS  95   7.607 -18.647  -6.771
  736    HE1  HIS  95           1HE      HIS  95   8.371 -14.692  -8.037
  737    H    ASN  96           H        ASN  96   1.372 -16.537  -7.819
  738    HA   ASN  96           HA       ASN  96   0.526 -19.266  -7.282
  739   1HB   ASN  96          2HB       ASN  96  -0.796 -17.142  -6.960
  740   2HB   ASN  96          1HB       ASN  96  -0.909 -17.009  -8.716
  741   1HD2  ASN  96          1HD2      ASN  96  -1.571 -19.420  -6.108
  742   2HD2  ASN  96          2HD2      ASN  96  -2.952 -20.064  -6.856
  743    H    SER  97           H        SER  97  -0.573 -20.630  -8.939
  744    HA   SER  97           HA       SER  97   0.983 -20.711 -11.446
  745   1HB   SER  97          2HB       SER  97  -1.225 -22.493 -10.367
  746   2HB   SER  97          1HB       SER  97  -0.102 -22.896 -11.663
  747    HG   SER  97           HG       SER  97   0.218 -23.234  -9.067
  748    H    ALA  98           H        ALA  98  -0.952 -21.837 -13.153
  749    HA   ALA  98           HA       ALA  98  -2.215 -19.515 -14.268
  750   1HB   ALA  98          1HB       ALA  98  -3.097 -22.353 -14.763
  751   2HB   ALA  98          2HB       ALA  98  -1.490 -21.826 -15.262
  752   3HB   ALA  98          3HB       ALA  98  -2.921 -21.034 -15.922
  753    H    GLY  99           H        GLY  99  -3.471 -18.645 -12.449
  754   1HA   GLY  99          2HA       GLY  99  -6.034 -20.133 -12.034
  755   2HA   GLY  99          1HA       GLY  99  -5.236 -19.290 -10.705
  756    H    LEU 100           H        LEU 100  -4.481 -16.914 -11.837
  757    HA   LEU 100           HA       LEU 100  -7.117 -15.698 -12.581
  758   1HB   LEU 100          2HB       LEU 100  -5.124 -15.163 -10.595
  759   2HB   LEU 100          1HB       LEU 100  -5.161 -13.794 -11.703
  760    HG   LEU 100           HG       LEU 100  -6.765 -13.500  -9.838
  761   1HD1  LEU 100          1HD1      LEU 100  -8.754 -13.017 -11.231
  762   2HD1  LEU 100          2HD1      LEU 100  -8.064 -13.979 -12.537
  763   3HD1  LEU 100          3HD1      LEU 100  -7.268 -12.492 -12.024
  764   1HD2  LEU 100          1HD2      LEU 100  -8.460 -15.700 -10.972
  765   2HD2  LEU 100          2HD2      LEU 100  -8.446 -15.028  -9.342
  766   3HD2  LEU 100          3HD2      LEU 100  -7.161 -16.122  -9.856
  767    H    ILE 101           H        ILE 101  -6.032 -13.207 -13.416
  768    HA   ILE 101           HA       ILE 101  -4.211 -13.848 -15.684
  769    HB   ILE 101           HB       ILE 101  -6.533 -14.239 -16.430
  770   1HG1  ILE 101          2HG1      ILE 101  -5.739 -11.598 -17.633
  771   2HG1  ILE 101          1HG1      ILE 101  -4.695 -13.005 -17.843
  772   1HG2  ILE 101          1HG2      ILE 101  -7.015 -11.316 -15.797
  773   2HG2  ILE 101          2HG2      ILE 101  -7.533 -12.635 -14.748
  774   3HG2  ILE 101          3HG2      ILE 101  -8.193 -12.492 -16.377
  775   1HD1  ILE 101          1HD1      ILE 101  -7.044 -14.145 -18.468
  776   2HD1  ILE 101          2HD1      ILE 101  -6.054 -13.321 -19.672
  777   3HD1  ILE 101          3HD1      ILE 101  -7.419 -12.485 -18.932
  778    H    SER 102           H        SER 102  -4.438 -12.053 -13.105
  779    HA   SER 102           HA       SER 102  -2.947  -9.805 -14.186
  780   1HB   SER 102          2HB       SER 102  -5.165  -9.140 -14.912
  781   2HB   SER 102          1HB       SER 102  -5.835  -9.471 -13.317
  782    HG   SER 102           HG       SER 102  -4.888  -7.697 -12.536
  783    H    ARG 103           H        ARG 103  -1.762  -8.871 -12.520
  784    HA   ARG 103           HA       ARG 103  -2.055 -10.018  -9.821
  785   1HB   ARG 103          2HB       ARG 103   0.033  -9.262 -11.411
  786   2HB   ARG 103          1HB       ARG 103  -0.121  -7.843 -10.375
  787   1HG   ARG 103          2HG       ARG 103   0.964  -8.959  -8.750
  788   2HG   ARG 103          1HG       ARG 103  -0.383 -10.095  -8.676
  789   1HD   ARG 103          2HD       ARG 103   1.976 -10.326 -10.583
  790   2HD   ARG 103          1HD       ARG 103   1.755 -11.284  -9.105
  791    HE   ARG 103           HE       ARG 103  -0.285 -11.305 -11.298
  792   1HH1  ARG 103          1HH1      ARG 103   2.316 -13.087 -10.275
  793   2HH1  ARG 103          2HH1      ARG 103   1.446 -14.554  -9.979
  794   1HH2  ARG 103          1HH2      ARG 103  -1.676 -13.090 -10.353
  795   2HH2  ARG 103          2HH2      ARG 103  -0.815 -14.556 -10.022
  796    H    LEU 104           H        LEU 104  -1.383  -8.027  -8.118
  797    HA   LEU 104           HA       LEU 104  -2.286  -6.219  -6.895
  798   1HB   LEU 104          2HB       LEU 104  -1.400  -5.158  -9.027
  799   2HB   LEU 104          1HB       LEU 104  -3.044  -5.234  -9.662
  800    HG   LEU 104           HG       LEU 104  -2.774  -4.050  -6.957
  801   1HD1  LEU 104          1HD1      LEU 104  -0.805  -3.070  -8.002
  802   2HD1  LEU 104          2HD1      LEU 104  -2.078  -1.852  -7.930
  803   3HD1  LEU 104          3HD1      LEU 104  -1.732  -2.674  -9.450
  804   1HD2  LEU 104          1HD2      LEU 104  -4.759  -4.252  -8.811
  805   2HD2  LEU 104          2HD2      LEU 104  -4.118  -2.658  -9.206
  806   3HD2  LEU 104          3HD2      LEU 104  -4.707  -2.993  -7.578
  807    H    LYS 105           H        LYS 105  -4.438  -5.001  -6.526
  808    HA   LYS 105           HA       LYS 105  -6.692  -6.882  -7.093
  809   1HB   LYS 105          2HB       LYS 105  -5.876  -5.046  -4.884
  810   2HB   LYS 105          1HB       LYS 105  -7.603  -5.310  -5.127
  811   1HG   LYS 105          2HG       LYS 105  -5.785  -7.690  -5.107
  812   2HG   LYS 105          1HG       LYS 105  -6.199  -6.932  -3.569
  813   1HD   LYS 105          2HD       LYS 105  -8.649  -7.042  -4.801
  814   2HD   LYS 105          1HD       LYS 105  -7.887  -8.517  -5.396
  815   1HE   LYS 105          2HE       LYS 105  -7.650  -7.894  -2.470
  816   2HE   LYS 105          1HE       LYS 105  -9.187  -8.538  -3.080
  817   1HZ   LYS 105          1HZ       LYS 105  -7.514 -10.272  -2.466
  818   2HZ   LYS 105          2HZ       LYS 105  -6.542  -9.710  -3.740
  819   3HZ   LYS 105          3HZ       LYS 105  -8.073 -10.371  -4.064
  820    H    TYR 106           H        TYR 106  -6.783  -3.402  -6.226
  821    HA   TYR 106           HA       TYR 106  -8.211  -2.923  -8.822
  822   1HB   TYR 106          2HB       TYR 106  -9.747  -3.170  -6.879
  823   2HB   TYR 106          1HB       TYR 106  -8.914  -1.836  -6.080
  824    HD1  TYR 106           1HD      TYR 106  -8.797   0.408  -7.279
  825    HD2  TYR 106           2HD      TYR 106 -11.455  -2.744  -8.460
  826    HE1  TYR 106           1HE      TYR 106 -10.169   2.046  -8.542
  827    HE2  TYR 106           2HE      TYR 106 -12.830  -1.112  -9.725
  828    HH   TYR 106           HH       TYR 106 -11.875   1.718 -10.716
  829    HA   PRO 107           HA       PRO 107  -4.878   0.129  -8.882
  830   1HB   PRO 107          2HB       PRO 107  -5.862   0.989 -11.435
  831   2HB   PRO 107          1HB       PRO 107  -4.437   0.004 -11.090
  832   1HG   PRO 107          2HG       PRO 107  -6.876  -0.843 -12.306
  833   2HG   PRO 107          1HG       PRO 107  -5.486  -1.843 -11.871
  834   1HD   PRO 107          2HD       PRO 107  -8.093  -1.715 -10.583
  835   2HD   PRO 107          1HD       PRO 107  -6.741  -2.822 -10.240
  836    H    VAL 108           H        VAL 108  -5.870   1.485  -7.242
  837    HA   VAL 108           HA       VAL 108  -7.533   3.699  -8.379
  838    HB   VAL 108           HB       VAL 108  -8.668   2.127  -6.774
  839   1HG1  VAL 108          1HG1      VAL 108  -6.689   3.268  -4.785
  840   2HG1  VAL 108          2HG1      VAL 108  -6.642   1.624  -5.420
  841   3HG1  VAL 108          3HG1      VAL 108  -8.000   2.146  -4.424
  842   1HG2  VAL 108          1HG2      VAL 108  -9.245   4.070  -5.084
  843   2HG2  VAL 108          2HG2      VAL 108  -9.702   4.217  -6.781
  844   3HG2  VAL 108          3HG2      VAL 108  -8.262   5.040  -6.182
  845    H    SER 109           H        SER 109  -6.861   5.864  -7.644
  846    HA   SER 109           HA       SER 109  -4.273   5.874  -6.125
  847   1HB   SER 109          2HB       SER 109  -4.869   7.962  -8.172
  848   2HB   SER 109          1HB       SER 109  -3.326   7.224  -7.741
  849    HG   SER 109           HG       SER 109  -4.278   6.617  -9.829
  850    H    GLN 110           H        GLN 110  -4.000   8.618  -6.055
  851    HA   GLN 110           HA       GLN 110  -5.142   9.595  -3.800
  852   1HB   GLN 110          2HB       GLN 110  -5.006  11.846  -5.011
  853   2HB   GLN 110          1HB       GLN 110  -3.552  10.850  -5.079
  854   1HG   GLN 110          2HG       GLN 110  -4.801   9.903  -7.269
  855   2HG   GLN 110          1HG       GLN 110  -5.481  11.529  -7.245
  856   1HE2  GLN 110          1HE2      GLN 110  -2.200  10.275  -6.394
  857   2HE2  GLN 110          2HE2      GLN 110  -1.367  11.333  -7.428
  858    H    GLN 111           H        GLN 111  -6.775   9.502  -6.962
  859    HA   GLN 111           HA       GLN 111  -9.384   9.672  -5.661
  860   1HB   GLN 111          2HB       GLN 111  -9.990  11.762  -6.884
  861   2HB   GLN 111          1HB       GLN 111  -8.677  12.013  -5.729
  862   1HG   GLN 111          2HG       GLN 111  -7.383  12.781  -7.398
  863   2HG   GLN 111          1HG       GLN 111  -7.479  11.205  -8.179
  864   1HE2  GLN 111          1HE2      GLN 111  -7.564  14.008  -9.382
  865   2HE2  GLN 111          2HE2      GLN 111  -8.990  14.035 -10.302
  866    H    ASN 112           H        ASN 112 -10.354   8.030  -6.736
  867    HA   ASN 112           HA       ASN 112 -10.900   8.186  -9.566
  868   1HB   ASN 112          2HB       ASN 112  -8.569   6.698  -8.540
  869   2HB   ASN 112          1HB       ASN 112  -9.611   5.746  -9.598
  870   1HD2  ASN 112          1HD2      ASN 112  -7.034   7.934  -9.630
  871   2HD2  ASN 112          2HD2      ASN 112  -7.164   8.455 -11.241
  872    H    LYS 113           H        LYS 113 -12.818   8.051  -7.825
  873    HA   LYS 113           HA       LYS 113 -13.466   5.359  -6.879
  874   1HB   LYS 113          2HB       LYS 113 -15.290   7.765  -7.103
  875   2HB   LYS 113          1HB       LYS 113 -15.377   6.449  -5.935
  876   1HG   LYS 113          2HG       LYS 113 -13.191   8.551  -6.098
  877   2HG   LYS 113          1HG       LYS 113 -14.446   8.451  -4.868
  878   1HD   LYS 113          2HD       LYS 113 -13.380   6.792  -3.735
  879   2HD   LYS 113          1HD       LYS 113 -12.875   5.972  -5.208
  880   1HE   LYS 113          2HE       LYS 113 -11.440   8.415  -5.161
  881   2HE   LYS 113          1HE       LYS 113 -11.330   7.739  -3.527
  882   1HZ   LYS 113          1HZ       LYS 113 -10.599   5.672  -4.374
  883   2HZ   LYS 113          2HZ       LYS 113  -9.656   6.853  -5.150
  884   3HZ   LYS 113          3HZ       LYS 113 -10.943   6.113  -5.975
  885    H    ASN 114           H        ASN 114 -13.339   4.320  -9.072
  886    HA   ASN 114           HA       ASN 114 -15.450   5.023 -11.011
  887   1HB   ASN 114          2HB       ASN 114 -12.902   3.722 -10.962
  888   2HB   ASN 114          1HB       ASN 114 -14.084   2.602 -11.634
  889   1HD2  ASN 114          1HD2      ASN 114 -14.317   2.825 -13.856
  890   2HD2  ASN 114          2HD2      ASN 114 -14.107   4.270 -14.722
  891    H    ALA 115           H        ALA 115 -14.469   1.927  -9.487
  892    HA   ALA 115           HA       ALA 115 -15.778   0.074  -8.823
  893   1HB   ALA 115          1HB       ALA 115 -17.717   0.712  -7.510
  894   2HB   ALA 115          2HB       ALA 115 -17.820   2.264  -8.341
  895   3HB   ALA 115          3HB       ALA 115 -16.468   1.932  -7.258
  896    HA   PRO 116           HA       PRO 116 -17.867   0.056 -12.978
  897   1HB   PRO 116          2HB       PRO 116 -17.128  -2.724 -13.086
  898   2HB   PRO 116          1HB       PRO 116 -16.494  -1.391 -14.056
  899   1HG   PRO 116          2HG       PRO 116 -15.176  -2.817 -11.937
  900   2HG   PRO 116          1HG       PRO 116 -14.538  -1.497 -12.921
  901   1HD   PRO 116          2HD       PRO 116 -15.302  -1.411 -10.148
  902   2HD   PRO 116          1HD       PRO 116 -14.704  -0.068 -11.155
  903    H    SER 117           H        SER 117 -17.895  -2.424 -10.406
  904    HA   SER 117           HA       SER 117 -19.670  -3.714  -9.525
  905   1HB   SER 117          2HB       SER 117 -20.858  -1.073 -10.351
  906   2HB   SER 117          1HB       SER 117 -21.881  -2.317  -9.638
  907    HG   SER 117           HG       SER 117 -21.122  -1.644  -7.806
  908    H    THR 118           H        THR 118 -19.690  -5.447 -11.057
  909    HA   THR 118           HA       THR 118 -21.799  -5.213 -13.180
  910    HB   THR 118           HB       THR 118 -20.297  -6.760 -14.485
  911    HG1  THR 118           1HG      THR 118 -19.085  -7.654 -12.879
  912   1HG2  THR 118          1HG2      THR 118 -20.199  -4.412 -14.999
  913   2HG2  THR 118          2HG2      THR 118 -18.537  -4.998 -14.927
  914   3HG2  THR 118          3HG2      THR 118 -19.211  -4.086 -13.577
  Start of MODEL    2
    1    H    THR   1           1H       THR   1   9.951 -11.555 -12.451
    2    HA   THR   1           HA       THR   1  11.590  -9.791 -12.798
    3    HB   THR   1           HB       THR   1  10.182  -8.105 -11.386
    4    HG1  THR   1           1HG      THR   1   8.893  -8.971  -9.997
    5   1HG2  THR   1          1HG2      THR   1   8.056  -9.082 -12.763
    6   2HG2  THR   1          2HG2      THR   1   9.373  -9.934 -13.570
    7   3HG2  THR   1          3HG2      THR   1   9.367  -8.172 -13.515
    8    H    GLU   2           H        GLU   2  13.270  -8.552 -11.932
    9    HA   GLU   2           HA       GLU   2  13.878  -8.919  -9.016
   10   1HB   GLU   2          2HB       GLU   2  16.264  -9.101  -9.726
   11   2HB   GLU   2          1HB       GLU   2  15.268 -10.386 -10.410
   12   1HG   GLU   2          2HG       GLU   2  15.132  -9.240 -12.535
   13   2HG   GLU   2          1HG       GLU   2  15.927  -7.812 -11.869
   14    H    ALA   3           H        ALA   3  12.728  -6.671 -10.864
   15    HA   ALA   3           HA       ALA   3  14.009  -4.455  -9.494
   16   1HB   ALA   3          1HB       ALA   3  14.488  -4.011 -12.324
   17   2HB   ALA   3          2HB       ALA   3  15.290  -5.486 -11.784
   18   3HB   ALA   3          3HB       ALA   3  15.635  -3.952 -10.986
   19    H    GLU   4           H        GLU   4  13.401  -2.386 -11.216
   20    HA   GLU   4           HA       GLU   4  10.815  -2.646 -12.501
   21   1HB   GLU   4          2HB       GLU   4   9.584  -1.365 -10.707
   22   2HB   GLU   4          1HB       GLU   4  10.092  -2.976 -10.202
   23   1HG   GLU   4          2HG       GLU   4  11.372  -2.127  -8.555
   24   2HG   GLU   4          1HG       GLU   4  12.200  -1.056  -9.685
   25    H    ASP   5           H        ASP   5  12.877  -1.460 -13.649
   26    HA   ASP   5           HA       ASP   5  12.925   1.430 -12.982
   27   1HB   ASP   5          2HB       ASP   5  14.713  -0.528 -14.024
   28   2HB   ASP   5          1HB       ASP   5  14.499   0.709 -15.260
   29    H    SER   6           H        SER   6  10.432   0.506 -14.022
   30    HA   SER   6           HA       SER   6  10.458   1.607 -16.815
   31   1HB   SER   6          2HB       SER   6   8.447  -0.228 -15.479
   32   2HB   SER   6          1HB       SER   6   8.538   0.169 -17.193
   33    HG   SER   6           HG       SER   6  10.692  -0.774 -17.110
   34    H    ILE   7           H        ILE   7   7.834   2.225 -17.154
   35    HA   ILE   7           HA       ILE   7   7.475   4.541 -15.355
   36    HB   ILE   7           HB       ILE   7   6.007   3.565 -17.831
   37   1HG1  ILE   7          2HG1      ILE   7   7.940   5.877 -17.605
   38   2HG1  ILE   7          1HG1      ILE   7   8.491   4.243 -17.980
   39   1HG2  ILE   7          1HG2      ILE   7   5.958   6.414 -16.976
   40   2HG2  ILE   7          2HG2      ILE   7   4.985   5.294 -16.024
   41   3HG2  ILE   7          3HG2      ILE   7   4.703   5.454 -17.757
   42   1HD1  ILE   7          1HD1      ILE   7   7.007   4.167 -19.933
   43   2HD1  ILE   7          2HD1      ILE   7   8.077   5.564 -20.039
   44   3HD1  ILE   7          3HD1      ILE   7   6.397   5.776 -19.549
   45    H    GLU   8           H        GLU   8   4.875   2.540 -16.736
   46    HA   GLU   8           HA       GLU   8   2.965   1.595 -15.723
   47   1HB   GLU   8          2HB       GLU   8   5.034   1.210 -13.534
   48   2HB   GLU   8          1HB       GLU   8   3.506   0.339 -13.651
   49   1HG   GLU   8          2HG       GLU   8   4.275  -0.359 -16.004
   50   2HG   GLU   8          1HG       GLU   8   5.876   0.203 -15.517
   51    H    MET   9           H        MET   9   1.438   3.165 -15.257
   52    HA   MET   9           HA       MET   9   1.423   4.295 -12.550
   53   1HB   MET   9          2HB       MET   9   1.072   6.622 -13.634
   54   2HB   MET   9          1HB       MET   9   2.711   5.982 -13.596
   55   1HG   MET   9          2HG       MET   9   2.515   6.708 -15.813
   56   2HG   MET   9          1HG       MET   9   2.109   5.002 -15.954
   57   1HE   MET   9          1HE       MET   9   0.677   4.226 -17.101
   58   2HE   MET   9          2HE       MET   9  -0.777   4.905 -17.827
   59   3HE   MET   9          3HE       MET   9  -0.847   4.225 -16.203
   60    H    TYR  10           H        TYR  10  -0.313   2.422 -13.889
   61    HA   TYR  10           HA       TYR  10  -2.642   3.433 -15.083
   62   1HB   TYR  10          2HB       TYR  10  -2.175   1.205 -13.083
   63   2HB   TYR  10          1HB       TYR  10  -3.700   1.417 -13.941
   64    HD1  TYR  10           1HD      TYR  10  -3.786   1.219 -16.421
   65    HD2  TYR  10           2HD      TYR  10  -0.214   0.360 -14.195
   66    HE1  TYR  10           1HE      TYR  10  -2.844   0.039 -18.388
   67    HE2  TYR  10           2HE      TYR  10   0.728  -0.821 -16.162
   68    HH   TYR  10           HH       TYR  10   0.039  -0.492 -19.004
   69    H    GLU  11           H        GLU  11  -2.747   2.457 -11.656
   70    HA   GLU  11           HA       GLU  11  -3.870   5.101 -10.893
   71   1HB   GLU  11          2HB       GLU  11  -5.552   3.154 -11.736
   72   2HB   GLU  11          1HB       GLU  11  -5.405   2.705 -10.040
   73   1HG   GLU  11          2HG       GLU  11  -7.037   4.237  -9.707
   74   2HG   GLU  11          1HG       GLU  11  -5.728   5.410  -9.846
   75    H    TRP  12           H        TRP  12  -3.179   1.770  -9.825
   76    HA   TRP  12           HA       TRP  12  -3.055   2.204  -7.049
   77   1HB   TRP  12          2HB       TRP  12  -1.589   0.182  -7.098
   78   2HB   TRP  12          1HB       TRP  12  -3.011   0.010  -8.124
   79    HD1  TRP  12           HD       TRP  12  -2.654  -0.214 -10.692
   80    HE1  TRP  12           1HE      TRP  12  -0.567  -0.451 -12.186
   81    HE3  TRP  12           3HE      TRP  12   0.992   0.938  -7.306
   82    HZ2  TRP  12           2HZ      TRP  12   2.273  -0.188 -11.973
   83    HZ3  TRP  12           3HZ      TRP  12   3.377   0.936  -7.978
   84    HH2  TRP  12           HH       TRP  12   4.022   0.374 -10.306
   85    H    TYR  13           H        TYR  13  -0.696   3.056  -9.530
   86    HA   TYR  13           HA       TYR  13   1.451   3.520  -7.579
   87   1HB   TYR  13          2HB       TYR  13   1.643   2.757 -10.017
   88   2HB   TYR  13          1HB       TYR  13   1.284   4.428 -10.460
   89    HD1  TYR  13           1HD      TYR  13   3.260   5.464 -11.165
   90    HD2  TYR  13           2HD      TYR  13   3.329   2.946  -7.684
   91    HE1  TYR  13           1HE      TYR  13   5.625   6.087 -10.758
   92    HE2  TYR  13           2HE      TYR  13   5.692   3.572  -7.278
   93    HH   TYR  13           HH       TYR  13   7.627   5.019  -9.566
   94    H    SER  14           H        SER  14   2.082   5.503  -6.753
   95    HA   SER  14           HA       SER  14   0.864   8.005  -7.762
   96   1HB   SER  14          2HB       SER  14   0.516   7.061  -4.904
   97   2HB   SER  14          1HB       SER  14  -0.167   8.515  -5.624
   98    HG   SER  14           HG       SER  14  -1.234   6.125  -5.541
   99    H    LYS  15           H        LYS  15   2.324   9.651  -7.528
  100    HA   LYS  15           HA       LYS  15   4.955   9.151  -6.417
  101   1HB   LYS  15          2HB       LYS  15   3.481  11.229  -7.906
  102   2HB   LYS  15          1HB       LYS  15   4.767  11.856  -6.876
  103   1HG   LYS  15          2HG       LYS  15   5.659  11.340  -9.097
  104   2HG   LYS  15          1HG       LYS  15   6.347  10.238  -7.904
  105   1HD   LYS  15          2HD       LYS  15   4.414   8.651  -8.516
  106   2HD   LYS  15          1HD       LYS  15   4.185   9.679  -9.930
  107   1HE   LYS  15          2HE       LYS  15   5.678   8.048 -10.742
  108   2HE   LYS  15          1HE       LYS  15   6.791   9.334 -10.231
  109   1HZ   LYS  15          1HZ       LYS  15   5.857   7.251  -8.351
  110   2HZ   LYS  15          2HZ       LYS  15   7.195   8.285  -8.201
  111   3HZ   LYS  15          3HZ       LYS  15   7.226   7.009  -9.321
  112    H    HIS  16           H        HIS  16   5.100   8.992  -4.216
  113    HA   HIS  16           HA       HIS  16   5.049   9.630  -1.952
  114   1HB   HIS  16          2HB       HIS  16   5.005  12.188  -3.537
  115   2HB   HIS  16          1HB       HIS  16   4.939  12.242  -1.775
  116    HD1  HIS  16           1HD      HIS  16   6.973  10.030  -4.134
  117    HD2  HIS  16           2HD      HIS  16   7.540  12.672  -0.960
  118    HE1  HIS  16           1HE      HIS  16   9.452  10.010  -3.620
  119    H    MET  17           H        MET  17   2.624   8.625  -2.709
  120    HA   MET  17           HA       MET  17   0.448  10.511  -2.136
  121   1HB   MET  17          2HB       MET  17   0.217   8.598  -3.671
  122   2HB   MET  17          1HB       MET  17   0.582   7.483  -2.356
  123   1HG   MET  17          2HG       MET  17  -1.474   8.977  -1.289
  124   2HG   MET  17          1HG       MET  17  -1.931   8.885  -2.989
  125   1HE   MET  17          1HE       MET  17   0.186   6.139  -0.940
  126   2HE   MET  17          2HE       MET  17  -1.176   5.430  -0.078
  127   3HE   MET  17          3HE       MET  17  -0.808   7.141   0.126
  128    H    THR  18           H        THR  18  -0.162  11.066  -0.091
  129    HA   THR  18           HA       THR  18   1.099  10.129   2.276
  130    HB   THR  18           HB       THR  18  -1.688  11.275   2.123
  131    HG1  THR  18           1HG      THR  18  -0.796  12.738   0.902
  132   1HG2  THR  18          1HG2      THR  18   0.560  11.190   4.075
  133   2HG2  THR  18          2HG2      THR  18  -1.179  11.112   4.358
  134   3HG2  THR  18          3HG2      THR  18  -0.409  12.663   4.021
  135    H    ARG  19           H        ARG  19   0.629   8.484   3.687
  136    HA   ARG  19           HA       ARG  19  -0.809   6.169   2.961
  137   1HB   ARG  19          2HB       ARG  19  -0.519   5.590   5.318
  138   2HB   ARG  19          1HB       ARG  19   0.907   6.477   4.781
  139   1HG   ARG  19          2HG       ARG  19  -0.210   8.593   5.670
  140   2HG   ARG  19          1HG       ARG  19  -1.418   7.546   6.418
  141   1HD   ARG  19          2HD       ARG  19   0.049   6.781   8.021
  142   2HD   ARG  19          1HD       ARG  19   1.439   6.833   6.918
  143    HE   ARG  19           HE       ARG  19   0.373   9.127   8.455
  144   1HH1  ARG  19          1HH2      ARG  19   3.202   7.796   7.541
  145   2HH1  ARG  19          2HH2      ARG  19   3.898   9.215   6.830
  146   1HH2  ARG  19          1HH1      ARG  19   0.933  11.013   6.869
  147   2HH2  ARG  19          2HH1      ARG  19   2.614  11.035   6.449
  148    H    SER  20           H        SER  20  -1.830   8.987   4.823
  149    HA   SER  20           HA       SER  20  -4.437   8.011   5.543
  150   1HB   SER  20          2HB       SER  20  -3.993   9.781   6.875
  151   2HB   SER  20          1HB       SER  20  -2.718  10.336   5.800
  152    HG   SER  20           HG       SER  20  -4.063  11.855   5.255
  153    H    GLN  21           H        GLN  21  -3.171   9.878   2.800
  154    HA   GLN  21           HA       GLN  21  -5.688  10.595   1.638
  155   1HB   GLN  21          2HB       GLN  21  -2.872  10.168   0.638
  156   2HB   GLN  21          1HB       GLN  21  -4.167  10.621  -0.472
  157   1HG   GLN  21          2HG       GLN  21  -3.757  12.177   2.068
  158   2HG   GLN  21          1HG       GLN  21  -2.750  12.507   0.661
  159   1HE2  GLN  21          1HE2      GLN  21  -5.595  13.471   2.125
  160   2HE2  GLN  21          2HE2      GLN  21  -6.409  14.078   0.765
  161    H    ALA  22           H        ALA  22  -3.611   7.727   1.348
  162    HA   ALA  22           HA       ALA  22  -5.149   6.404  -0.680
  163   1HB   ALA  22          1HB       ALA  22  -3.904   4.593   1.205
  164   2HB   ALA  22          2HB       ALA  22  -2.835   5.962   0.904
  165   3HB   ALA  22          3HB       ALA  22  -3.402   4.974  -0.442
  166    H    GLU  23           H        GLU  23  -5.159   6.158   2.884
  167    HA   GLU  23           HA       GLU  23  -7.233   4.267   3.207
  168   1HB   GLU  23          2HB       GLU  23  -6.475   6.726   4.821
  169   2HB   GLU  23          1HB       GLU  23  -7.543   5.454   5.412
  170   1HG   GLU  23          2HG       GLU  23  -5.693   3.805   4.993
  171   2HG   GLU  23          1HG       GLU  23  -4.643   5.167   4.614
  172    H    GLN  24           H        GLN  24  -7.538   7.853   3.128
  173    HA   GLN  24           HA       GLN  24 -10.393   7.803   3.250
  174   1HB   GLN  24          2HB       GLN  24 -10.190  10.181   2.646
  175   2HB   GLN  24          1HB       GLN  24  -8.986   9.738   3.852
  176   1HG   GLN  24          2HG       GLN  24  -7.311   9.471   2.029
  177   2HG   GLN  24          1HG       GLN  24  -8.522  10.025   0.872
  178   1HE2  GLN  24          1HE2      GLN  24  -7.270  11.128   4.083
  179   2HE2  GLN  24          2HE2      GLN  24  -7.175  12.763   3.640
  180    H    LEU  25           H        LEU  25  -8.193   8.188   0.388
  181    HA   LEU  25           HA       LEU  25 -10.445   8.269  -1.410
  182   1HB   LEU  25          2HB       LEU  25  -8.769   8.056  -3.163
  183   2HB   LEU  25          1HB       LEU  25  -8.147   9.130  -1.916
  184    HG   LEU  25           HG       LEU  25  -7.119   6.907  -0.936
  185   1HD1  LEU  25          1HD1      LEU  25  -8.367   5.928  -3.251
  186   2HD1  LEU  25          2HD1      LEU  25  -7.187   5.077  -2.256
  187   3HD1  LEU  25          3HD1      LEU  25  -6.654   6.000  -3.660
  188   1HD2  LEU  25          1HD2      LEU  25  -5.299   8.106  -1.544
  189   2HD2  LEU  25          2HD2      LEU  25  -6.226   8.935  -2.791
  190   3HD2  LEU  25          3HD2      LEU  25  -5.423   7.409  -3.157
  191    H    LEU  26           H        LEU  26  -8.840   5.694   0.265
  192    HA   LEU  26           HA       LEU  26  -9.709   3.574  -1.568
  193   1HB   LEU  26          2HB       LEU  26  -8.308   3.870   1.041
  194   2HB   LEU  26          1HB       LEU  26  -9.186   2.367   0.815
  195    HG   LEU  26           HG       LEU  26  -7.209   3.456  -1.202
  196   1HD1  LEU  26          1HD1      LEU  26  -6.593   2.432   1.317
  197   2HD1  LEU  26          2HD1      LEU  26  -5.500   2.503  -0.064
  198   3HD1  LEU  26          3HD1      LEU  26  -6.430   1.038   0.247
  199   1HD2  LEU  26          1HD2      LEU  26  -7.903   0.573  -1.009
  200   2HD2  LEU  26          2HD2      LEU  26  -7.645   1.574  -2.437
  201   3HD2  LEU  26          3HD2      LEU  26  -9.187   1.636  -1.584
  202    H    LYS  27           H        LYS  27 -10.589   4.422   1.809
  203    HA   LYS  27           HA       LYS  27 -12.963   2.871   1.969
  204   1HB   LYS  27          2HB       LYS  27 -11.460   4.511   3.566
  205   2HB   LYS  27          1HB       LYS  27 -12.910   5.488   3.339
  206   1HG   LYS  27          2HG       LYS  27 -13.431   2.635   3.905
  207   2HG   LYS  27          1HG       LYS  27 -12.668   3.520   5.227
  208   1HD   LYS  27          2HD       LYS  27 -14.469   4.928   5.514
  209   2HD   LYS  27          1HD       LYS  27 -14.943   4.840   3.818
  210   1HE   LYS  27          2HE       LYS  27 -16.613   3.504   4.704
  211   2HE   LYS  27          1HE       LYS  27 -15.361   2.258   4.530
  212   1HZ   LYS  27          1HZ       LYS  27 -15.906   3.909   6.939
  213   2HZ   LYS  27          2HZ       LYS  27 -14.565   2.880   6.772
  214   3HZ   LYS  27          3HZ       LYS  27 -16.136   2.235   6.785
  215    H    GLN  28           H        GLN  28 -12.460   6.203   0.833
  216    HA   GLN  28           HA       GLN  28 -15.293   6.744   0.473
  217   1HB   GLN  28          2HB       GLN  28 -13.155   8.263   0.818
  218   2HB   GLN  28          1HB       GLN  28 -13.120   8.231  -0.944
  219   1HG   GLN  28          2HG       GLN  28 -14.489  10.076  -0.549
  220   2HG   GLN  28          1HG       GLN  28 -15.683   8.788  -0.710
  221   1HE2  GLN  28          1HE2      GLN  28 -17.208   8.822   0.940
  222   2HE2  GLN  28          2HE2      GLN  28 -16.924   9.357   2.525
  223    H    GLU  29           H        GLU  29 -12.681   5.680  -1.750
  224    HA   GLU  29           HA       GLU  29 -14.192   5.989  -4.172
  225   1HB   GLU  29          2HB       GLU  29 -11.683   5.595  -3.838
  226   2HB   GLU  29          1HB       GLU  29 -12.068   3.894  -3.588
  227   1HG   GLU  29          2HG       GLU  29 -11.413   4.371  -5.934
  228   2HG   GLU  29          1HG       GLU  29 -13.074   3.788  -5.831
  229    H    GLY  30           H        GLY  30 -13.955   3.418  -1.762
  230   1HA   GLY  30          2HA       GLY  30 -15.590   1.812  -1.227
  231   2HA   GLY  30          1HA       GLY  30 -16.531   2.390  -2.597
  232    H    LYS  31           H        LYS  31 -13.186   1.275  -2.762
  233    HA   LYS  31           HA       LYS  31 -14.092  -0.919  -4.592
  234   1HB   LYS  31          2HB       LYS  31 -11.303   0.199  -4.247
  235   2HB   LYS  31          1HB       LYS  31 -11.970  -0.641  -5.646
  236   1HG   LYS  31          2HG       LYS  31 -12.805   2.108  -4.662
  237   2HG   LYS  31          1HG       LYS  31 -11.825   1.780  -6.085
  238   1HD   LYS  31          2HD       LYS  31 -14.611   0.653  -5.728
  239   2HD   LYS  31          1HD       LYS  31 -14.299   2.190  -6.534
  240   1HE   LYS  31          2HE       LYS  31 -13.291   1.184  -8.366
  241   2HE   LYS  31          1HE       LYS  31 -12.747  -0.219  -7.425
  242   1HZ   LYS  31          1HZ       LYS  31 -15.165  -0.746  -7.108
  243   2HZ   LYS  31          2HZ       LYS  31 -14.586  -0.951  -8.692
  244   3HZ   LYS  31          3HZ       LYS  31 -15.510   0.418  -8.292
  245    H    GLU  32           H        GLU  32 -14.404  -2.660  -3.054
  246    HA   GLU  32           HA       GLU  32 -12.682  -3.144  -0.841
  247   1HB   GLU  32          2HB       GLU  32 -13.556  -5.536  -1.091
  248   2HB   GLU  32          1HB       GLU  32 -14.765  -4.272  -0.881
  249   1HG   GLU  32          2HG       GLU  32 -14.074  -4.671  -3.697
  250   2HG   GLU  32          1HG       GLU  32 -14.695  -6.144  -2.952
  251    H    GLY  33           H        GLY  33 -10.575  -3.627  -0.883
  252   1HA   GLY  33          2HA       GLY  33  -8.706  -4.994  -1.435
  253   2HA   GLY  33          1HA       GLY  33  -9.561  -5.516  -2.886
  254    H    GLY  34           H        GLY  34  -9.696  -2.113  -2.375
  255   1HA   GLY  34          2HA       GLY  34  -8.452  -1.431  -4.803
  256   2HA   GLY  34          1HA       GLY  34  -8.600  -0.325  -3.431
  257    H    PHE  35           H        PHE  35  -6.306  -0.993  -5.367
  258    HA   PHE  35           HA       PHE  35  -4.274  -1.543  -3.233
  259   1HB   PHE  35          2HB       PHE  35  -4.715  -3.426  -4.797
  260   2HB   PHE  35          1HB       PHE  35  -4.287  -2.378  -6.149
  261    HD1  PHE  35           1HD      PHE  35  -1.978  -1.563  -6.432
  262    HD2  PHE  35           2HD      PHE  35  -3.018  -4.309  -3.302
  263    HE1  PHE  35           1HE      PHE  35   0.423  -2.095  -6.106
  264    HE2  PHE  35           2HE      PHE  35  -0.619  -4.846  -2.976
  265    HZ   PHE  35           HZ       PHE  35   1.102  -3.739  -4.377
  266    H    ILE  36           H        ILE  36  -2.870   0.138  -2.980
  267    HA   ILE  36           HA       ILE  36  -2.173   1.790  -5.376
  268    HB   ILE  36           HB       ILE  36  -2.689   2.882  -2.596
  269   1HG1  ILE  36          2HG1      ILE  36  -4.576   2.546  -4.946
  270   2HG1  ILE  36          1HG1      ILE  36  -4.798   1.968  -3.298
  271   1HG2  ILE  36          1HG2      ILE  36  -2.552   4.181  -5.337
  272   2HG2  ILE  36          2HG2      ILE  36  -1.284   4.240  -4.113
  273   3HG2  ILE  36          3HG2      ILE  36  -2.833   5.023  -3.814
  274   1HD1  ILE  36          1HD1      ILE  36  -4.826   4.360  -2.526
  275   2HD1  ILE  36          2HD1      ILE  36  -6.166   3.948  -3.596
  276   3HD1  ILE  36          3HD1      ILE  36  -4.790   4.858  -4.218
  277    H    VAL  37           H        VAL  37  -0.081   2.973  -5.033
  278    HA   VAL  37           HA       VAL  37   1.625   1.939  -2.835
  279    HB   VAL  37           HB       VAL  37   2.253   1.642  -5.791
  280   1HG1  VAL  37          1HG1      VAL  37   4.143   0.216  -4.810
  281   2HG1  VAL  37          2HG1      VAL  37   3.763   0.967  -3.259
  282   3HG1  VAL  37          3HG1      VAL  37   4.302   1.963  -4.611
  283   1HG2  VAL  37          1HG2      VAL  37   1.376  -0.333  -3.668
  284   2HG2  VAL  37          2HG2      VAL  37   2.157  -0.834  -5.168
  285   3HG2  VAL  37          3HG2      VAL  37   0.604  -0.002  -5.218
  286    H    ARG  38           H        ARG  38   3.672   3.179  -2.681
  287    HA   ARG  38           HA       ARG  38   3.946   5.591  -4.362
  288   1HB   ARG  38          2HB       ARG  38   3.721   7.091  -2.390
  289   2HB   ARG  38          1HB       ARG  38   2.230   6.209  -2.717
  290   1HG   ARG  38          2HG       ARG  38   2.377   5.782  -0.462
  291   2HG   ARG  38          1HG       ARG  38   3.390   4.457  -1.035
  292   1HD   ARG  38          2HD       ARG  38   5.306   5.402  -0.214
  293   2HD   ARG  38          1HD       ARG  38   4.795   7.044  -0.657
  294    HE   ARG  38           HE       ARG  38   3.564   5.604   1.661
  295   1HH1  ARG  38          1HH1      ARG  38   6.099   7.580   1.487
  296   2HH1  ARG  38          2HH1      ARG  38   5.387   8.961   2.250
  297   1HH2  ARG  38          1HH2      ARG  38   2.153   7.720   2.081
  298   2HH2  ARG  38          2HH2      ARG  38   3.154   9.041   2.587
  299    H    ASP  39           H        ASP  39   5.970   6.758  -3.867
  300    HA   ASP  39           HA       ASP  39   8.118   4.938  -3.054
  301   1HB   ASP  39          2HB       ASP  39   8.165   6.630  -4.935
  302   2HB   ASP  39          1HB       ASP  39   8.184   7.900  -3.711
  303    H    SER  40           H        SER  40   9.749   5.634  -1.393
  304    HA   SER  40           HA       SER  40   8.397   6.938   0.942
  305   1HB   SER  40          2HB       SER  40   9.065   4.564   1.152
  306   2HB   SER  40          1HB       SER  40  10.725   4.997   0.753
  307    HG   SER  40           HG       SER  40   9.215   5.546   3.058
  308    H    SER  41           H        SER  41  10.932   7.219   2.372
  309    HA   SER  41           HA       SER  41  12.497   9.133   0.715
  310   1HB   SER  41          2HB       SER  41  10.529   9.755   2.806
  311   2HB   SER  41          1HB       SER  41  12.095  10.512   3.084
  312    HG   SER  41           HG       SER  41  10.570  11.698   1.717
  313    H    LYS  42           H        LYS  42  12.081   7.950   4.080
  314    HA   LYS  42           HA       LYS  42  14.762   8.288   4.940
  315   1HB   LYS  42          2HB       LYS  42  12.712   6.166   5.666
  316   2HB   LYS  42          1HB       LYS  42  14.105   6.617   6.650
  317   1HG   LYS  42          2HG       LYS  42  13.093   8.493   7.428
  318   2HG   LYS  42          1HG       LYS  42  12.451   8.911   5.839
  319   1HD   LYS  42          2HD       LYS  42  10.912   6.770   6.347
  320   2HD   LYS  42          1HD       LYS  42  11.227   7.275   8.008
  321   1HE   LYS  42          2HE       LYS  42   9.948   9.162   7.801
  322   2HE   LYS  42          1HE       LYS  42  10.515   9.475   6.149
  323   1HZ   LYS  42          1HZ       LYS  42   9.137   7.734   5.317
  324   2HZ   LYS  42          2HZ       LYS  42   8.157   8.739   6.274
  325   3HZ   LYS  42          3HZ       LYS  42   8.694   7.245   6.880
  326    H    ALA  43           H        ALA  43  13.316   5.120   4.101
  327    HA   ALA  43           HA       ALA  43  15.989   4.038   3.443
  328   1HB   ALA  43          1HB       ALA  43  13.799   2.278   2.841
  329   2HB   ALA  43          2HB       ALA  43  13.450   3.097   4.364
  330   3HB   ALA  43          3HB       ALA  43  14.940   2.171   4.181
  331    H    GLY  44           H        GLY  44  13.318   5.470   1.812
  332   1HA   GLY  44          2HA       GLY  44  13.038   5.915  -0.491
  333   2HA   GLY  44          1HA       GLY  44  14.578   5.090  -0.792
  334    H    LYS  45           H        LYS  45  12.101   3.581   1.132
  335    HA   LYS  45           HA       LYS  45  11.946   1.359  -0.787
  336   1HB   LYS  45          2HB       LYS  45  10.809   0.254   1.080
  337   2HB   LYS  45          1HB       LYS  45  12.273   1.050   1.654
  338   1HG   LYS  45          2HG       LYS  45  10.449   3.062   1.944
  339   2HG   LYS  45          1HG       LYS  45   9.438   1.652   2.254
  340   1HD   LYS  45          2HD       LYS  45  10.509   1.148   4.201
  341   2HD   LYS  45          1HD       LYS  45  12.089   1.602   3.564
  342   1HE   LYS  45          2HE       LYS  45  11.658   3.947   3.938
  343   2HE   LYS  45          1HE       LYS  45   9.955   3.626   4.324
  344   1HZ   LYS  45          1HZ       LYS  45  12.236   2.432   5.803
  345   2HZ   LYS  45          2HZ       LYS  45  10.590   2.351   6.215
  346   3HZ   LYS  45          3HZ       LYS  45  11.421   3.829   6.313
  347    H    TYR  46           H        TYR  46   9.495   0.391  -0.797
  348    HA   TYR  46           HA       TYR  46   7.734   2.662  -1.664
  349   1HB   TYR  46          2HB       TYR  46   7.705  -0.253  -2.508
  350   2HB   TYR  46          1HB       TYR  46   6.787   1.057  -3.242
  351    HD1  TYR  46           1HD      TYR  46   8.693  -0.789  -4.729
  352    HD2  TYR  46           2HD      TYR  46   9.311   3.023  -2.852
  353    HE1  TYR  46           1HE      TYR  46  10.584  -0.337  -6.264
  354    HE2  TYR  46           2HE      TYR  46  11.201   3.474  -4.385
  355    HH   TYR  46           HH       TYR  46  11.716   2.265  -7.068
  356    H    THR  47           H        THR  47   5.438   2.439  -1.179
  357    HA   THR  47           HA       THR  47   4.832   0.531   1.055
  358    HB   THR  47           HB       THR  47   3.969   3.417   0.657
  359    HG1  THR  47           1HG      THR  47   5.536   3.869   1.973
  360   1HG2  THR  47          1HG2      THR  47   3.318   2.713   3.238
  361   2HG2  THR  47          2HG2      THR  47   2.936   1.236   2.352
  362   3HG2  THR  47          3HG2      THR  47   2.176   2.761   1.894
  363    H    VAL  48           H        VAL  48   3.013  -0.698   0.712
  364    HA   VAL  48           HA       VAL  48   1.379  -0.071  -1.721
  365    HB   VAL  48           HB       VAL  48   1.942  -2.549  -0.079
  366   1HG1  VAL  48          1HG1      VAL  48  -0.411  -2.632  -0.733
  367   2HG1  VAL  48          2HG1      VAL  48   0.515  -3.759  -1.724
  368   3HG1  VAL  48          3HG1      VAL  48   0.013  -2.206  -2.391
  369   1HG2  VAL  48          1HG2      VAL  48   3.462  -1.488  -1.984
  370   2HG2  VAL  48          2HG2      VAL  48   2.299  -2.293  -3.039
  371   3HG2  VAL  48          3HG2      VAL  48   3.233  -3.234  -1.878
  372    H    SER  49           H        SER  49  -0.514   0.976  -1.273
  373    HA   SER  49           HA       SER  49  -1.819   0.602   1.385
  374   1HB   SER  49          2HB       SER  49  -1.767   2.648  -0.802
  375   2HB   SER  49          1HB       SER  49  -3.180   2.587   0.249
  376    HG   SER  49           HG       SER  49  -0.754   3.604   0.737
  377    H    VAL  50           H        VAL  50  -3.413  -0.978   1.400
  378    HA   VAL  50           HA       VAL  50  -5.204  -1.110  -1.003
  379    HB   VAL  50           HB       VAL  50  -5.163  -3.531  -0.839
  380   1HG1  VAL  50          1HG1      VAL  50  -2.368  -2.389  -0.543
  381   2HG1  VAL  50          2HG1      VAL  50  -3.274  -2.542  -2.046
  382   3HG1  VAL  50          3HG1      VAL  50  -2.746  -3.987  -1.187
  383   1HG2  VAL  50          1HG2      VAL  50  -3.372  -3.178   1.587
  384   2HG2  VAL  50          2HG2      VAL  50  -3.927  -4.705   0.904
  385   3HG2  VAL  50          3HG2      VAL  50  -5.079  -3.613   1.664
  386    H    PHE  51           H        PHE  51  -7.467  -1.318  -0.495
  387    HA   PHE  51           HA       PHE  51  -8.104  -1.729   2.410
  388   1HB   PHE  51          2HB       PHE  51  -8.682   0.447   2.556
  389   2HB   PHE  51          1HB       PHE  51  -8.276   0.687   0.864
  390    HD1  PHE  51           1HD      PHE  51 -10.932   0.507   3.277
  391    HD2  PHE  51           2HD      PHE  51 -10.043   0.031  -0.897
  392    HE1  PHE  51           1HE      PHE  51 -13.339   0.734   2.737
  393    HE2  PHE  51           2HE      PHE  51 -12.446   0.264  -1.431
  394    HZ   PHE  51           HZ       PHE  51 -14.099   0.612   0.381
  395    H    ALA  52           H        ALA  52 -10.472  -2.226   2.728
  396    HA   ALA  52           HA       ALA  52 -11.980  -3.084   0.363
  397   1HB   ALA  52          1HB       ALA  52 -11.157  -5.127   2.427
  398   2HB   ALA  52          2HB       ALA  52 -10.323  -4.914   0.887
  399   3HB   ALA  52          3HB       ALA  52 -12.011  -5.423   0.913
  400    H    LYS  53           H        LYS  53 -14.159  -3.847   0.940
  401    HA   LYS  53           HA       LYS  53 -15.078  -2.700   3.552
  402   1HB   LYS  53          2HB       LYS  53 -16.419  -3.208   0.876
  403   2HB   LYS  53          1HB       LYS  53 -17.227  -2.510   2.281
  404   1HG   LYS  53          2HG       LYS  53 -14.673  -1.217   1.523
  405   2HG   LYS  53          1HG       LYS  53 -15.986  -1.025   0.361
  406   1HD   LYS  53          2HD       LYS  53 -16.205  -0.413   3.319
  407   2HD   LYS  53          1HD       LYS  53 -15.946   0.795   2.063
  408   1HE   LYS  53          2HE       LYS  53 -18.223  -1.016   1.538
  409   2HE   LYS  53          1HE       LYS  53 -18.426   0.042   2.949
  410   1HZ   LYS  53          1HZ       LYS  53 -17.592   1.890   1.527
  411   2HZ   LYS  53          2HZ       LYS  53 -19.098   1.271   1.039
  412   3HZ   LYS  53          3HZ       LYS  53 -17.688   0.851   0.189
  413    H    SER  54           H        SER  54 -14.000  -5.362   3.531
  414    HA   SER  54           HA       SER  54 -16.323  -6.870   4.511
  415   1HB   SER  54          2HB       SER  54 -16.561  -7.288   2.156
  416   2HB   SER  54          1HB       SER  54 -14.833  -7.572   1.968
  417    HG   SER  54           HG       SER  54 -16.092  -9.513   2.086
  418    H    THR  55           H        THR  55 -14.710  -6.543   6.350
  419    HA   THR  55           HA       THR  55 -13.142  -8.959   6.772
  420    HB   THR  55           HB       THR  55 -11.349  -6.656   6.983
  421    HG1  THR  55           1HG      THR  55 -11.067  -6.450   4.734
  422   1HG2  THR  55          1HG2      THR  55 -10.033  -8.330   5.431
  423   2HG2  THR  55          2HG2      THR  55 -11.311  -9.446   5.914
  424   3HG2  THR  55          3HG2      THR  55 -10.280  -8.703   7.137
  425    H    GLY  56           H        GLY  56 -11.354  -7.397   8.699
  426   1HA   GLY  56          2HA       GLY  56 -12.854  -7.550  11.062
  427   2HA   GLY  56          1HA       GLY  56 -11.489  -6.444  10.860
  428    H    ASP  57           H        ASP  57 -12.717  -5.041   8.627
  429    HA   ASP  57           HA       ASP  57 -14.862  -3.510  10.052
  430   1HB   ASP  57          2HB       ASP  57 -12.361  -2.691   9.338
  431   2HB   ASP  57          1HB       ASP  57 -13.261  -2.299   7.874
  432    HA   PRO  58           HA       PRO  58 -16.684  -5.713   6.373
  433   1HB   PRO  58          2HB       PRO  58 -19.205  -4.927   7.522
  434   2HB   PRO  58          1HB       PRO  58 -18.518  -6.547   7.380
  435   1HG   PRO  58          2HG       PRO  58 -18.742  -4.887   9.737
  436   2HG   PRO  58          1HG       PRO  58 -18.188  -6.559   9.620
  437   1HD   PRO  58          2HD       PRO  58 -16.588  -4.299  10.198
  438   2HD   PRO  58          1HD       PRO  58 -15.998  -5.927   9.779
  439    H    GLN  59           H        GLN  59 -17.033  -2.500   7.652
  440    HA   GLN  59           HA       GLN  59 -18.220  -1.613   5.048
  441   1HB   GLN  59          2HB       GLN  59 -18.983   0.349   6.475
  442   2HB   GLN  59          1HB       GLN  59 -19.683  -1.211   6.913
  443   1HG   GLN  59          2HG       GLN  59 -18.408  -1.401   8.843
  444   2HG   GLN  59          1HG       GLN  59 -17.127  -0.360   8.221
  445   1HE2  GLN  59          1HE2      GLN  59 -17.197   1.824   8.833
  446   2HE2  GLN  59          2HE2      GLN  59 -18.515   2.563   9.605
  447    H    GLY  60           H        GLY  60 -15.208  -1.890   5.914
  448   1HA   GLY  60          2HA       GLY  60 -14.068   0.055   4.396
  449   2HA   GLY  60          1HA       GLY  60 -14.382   0.911   5.895
  450    H    VAL  61           H        VAL  61 -12.290  -1.324   4.300
  451    HA   VAL  61           HA       VAL  61 -10.639  -1.512   6.800
  452    HB   VAL  61           HB       VAL  61 -11.086  -3.535   4.575
  453   1HG1  VAL  61          1HG1      VAL  61  -8.862  -3.924   5.130
  454   2HG1  VAL  61          2HG1      VAL  61  -9.682  -4.952   6.305
  455   3HG1  VAL  61          3HG1      VAL  61  -9.072  -3.370   6.792
  456   1HG2  VAL  61          1HG2      VAL  61 -12.882  -3.330   6.284
  457   2HG2  VAL  61          2HG2      VAL  61 -11.693  -3.679   7.538
  458   3HG2  VAL  61          3HG2      VAL  61 -12.081  -4.900   6.325
  459    H    ILE  62           H        ILE  62  -8.524  -0.998   6.569
  460    HA   ILE  62           HA       ILE  62  -7.380  -0.643   3.841
  461    HB   ILE  62           HB       ILE  62  -6.821   1.518   5.780
  462   1HG1  ILE  62          2HG1      ILE  62  -9.609   1.067   4.671
  463   2HG1  ILE  62          1HG1      ILE  62  -9.157   1.104   6.365
  464   1HG2  ILE  62          1HG2      ILE  62  -6.875   1.057   2.949
  465   2HG2  ILE  62          2HG2      ILE  62  -6.260   2.461   3.816
  466   3HG2  ILE  62          3HG2      ILE  62  -7.949   2.408   3.314
  467   1HD1  ILE  62          1HD1      ILE  62  -8.206   3.497   5.618
  468   2HD1  ILE  62          2HD1      ILE  62  -9.852   3.255   6.202
  469   3HD1  ILE  62          3HD1      ILE  62  -9.534   3.339   4.468
  470    H    ARG  63           H        ARG  63  -5.021  -0.484   3.876
  471    HA   ARG  63           HA       ARG  63  -3.488  -0.749   6.326
  472   1HB   ARG  63          2HB       ARG  63  -4.815  -3.002   5.712
  473   2HB   ARG  63          1HB       ARG  63  -3.406  -3.238   4.677
  474   1HG   ARG  63          2HG       ARG  63  -1.903  -3.078   6.546
  475   2HG   ARG  63          1HG       ARG  63  -3.199  -2.542   7.616
  476   1HD   ARG  63          2HD       ARG  63  -4.008  -4.672   7.913
  477   2HD   ARG  63          1HD       ARG  63  -3.633  -5.151   6.245
  478    HE   ARG  63           HE       ARG  63  -1.152  -4.694   7.482
  479   1HH1  ARG  63          1HH1      ARG  63  -2.932  -5.902   9.743
  480   2HH1  ARG  63          2HH1      ARG  63  -2.467  -7.566   9.629
  481   1HH2  ARG  63          1HH2      ARG  63  -0.956  -7.208   6.530
  482   2HH2  ARG  63          2HH2      ARG  63  -1.349  -8.305   7.811
  483    H    HIS  64           H        HIS  64  -1.506   0.114   5.777
  484    HA   HIS  64           HA       HIS  64  -0.730   0.114   2.898
  485   1HB   HIS  64          2HB       HIS  64   0.595   1.634   5.145
  486   2HB   HIS  64          1HB       HIS  64   0.557   2.035   3.429
  487    HD1  HIS  64           1HD      HIS  64  -2.304   2.035   2.685
  488    HD2  HIS  64           2HD      HIS  64  -1.056   3.446   6.403
  489    HE1  HIS  64           1HE      HIS  64  -4.146   3.547   3.531
  490    H    TYR  65           H        TYR  65   0.416  -1.758   2.488
  491    HA   TYR  65           HA       TYR  65   2.289  -2.904   4.439
  492   1HB   TYR  65          2HB       TYR  65   2.091  -3.498   1.492
  493   2HB   TYR  65          1HB       TYR  65   2.553  -4.588   2.793
  494    HD1  TYR  65           1HD      TYR  65   0.208  -4.612   0.549
  495    HD2  TYR  65           2HD      TYR  65   0.392  -3.924   4.785
  496    HE1  TYR  65           1HE      TYR  65  -2.138  -5.358   0.774
  497    HE2  TYR  65           2HE      TYR  65  -1.956  -4.667   5.009
  498    HH   TYR  65           HH       TYR  65  -3.576  -6.027   3.814
  499    H    VAL  66           H        VAL  66   4.347  -2.091   4.646
  500    HA   VAL  66           HA       VAL  66   5.459  -0.563   2.322
  501    HB   VAL  66           HB       VAL  66   6.184  -0.412   5.266
  502   1HG1  VAL  66          1HG1      VAL  66   8.002   0.385   3.939
  503   2HG1  VAL  66          2HG1      VAL  66   7.127   1.829   4.445
  504   3HG1  VAL  66          3HG1      VAL  66   6.919   1.199   2.811
  505   1HG2  VAL  66          1HG2      VAL  66   4.403   0.944   5.576
  506   2HG2  VAL  66          2HG2      VAL  66   3.847   0.523   3.957
  507   3HG2  VAL  66          3HG2      VAL  66   4.873   1.937   4.197
  508    H    VAL  67           H        VAL  67   7.889  -0.692   2.161
  509    HA   VAL  67           HA       VAL  67   8.804  -3.463   2.839
  510    HB   VAL  67           HB       VAL  67   9.514  -1.570   0.580
  511   1HG1  VAL  67          1HG1      VAL  67  10.984  -3.737   1.705
  512   2HG1  VAL  67          2HG1      VAL  67  11.341  -2.831   0.235
  513   3HG1  VAL  67          3HG1      VAL  67  10.344  -4.283   0.155
  514   1HG2  VAL  67          1HG2      VAL  67   7.476  -2.420  -0.088
  515   2HG2  VAL  67          2HG2      VAL  67   7.632  -3.862   0.915
  516   3HG2  VAL  67          3HG2      VAL  67   8.503  -3.755  -0.614
  517    H    CYS  68           H        CYS  68  10.469  -3.558   4.260
  518    HA   CYS  68           HA       CYS  68  11.939  -1.095   4.982
  519   1HB   CYS  68          2HB       CYS  68  11.005  -2.665   6.681
  520   2HB   CYS  68          1HB       CYS  68  12.036  -3.944   6.039
  521    HG   CYS  68           HG       CYS  68  12.952  -2.087   8.100
  522    H    SER  69           H        SER  69  14.265  -0.970   4.740
  523    HA   SER  69           HA       SER  69  15.419  -3.032   2.894
  524   1HB   SER  69          2HB       SER  69  16.700  -0.905   2.058
  525   2HB   SER  69          1HB       SER  69  15.032  -1.162   1.544
  526    HG   SER  69           HG       SER  69  14.356   0.298   3.065
  527    H    THR  70           H        THR  70  17.355  -3.846   3.513
  528    HA   THR  70           HA       THR  70  18.698  -2.680   5.906
  529    HB   THR  70           HB       THR  70  17.955  -5.082   5.816
  530    HG1  THR  70           1HG      THR  70  19.634  -5.586   6.966
  531   1HG2  THR  70          1HG2      THR  70  18.772  -5.069   3.251
  532   2HG2  THR  70          2HG2      THR  70  18.647  -6.546   4.205
  533   3HG2  THR  70          3HG2      THR  70  20.208  -5.754   4.009
  534    HA   PRO  71           HA       PRO  71  21.986  -1.052   3.502
  535   1HB   PRO  71          2HB       PRO  71  24.089  -1.986   5.229
  536   2HB   PRO  71          1HB       PRO  71  23.369  -0.375   5.154
  537   1HG   PRO  71          2HG       PRO  71  23.060  -2.316   7.222
  538   2HG   PRO  71          1HG       PRO  71  22.271  -0.741   7.099
  539   1HD   PRO  71          2HD       PRO  71  21.106  -3.373   6.722
  540   2HD   PRO  71          1HD       PRO  71  20.286  -1.794   6.720
  541    H    GLN  72           H        GLN  72  21.590  -4.364   3.721
  542    HA   GLN  72           HA       GLN  72  24.094  -5.015   2.262
  543   1HB   GLN  72          2HB       GLN  72  23.310  -6.466   4.082
  544   2HB   GLN  72          1HB       GLN  72  21.750  -6.651   3.293
  545   1HG   GLN  72          2HG       GLN  72  23.279  -8.600   2.933
  546   2HG   GLN  72          1HG       GLN  72  22.773  -7.836   1.431
  547   1HE2  GLN  72          1HE2      GLN  72  25.353  -6.989   3.816
  548   2HE2  GLN  72          2HE2      GLN  72  26.601  -6.939   2.666
  549    H    SER  73           H        SER  73  21.793  -3.312   1.174
  550    HA   SER  73           HA       SER  73  20.714  -3.037  -0.909
  551   1HB   SER  73          2HB       SER  73  23.106  -4.376  -1.326
  552   2HB   SER  73          1HB       SER  73  21.935  -5.434  -2.108
  553    HG   SER  73           HG       SER  73  22.607  -2.761  -2.651
  554    H    GLN  74           H        GLN  74  19.291  -4.390   1.054
  555    HA   GLN  74           HA       GLN  74  17.814  -6.443  -0.546
  556   1HB   GLN  74          2HB       GLN  74  18.052  -6.801   2.391
  557   2HB   GLN  74          1HB       GLN  74  18.090  -8.011   1.115
  558   1HG   GLN  74          2HG       GLN  74  20.382  -6.993   0.491
  559   2HG   GLN  74          1HG       GLN  74  20.330  -6.231   2.079
  560   1HE2  GLN  74          1HE2      GLN  74  20.670  -9.311   0.391
  561   2HE2  GLN  74          2HE2      GLN  74  21.040 -10.237   1.766
  562    H    TYR  75           H        TYR  75  15.589  -6.853   0.478
  563    HA   TYR  75           HA       TYR  75  14.516  -4.507   1.986
  564   1HB   TYR  75          2HB       TYR  75  13.356  -5.527  -0.617
  565   2HB   TYR  75          1HB       TYR  75  12.832  -4.112   0.287
  566    HD1  TYR  75           1HD      TYR  75  15.651  -5.555  -1.649
  567    HD2  TYR  75           2HD      TYR  75  13.930  -2.016   0.060
  568    HE1  TYR  75           1HE      TYR  75  17.315  -4.175  -2.846
  569    HE2  TYR  75           2HE      TYR  75  15.590  -0.631  -1.141
  570    HH   TYR  75           HH       TYR  75  17.025  -0.810  -3.164
  571    H    TYR  76           H        TYR  76  12.304  -4.918   2.817
  572    HA   TYR  76           HA       TYR  76  10.889  -7.393   2.550
  573   1HB   TYR  76          2HB       TYR  76  11.560  -8.454   4.702
  574   2HB   TYR  76          1HB       TYR  76  12.934  -8.303   3.620
  575    HD1  TYR  76           1HD      TYR  76  14.826  -6.914   4.193
  576    HD2  TYR  76           2HD      TYR  76  11.248  -6.806   6.555
  577    HE1  TYR  76           1HE      TYR  76  16.016  -5.631   5.943
  578    HE2  TYR  76           2HE      TYR  76  12.430  -5.521   8.304
  579    HH   TYR  76           HH       TYR  76  14.419  -4.740   8.994
  580    H    LEU  77           H        LEU  77   9.126  -7.570   4.158
  581    HA   LEU  77           HA       LEU  77   8.425  -4.927   5.388
  582   1HB   LEU  77          2HB       LEU  77   6.971  -6.487   3.765
  583   2HB   LEU  77          1HB       LEU  77   6.615  -7.332   5.271
  584    HG   LEU  77           HG       LEU  77   6.412  -4.392   5.448
  585   1HD1  LEU  77          1HD1      LEU  77   4.196  -5.840   4.005
  586   2HD1  LEU  77          2HD1      LEU  77   5.515  -5.093   3.105
  587   3HD1  LEU  77          3HD1      LEU  77   4.478  -4.104   4.134
  588   1HD2  LEU  77          1HD2      LEU  77   5.541  -5.404   7.324
  589   2HD2  LEU  77          2HD2      LEU  77   5.039  -6.846   6.441
  590   3HD2  LEU  77          3HD2      LEU  77   4.075  -5.374   6.344
  591    H    ALA  78           H        ALA  78   9.652  -7.998   5.962
  592    HA   ALA  78           HA       ALA  78   9.702  -7.639   8.886
  593   1HB   ALA  78          1HB       ALA  78   9.022 -10.373   7.943
  594   2HB   ALA  78          2HB       ALA  78   7.737  -9.184   7.728
  595   3HB   ALA  78          3HB       ALA  78   8.396  -9.488   9.335
  596    H    GLU  79           H        GLU  79  11.873  -7.971   9.342
  597    HA   GLU  79           HA       GLU  79  13.862  -8.635   7.515
  598   1HB   GLU  79          2HB       GLU  79  13.536  -8.750  10.482
  599   2HB   GLU  79          1HB       GLU  79  14.980  -9.500   9.798
  600   1HG   GLU  79          2HG       GLU  79  15.352  -7.351   8.504
  601   2HG   GLU  79          1HG       GLU  79  14.071  -6.633   9.481
  602    H    LYS  80           H        LYS  80  11.605 -10.799   8.964
  603    HA   LYS  80           HA       LYS  80  12.810 -13.288   9.128
  604   1HB   LYS  80          2HB       LYS  80  10.188 -12.187   8.310
  605   2HB   LYS  80          1HB       LYS  80  10.483 -13.851   7.808
  606   1HG   LYS  80          2HG       LYS  80  11.045 -14.459  10.134
  607   2HG   LYS  80          1HG       LYS  80  10.751 -12.795  10.639
  608   1HD   LYS  80          2HD       LYS  80   8.426 -13.330   9.328
  609   2HD   LYS  80          1HD       LYS  80   8.815 -14.930   9.959
  610   1HE   LYS  80          2HE       LYS  80   9.227 -13.726  12.221
  611   2HE   LYS  80          1HE       LYS  80   8.331 -12.375  11.498
  612   1HZ   LYS  80          1HZ       LYS  80   6.738 -13.790  12.518
  613   2HZ   LYS  80          2HZ       LYS  80   7.415 -15.181  11.817
  614   3HZ   LYS  80          3HZ       LYS  80   6.610 -14.042  10.846
  615    H    HIS  81           H        HIS  81  11.917 -11.550   6.155
  616    HA   HIS  81           HA       HIS  81  13.822 -13.205   4.606
  617   1HB   HIS  81          2HB       HIS  81  12.015 -13.776   2.962
  618   2HB   HIS  81          1HB       HIS  81  11.745 -14.502   4.545
  619    HD1  HIS  81           1HD      HIS  81   9.674 -13.779   5.839
  620    HD2  HIS  81           2HD      HIS  81  10.297 -11.495   2.409
  621    HE1  HIS  81           1HE      HIS  81   7.598 -12.358   5.537
  622    H    LEU  82           H        LEU  82  14.660 -11.964   2.878
  623    HA   LEU  82           HA       LEU  82  13.192  -9.509   2.113
  624   1HB   LEU  82          2HB       LEU  82  15.117  -8.115   2.706
  625   2HB   LEU  82          1HB       LEU  82  14.609  -9.041   4.114
  626    HG   LEU  82           HG       LEU  82  16.778  -9.989   2.255
  627   1HD1  LEU  82          1HD1      LEU  82  18.326  -8.674   3.282
  628   2HD1  LEU  82          2HD1      LEU  82  17.571  -8.863   4.863
  629   3HD1  LEU  82          3HD1      LEU  82  16.946  -7.671   3.724
  630   1HD2  LEU  82          1HD2      LEU  82  15.511 -10.928   4.738
  631   2HD2  LEU  82          2HD2      LEU  82  17.271 -10.880   4.835
  632   3HD2  LEU  82          3HD2      LEU  82  16.483 -11.825   3.572
  633    H    PHE  83           H        PHE  83  13.573  -8.909  -0.009
  634    HA   PHE  83           HA       PHE  83  15.523 -10.593  -1.534
  635   1HB   PHE  83          2HB       PHE  83  12.839  -9.372  -2.041
  636   2HB   PHE  83          1HB       PHE  83  13.917  -9.592  -3.424
  637    HD1  PHE  83           1HD      PHE  83  15.142 -11.942  -3.522
  638    HD2  PHE  83           2HD      PHE  83  11.496 -11.172  -1.388
  639    HE1  PHE  83           1HE      PHE  83  14.607 -14.363  -3.561
  640    HE2  PHE  83           2HE      PHE  83  10.960 -13.592  -1.428
  641    HZ   PHE  83           HZ       PHE  83  12.515 -15.189  -2.515
  642    H    SER  84           H        SER  84  15.465  -8.788  -3.860
  643    HA   SER  84           HA       SER  84  17.258  -6.667  -2.746
  644   1HB   SER  84          2HB       SER  84  18.208  -8.323  -4.298
  645   2HB   SER  84          1HB       SER  84  16.998  -7.905  -5.507
  646    HG   SER  84           HG       SER  84  19.337  -6.740  -5.026
  647    H    THR  85           H        THR  85  14.088  -6.817  -3.672
  648    HA   THR  85           HA       THR  85  13.960  -3.947  -4.209
  649    HB   THR  85           HB       THR  85  12.961  -5.716  -6.441
  650    HG1  THR  85           1HG      THR  85  14.891  -5.863  -7.282
  651   1HG2  THR  85          1HG2      THR  85  12.424  -3.737  -7.352
  652   2HG2  THR  85          2HG2      THR  85  14.084  -3.170  -7.180
  653   3HG2  THR  85          3HG2      THR  85  12.938  -2.949  -5.859
  654    H    ILE  86           H        ILE  86  11.665  -3.211  -4.361
  655    HA   ILE  86           HA       ILE  86   9.919  -4.681  -2.613
  656    HB   ILE  86           HB       ILE  86   9.765  -2.267  -4.385
  657   1HG1  ILE  86          2HG1      ILE  86   8.953  -1.606  -1.848
  658   2HG1  ILE  86          1HG1      ILE  86  10.067  -2.934  -1.536
  659   1HG2  ILE  86          1HG2      ILE  86   7.444  -3.513  -2.877
  660   2HG2  ILE  86          2HG2      ILE  86   7.541  -3.246  -4.619
  661   3HG2  ILE  86          3HG2      ILE  86   7.446  -1.870  -3.521
  662   1HD1  ILE  86          1HD1      ILE  86  11.410  -1.466  -3.451
  663   2HD1  ILE  86          2HD1      ILE  86  11.704  -1.383  -1.714
  664   3HD1  ILE  86          3HD1      ILE  86  10.629  -0.217  -2.482
  665    HA   PRO  87           HA       PRO  87   7.267  -5.502  -6.655
  666   1HB   PRO  87          2HB       PRO  87   9.191  -5.766  -8.781
  667   2HB   PRO  87          1HB       PRO  87   7.842  -4.633  -8.658
  668   1HG   PRO  87          2HG       PRO  87  10.672  -4.110  -8.323
  669   2HG   PRO  87          1HG       PRO  87   9.333  -2.957  -8.355
  670   1HD   PRO  87          2HD       PRO  87  10.876  -3.681  -6.094
  671   2HD   PRO  87          1HD       PRO  87   9.366  -2.741  -6.084
  672    H    GLU  88           H        GLU  88  10.628  -6.750  -7.074
  673    HA   GLU  88           HA       GLU  88   9.852  -9.431  -7.629
  674   1HB   GLU  88          2HB       GLU  88  12.194  -9.902  -7.282
  675   2HB   GLU  88          1HB       GLU  88  12.084  -8.290  -7.983
  676   1HG   GLU  88          2HG       GLU  88  12.222  -7.339  -5.666
  677   2HG   GLU  88          1HG       GLU  88  12.507  -8.971  -5.062
  678    H    LEU  89           H        LEU  89  10.691  -7.872  -4.520
  679    HA   LEU  89           HA       LEU  89  10.574 -10.163  -2.851
  680   1HB   LEU  89          2HB       LEU  89  11.361  -7.817  -2.332
  681   2HB   LEU  89          1HB       LEU  89   9.670  -7.331  -2.223
  682    HG   LEU  89           HG       LEU  89  10.614  -9.680  -0.617
  683   1HD1  LEU  89          1HD1      LEU  89  11.615  -8.395   1.033
  684   2HD1  LEU  89          2HD1      LEU  89  10.750  -6.931   0.567
  685   3HD1  LEU  89          3HD1      LEU  89  12.113  -7.496  -0.400
  686   1HD2  LEU  89          1HD2      LEU  89   8.474  -7.561  -0.439
  687   2HD2  LEU  89          2HD2      LEU  89   8.915  -8.531   0.966
  688   3HD2  LEU  89          3HD2      LEU  89   8.282  -9.313  -0.481
  689    H    ILE  90           H        ILE  90   7.958  -7.735  -3.302
  690    HA   ILE  90           HA       ILE  90   5.901  -9.155  -1.985
  691    HB   ILE  90           HB       ILE  90   5.786  -7.304  -4.394
  692   1HG1  ILE  90          2HG1      ILE  90   6.998  -6.281  -2.540
  693   2HG1  ILE  90          1HG1      ILE  90   5.396  -5.555  -2.641
  694   1HG2  ILE  90          1HG2      ILE  90   3.713  -8.764  -3.295
  695   2HG2  ILE  90          2HG2      ILE  90   3.530  -7.255  -4.189
  696   3HG2  ILE  90          3HG2      ILE  90   3.603  -7.232  -2.427
  697   1HD1  ILE  90          1HD1      ILE  90   4.771  -7.504  -0.956
  698   2HD1  ILE  90          2HD1      ILE  90   5.496  -6.006  -0.371
  699   3HD1  ILE  90          3HD1      ILE  90   6.496  -7.442  -0.595
  700    H    ASN  91           H        ASN  91   7.074  -9.434  -5.322
  701    HA   ASN  91           HA       ASN  91   4.937 -11.217  -6.192
  702   1HB   ASN  91          2HB       ASN  91   6.645  -9.602  -7.446
  703   2HB   ASN  91          1HB       ASN  91   7.627 -11.067  -7.504
  704   1HD2  ASN  91          1HD2      ASN  91   4.143 -10.224  -8.018
  705   2HD2  ASN  91          2HD2      ASN  91   3.978 -11.163  -9.423
  706    H    TYR  92           H        TYR  92   8.283 -11.632  -5.054
  707    HA   TYR  92           HA       TYR  92   8.796 -14.313  -5.578
  708   1HB   TYR  92          2HB       TYR  92   9.446 -12.364  -3.421
  709   2HB   TYR  92          1HB       TYR  92   9.840 -14.053  -3.106
  710    HD1  TYR  92           1HD      TYR  92  10.716 -15.202  -5.528
  711    HD2  TYR  92           2HD      TYR  92  11.298 -11.171  -4.175
  712    HE1  TYR  92           1HE      TYR  92  12.718 -15.003  -6.974
  713    HE2  TYR  92           2HE      TYR  92  13.299 -10.970  -5.617
  714    HH   TYR  92           HH       TYR  92  14.917 -13.479  -6.871
  715    H    HIS  93           H        HIS  93   7.442 -13.263  -2.420
  716    HA   HIS  93           HA       HIS  93   6.600 -15.902  -1.662
  717   1HB   HIS  93          2HB       HIS  93   6.953 -13.526  -0.430
  718   2HB   HIS  93          1HB       HIS  93   5.199 -13.491  -0.608
  719    HD1  HIS  93           1HD      HIS  93   7.971 -15.451   1.025
  720    HD2  HIS  93           2HD      HIS  93   3.803 -15.375   0.978
  721    HE1  HIS  93           1HE      HIS  93   7.206 -16.980   2.893
  722    H    GLN  94           H        GLN  94   4.459 -13.111  -2.376
  723    HA   GLN  94           HA       GLN  94   2.847 -14.473  -4.329
  724   1HB   GLN  94          2HB       GLN  94   2.529 -15.361  -1.678
  725   2HB   GLN  94          1HB       GLN  94   1.141 -14.316  -1.970
  726   1HG   GLN  94          2HG       GLN  94   0.177 -15.844  -3.314
  727   2HG   GLN  94          1HG       GLN  94   1.649 -16.015  -4.271
  728   1HE2  GLN  94          1HE2      GLN  94  -0.224 -18.155  -3.205
  729   2HE2  GLN  94          2HE2      GLN  94   0.772 -19.197  -2.309
  730    H    HIS  95           H        HIS  95   1.831 -12.547  -1.492
  731    HA   HIS  95           HA       HIS  95   1.254 -10.263  -3.351
  732   1HB   HIS  95          2HB       HIS  95  -0.407 -11.352  -1.054
  733   2HB   HIS  95          1HB       HIS  95  -0.828  -9.949  -2.037
  734    HD1  HIS  95           1HD      HIS  95  -0.742 -13.678  -2.082
  735    HD2  HIS  95           2HD      HIS  95  -1.598 -10.583  -4.740
  736    HE1  HIS  95           1HE      HIS  95  -1.859 -14.745  -4.086
  737    H    ASN  96           H        ASN  96   1.850 -11.280   0.018
  738    HA   ASN  96           HA       ASN  96   3.620  -9.044   0.531
  739   1HB   ASN  96          2HB       ASN  96   0.798  -8.635   0.738
  740   2HB   ASN  96          1HB       ASN  96   1.462  -8.606   2.372
  741   1HD2  ASN  96          1HD2      ASN  96   3.845  -7.359   2.224
  742   2HD2  ASN  96          2HD2      ASN  96   3.728  -5.831   1.493
  743    H    SER  97           H        SER  97   3.186  -8.874   3.340
  744    HA   SER  97           HA       SER  97   4.480 -11.300   4.248
  745   1HB   SER  97          2HB       SER  97   4.280 -10.151   6.446
  746   2HB   SER  97          1HB       SER  97   4.873  -9.062   5.195
  747    HG   SER  97           HG       SER  97   3.261  -7.914   6.012
  748    H    ALA  98           H        ALA  98   3.599 -12.970   5.547
  749    HA   ALA  98           HA       ALA  98   1.917 -14.478   6.246
  750   1HB   ALA  98          1HB       ALA  98   1.708 -12.307   7.679
  751   2HB   ALA  98          2HB       ALA  98   0.377 -13.463   7.717
  752   3HB   ALA  98          3HB       ALA  98   0.255 -12.009   6.727
  753    H    GLY  99           H        GLY  99  -0.776 -14.579   6.027
  754   1HA   GLY  99          2HA       GLY  99  -1.655 -13.659   3.376
  755   2HA   GLY  99          1HA       GLY  99  -1.452 -15.406   3.524
  756    H    LEU 100           H        LEU 100  -3.079 -12.655   5.120
  757    HA   LEU 100           HA       LEU 100  -5.352 -14.512   5.744
  758   1HB   LEU 100          2HB       LEU 100  -3.707 -12.695   7.435
  759   2HB   LEU 100          1HB       LEU 100  -5.437 -12.731   7.777
  760    HG   LEU 100           HG       LEU 100  -4.056 -15.349   7.393
  761   1HD1  LEU 100          1HD1      LEU 100  -2.970 -15.366   9.442
  762   2HD1  LEU 100          2HD1      LEU 100  -4.008 -14.112  10.119
  763   3HD1  LEU 100          3HD1      LEU 100  -2.731 -13.681   8.981
  764   1HD2  LEU 100          1HD2      LEU 100  -5.647 -15.767   9.426
  765   2HD2  LEU 100          2HD2      LEU 100  -6.359 -15.545   7.828
  766   3HD2  LEU 100          3HD2      LEU 100  -6.350 -14.211   8.982
  767    H    ILE 101           H        ILE 101  -4.489 -11.027   5.719
  768    HA   ILE 101           HA       ILE 101  -7.214 -10.183   5.158
  769    HB   ILE 101           HB       ILE 101  -4.525  -8.782   4.962
  770   1HG1  ILE 101          2HG1      ILE 101  -6.539  -8.467   7.176
  771   2HG1  ILE 101          1HG1      ILE 101  -5.415  -9.826   7.202
  772   1HG2  ILE 101          1HG2      ILE 101  -6.050  -7.434   3.749
  773   2HG2  ILE 101          2HG2      ILE 101  -6.056  -6.741   5.372
  774   3HG2  ILE 101          3HG2      ILE 101  -7.376  -7.791   4.857
  775   1HD1  ILE 101          1HD1      ILE 101  -4.602  -7.768   8.430
  776   2HD1  ILE 101          2HD1      ILE 101  -4.534  -6.947   6.870
  777   3HD1  ILE 101          3HD1      ILE 101  -3.511  -8.353   7.174
  778    H    SER 102           H        SER 102  -7.826  -9.015   3.148
  779    HA   SER 102           HA       SER 102  -7.269 -10.494   0.762
  780   1HB   SER 102          2HB       SER 102  -8.397  -7.714   1.221
  781   2HB   SER 102          1HB       SER 102  -8.532  -8.612  -0.288
  782    HG   SER 102           HG       SER 102  -9.869  -8.918   2.104
  783    H    ARG 103           H        ARG 103  -6.229  -9.604  -1.218
  784    HA   ARG 103           HA       ARG 103  -3.884  -7.855  -0.549
  785   1HB   ARG 103          2HB       ARG 103  -4.246 -10.069  -2.598
  786   2HB   ARG 103          1HB       ARG 103  -2.762  -9.148  -2.357
  787   1HG   ARG 103          2HG       ARG 103  -4.118 -10.805  -0.210
  788   2HG   ARG 103          1HG       ARG 103  -2.735 -11.342  -1.164
  789   1HD   ARG 103          2HD       ARG 103  -1.357 -10.302   0.303
  790   2HD   ARG 103          1HD       ARG 103  -2.102  -8.750  -0.127
  791    HE   ARG 103           HE       ARG 103  -3.925 -10.047   1.585
  792   1HH1  ARG 103          1HH2      ARG 103  -1.428 -10.998   2.948
  793   2HH1  ARG 103          2HH2      ARG 103  -1.115  -9.712   4.066
  794   1HH2  ARG 103          1HH1      ARG 103  -3.209  -7.456   2.469
  795   2HH2  ARG 103          2HH1      ARG 103  -2.123  -7.707   3.795
  796    H    LEU 104           H        LEU 104  -3.172  -7.600  -3.375
  797    HA   LEU 104           HA       LEU 104  -4.489  -5.219  -4.103
  798   1HB   LEU 104          2HB       LEU 104  -2.345  -6.036  -5.011
  799   2HB   LEU 104          1HB       LEU 104  -3.190  -7.343  -5.839
  800    HG   LEU 104           HG       LEU 104  -4.216  -4.609  -6.357
  801   1HD1  LEU 104          1HD1      LEU 104  -2.436  -3.812  -7.590
  802   2HD1  LEU 104          2HD1      LEU 104  -1.811  -5.427  -7.927
  803   3HD1  LEU 104          3HD1      LEU 104  -1.552  -4.692  -6.344
  804   1HD2  LEU 104          1HD2      LEU 104  -4.681  -7.076  -7.391
  805   2HD2  LEU 104          2HD2      LEU 104  -3.455  -6.492  -8.516
  806   3HD2  LEU 104          3HD2      LEU 104  -4.948  -5.582  -8.289
  807    H    LYS 105           H        LYS 105  -6.085  -4.808  -5.788
  808    HA   LYS 105           HA       LYS 105  -7.584  -6.976  -7.005
  809   1HB   LYS 105          2HB       LYS 105  -8.309  -7.145  -4.650
  810   2HB   LYS 105          1HB       LYS 105  -8.815  -5.459  -4.688
  811   1HG   LYS 105          2HG       LYS 105 -10.701  -7.082  -5.044
  812   2HG   LYS 105          1HG       LYS 105 -10.498  -5.928  -6.361
  813   1HD   LYS 105          2HD       LYS 105  -9.877  -7.536  -7.846
  814   2HD   LYS 105          1HD       LYS 105  -8.926  -8.412  -6.647
  815   1HE   LYS 105          2HE       LYS 105 -10.655  -9.810  -6.143
  816   2HE   LYS 105          1HE       LYS 105 -11.834  -8.483  -6.138
  817   1HZ   LYS 105          1HZ       LYS 105 -10.638  -9.768  -8.538
  818   2HZ   LYS 105          2HZ       LYS 105 -11.666  -8.416  -8.573
  819   3HZ   LYS 105          3HZ       LYS 105 -12.247  -9.915  -8.022
  820    H    TYR 106           H        TYR 106  -7.253  -3.516  -6.265
  821    HA   TYR 106           HA       TYR 106  -8.501  -2.955  -8.897
  822   1HB   TYR 106          2HB       TYR 106 -10.385  -2.992  -7.338
  823   2HB   TYR 106          1HB       TYR 106  -9.542  -1.879  -6.262
  824    HD1  TYR 106           1HD      TYR 106 -10.074   0.370  -6.426
  825    HD2  TYR 106           2HD      TYR 106 -10.453  -2.119  -9.898
  826    HE1  TYR 106           1HE      TYR 106 -10.858   2.324  -7.735
  827    HE2  TYR 106           2HE      TYR 106 -11.249  -0.172 -11.208
  828    HH   TYR 106           HH       TYR 106 -12.329   2.016 -10.780
  829    HA   PRO 107           HA       PRO 107  -5.159   0.043  -8.687
  830   1HB   PRO 107          2HB       PRO 107  -6.167   1.227 -11.103
  831   2HB   PRO 107          1HB       PRO 107  -4.772   0.161 -10.914
  832   1HG   PRO 107          2HG       PRO 107  -7.266  -0.451 -12.153
  833   2HG   PRO 107          1HG       PRO 107  -5.909  -1.546 -11.872
  834   1HD   PRO 107          2HD       PRO 107  -8.477  -1.470 -10.517
  835   2HD   PRO 107          1HD       PRO 107  -7.166  -2.658 -10.333
  836    H    VAL 108           H        VAL 108  -5.340   1.787  -7.378
  837    HA   VAL 108           HA       VAL 108  -7.509   3.799  -7.858
  838    HB   VAL 108           HB       VAL 108  -6.556   2.700  -5.187
  839   1HG1  VAL 108          1HG1      VAL 108  -8.914   4.501  -5.788
  840   2HG1  VAL 108          2HG1      VAL 108  -7.337   5.116  -5.293
  841   3HG1  VAL 108          3HG1      VAL 108  -8.260   4.077  -4.206
  842   1HG2  VAL 108          1HG2      VAL 108  -7.952   1.126  -6.585
  843   2HG2  VAL 108          2HG2      VAL 108  -9.235   2.335  -6.550
  844   3HG2  VAL 108          3HG2      VAL 108  -8.691   1.583  -5.051
  845    H    SER 109           H        SER 109  -6.524   5.822  -8.095
  846    HA   SER 109           HA       SER 109  -3.730   6.170  -7.087
  847   1HB   SER 109          2HB       SER 109  -5.452   7.307  -9.257
  848   2HB   SER 109          1HB       SER 109  -4.220   8.361  -8.568
  849    HG   SER 109           HG       SER 109  -2.698   6.692  -9.017
  850    H    GLN 110           H        GLN 110  -6.470   8.340  -7.590
  851    HA   GLN 110           HA       GLN 110  -6.482   9.131  -4.750
  852   1HB   GLN 110          2HB       GLN 110  -6.221  11.099  -7.048
  853   2HB   GLN 110          1HB       GLN 110  -6.103  11.458  -5.326
  854   1HG   GLN 110          2HG       GLN 110  -4.119   9.798  -5.317
  855   2HG   GLN 110          1HG       GLN 110  -4.141   9.975  -7.070
  856   1HE2  GLN 110          1HE2      GLN 110  -2.339  11.060  -4.671
  857   2HE2  GLN 110          2HE2      GLN 110  -2.103  12.681  -5.114
  858    H    GLN 111           H        GLN 111  -7.767   9.757  -8.005
  859    HA   GLN 111           HA       GLN 111  -9.966  10.065  -8.788
  860   1HB   GLN 111          2HB       GLN 111 -10.213   8.165  -6.446
  861   2HB   GLN 111          1HB       GLN 111 -11.557   8.506  -7.542
  862   1HG   GLN 111          2HG       GLN 111  -9.686   7.980  -9.381
  863   2HG   GLN 111          1HG       GLN 111  -9.016   7.027  -8.057
  864   1HE2  GLN 111          1HE2      GLN 111 -10.003   5.021  -7.613
  865   2HE2  GLN 111          2HE2      GLN 111 -11.439   4.484  -8.345
  866    H    ASN 112           H        ASN 112 -12.219  10.774  -8.111
  867    HA   ASN 112           HA       ASN 112 -12.020  12.849  -6.007
  868   1HB   ASN 112          2HB       ASN 112 -12.809  12.954  -8.611
  869   2HB   ASN 112          1HB       ASN 112 -14.360  12.671  -7.821
  870   1HD2  ASN 112          1HD2      ASN 112 -15.188  14.830  -8.078
  871   2HD2  ASN 112          2HD2      ASN 112 -14.494  16.171  -7.302
  872    H    LYS 113           H        LYS 113 -12.483   9.904  -5.576
  873    HA   LYS 113           HA       LYS 113 -13.826   8.543  -4.197
  874   1HB   LYS 113          2HB       LYS 113 -15.206  11.132  -3.432
  875   2HB   LYS 113          1HB       LYS 113 -14.942   9.706  -2.435
  876   1HG   LYS 113          2HG       LYS 113 -12.813  11.624  -3.428
  877   2HG   LYS 113          1HG       LYS 113 -13.374  11.453  -1.767
  878   1HD   LYS 113          2HD       LYS 113 -11.900   9.794  -1.412
  879   2HD   LYS 113          1HD       LYS 113 -12.594   8.866  -2.740
  880   1HE   LYS 113          2HE       LYS 113 -10.400   9.154  -3.501
  881   2HE   LYS 113          1HE       LYS 113 -11.185  10.573  -4.222
  882   1HZ   LYS 113          1HZ       LYS 113  -9.705  10.454  -1.650
  883   2HZ   LYS 113          2HZ       LYS 113 -10.652  11.782  -2.130
  884   3HZ   LYS 113          3HZ       LYS 113  -9.282  11.340  -3.033
  885    H    ASN 114           H        ASN 114 -16.470   8.520  -3.581
  886    HA   ASN 114           HA       ASN 114 -17.868   8.818  -6.222
  887   1HB   ASN 114          2HB       ASN 114 -19.031   6.713  -5.603
  888   2HB   ASN 114          1HB       ASN 114 -17.283   6.490  -5.663
  889   1HD2  ASN 114          1HD2      ASN 114 -18.629   4.647  -4.131
  890   2HD2  ASN 114          2HD2      ASN 114 -18.415   4.957  -2.476
  891    H    ALA 115           H        ALA 115 -20.420   8.116  -5.335
  892    HA   ALA 115           HA       ALA 115 -22.334   9.063  -4.325
  893   1HB   ALA 115          1HB       ALA 115 -20.465   8.393  -2.395
  894   2HB   ALA 115          2HB       ALA 115 -22.132   8.865  -2.068
  895   3HB   ALA 115          3HB       ALA 115 -20.845  10.068  -1.997
  896    HA   PRO 116           HA       PRO 116 -22.527  13.391  -5.054
  897   1HB   PRO 116          2HB       PRO 116 -23.784  14.152  -2.579
  898   2HB   PRO 116          1HB       PRO 116 -24.545  13.895  -4.152
  899   1HG   PRO 116          2HG       PRO 116 -24.727  12.234  -1.822
  900   2HG   PRO 116          1HG       PRO 116 -25.476  11.975  -3.400
  901   1HD   PRO 116          2HD       PRO 116 -23.269  10.529  -2.228
  902   2HD   PRO 116          1HD       PRO 116 -24.027  10.267  -3.818
  903    H    SER 117           H        SER 117 -21.525  15.436  -4.438
  904    HA   SER 117           HA       SER 117 -19.886  15.453  -1.954
  905   1HB   SER 117          2HB       SER 117 -18.446  14.410  -3.581
  906   2HB   SER 117          1HB       SER 117 -18.883  15.593  -4.810
  907    HG   SER 117           HG       SER 117 -17.501  16.097  -2.377
  908    H    THR 118           H        THR 118 -22.218  17.010  -2.975
  909    HA   THR 118           HA       THR 118 -21.050  19.679  -3.563
  910    HB   THR 118           HB       THR 118 -23.554  20.196  -3.786
  911    HG1  THR 118           1HG      THR 118 -24.221  18.426  -2.483
  912   1HG2  THR 118          1HG2      THR 118 -23.739  18.894  -5.917
  913   2HG2  THR 118          2HG2      THR 118 -22.289  18.004  -5.452
  914   3HG2  THR 118          3HG2      THR 118 -22.201  19.741  -5.749
  Start of MODEL    3
    1    H    THR   1           1H       THR   1  16.796  -6.077  -9.561
    2    HA   THR   1           HA       THR   1  16.337  -7.026 -12.344
    3    HB   THR   1           HB       THR   1  16.027  -9.212 -10.973
    4    HG1  THR   1           1HG      THR   1  16.162  -8.666  -8.921
    5   1HG2  THR   1          1HG2      THR   1  18.056  -8.312 -12.453
    6   2HG2  THR   1          2HG2      THR   1  18.178  -9.817 -11.541
    7   3HG2  THR   1          3HG2      THR   1  18.879  -8.335 -10.893
    8    H    GLU   2           H        GLU   2  14.162  -7.162 -12.817
    9    HA   GLU   2           HA       GLU   2  11.831  -6.900 -12.553
   10   1HB   GLU   2          2HB       GLU   2  12.829  -8.795 -10.779
   11   2HB   GLU   2          1HB       GLU   2  11.844  -7.758  -9.747
   12   1HG   GLU   2          2HG       GLU   2   9.896  -8.418 -10.724
   13   2HG   GLU   2          1HG       GLU   2  10.604  -8.444 -12.339
   14    H    ALA   3           H        ALA   3  11.630  -4.623 -12.561
   15    HA   ALA   3           HA       ALA   3  11.862  -3.207  -9.935
   16   1HB   ALA   3          1HB       ALA   3  11.536  -2.037 -12.708
   17   2HB   ALA   3          2HB       ALA   3  13.108  -2.526 -12.077
   18   3HB   ALA   3          3HB       ALA   3  12.192  -1.252 -11.273
   19    H    GLU   4           H        GLU   4  10.168  -1.021 -10.913
   20    HA   GLU   4           HA       GLU   4   7.503  -2.123 -11.425
   21   1HB   GLU   4          2HB       GLU   4   6.694  -1.229  -9.151
   22   2HB   GLU   4          1HB       GLU   4   7.637  -2.717  -9.118
   23   1HG   GLU   4          2HG       GLU   4   8.954  -1.673  -7.602
   24   2HG   GLU   4          1HG       GLU   4   9.584  -0.737  -8.956
   25    H    ASP   5           H        ASP   5   9.435   0.656 -10.303
   26    HA   ASP   5           HA       ASP   5   7.523   2.708 -10.860
   27   1HB   ASP   5          2HB       ASP   5  10.231   2.413 -10.025
   28   2HB   ASP   5          1HB       ASP   5  10.208   3.577 -11.347
   29    H    SER   6           H        SER   6   6.589   2.927 -12.875
   30    HA   SER   6           HA       SER   6   8.424   2.924 -15.246
   31   1HB   SER   6          2HB       SER   6   6.067   1.285 -14.583
   32   2HB   SER   6          1HB       SER   6   6.016   1.990 -16.196
   33    HG   SER   6           HG       SER   6   8.000   0.329 -15.044
   34    H    ILE   7           H        ILE   7   6.613   3.627 -17.180
   35    HA   ILE   7           HA       ILE   7   5.939   6.413 -16.422
   36    HB   ILE   7           HB       ILE   7   6.186   4.822 -18.983
   37   1HG1  ILE   7          2HG1      ILE   7   8.270   5.573 -17.898
   38   2HG1  ILE   7          1HG1      ILE   7   8.012   6.426 -19.419
   39   1HG2  ILE   7          1HG2      ILE   7   5.841   7.126 -20.085
   40   2HG2  ILE   7          2HG2      ILE   7   5.097   7.605 -18.559
   41   3HG2  ILE   7          3HG2      ILE   7   4.401   6.289 -19.505
   42   1HD1  ILE   7          1HD1      ILE   7   7.617   7.457 -16.608
   43   2HD1  ILE   7          2HD1      ILE   7   6.873   8.253 -17.995
   44   3HD1  ILE   7          3HD1      ILE   7   8.627   8.129 -17.887
   45    H    GLU   8           H        GLU   8   4.346   3.686 -18.114
   46    HA   GLU   8           HA       GLU   8   1.767   4.657 -18.436
   47   1HB   GLU   8          2HB       GLU   8   2.783   1.929 -17.598
   48   2HB   GLU   8          1HB       GLU   8   1.122   2.218 -18.119
   49   1HG   GLU   8          2HG       GLU   8   2.088   3.238 -20.240
   50   2HG   GLU   8          1HG       GLU   8   3.654   2.605 -19.731
   51    H    MET   9           H        MET   9   2.304   2.404 -15.726
   52    HA   MET   9           HA       MET   9   1.343   2.358 -13.569
   53   1HB   MET   9          2HB       MET   9   1.748   5.339 -13.982
   54   2HB   MET   9          1HB       MET   9   1.528   4.549 -12.421
   55   1HG   MET   9          2HG       MET   9   3.769   3.911 -14.361
   56   2HG   MET   9          1HG       MET   9   3.933   4.975 -12.964
   57   1HE   MET   9          1HE       MET   9   2.811   0.989 -13.752
   58   2HE   MET   9          2HE       MET   9   4.498   0.682 -13.348
   59   3HE   MET   9          3HE       MET   9   4.096   1.917 -14.538
   60    H    TYR  10           H        TYR  10  -0.790   1.650 -13.988
   61    HA   TYR  10           HA       TYR  10  -2.896   3.068 -15.199
   62   1HB   TYR  10          2HB       TYR  10  -2.634   0.892 -13.151
   63   2HB   TYR  10          1HB       TYR  10  -4.237   1.539 -13.498
   64    HD1  TYR  10           1HD      TYR  10  -1.216   0.044 -15.097
   65    HD2  TYR  10           2HD      TYR  10  -5.403   0.931 -15.469
   66    HE1  TYR  10           1HE      TYR  10  -1.319  -1.312 -17.171
   67    HE2  TYR  10           2HE      TYR  10  -5.505  -0.425 -17.545
   68    HH   TYR  10           HH       TYR  10  -3.477  -2.635 -18.396
   69    H    GLU  11           H        GLU  11  -3.001   2.517 -11.679
   70    HA   GLU  11           HA       GLU  11  -3.443   5.430 -11.217
   71   1HB   GLU  11          2HB       GLU  11  -5.570   3.868 -11.708
   72   2HB   GLU  11          1HB       GLU  11  -5.353   3.477 -10.004
   73   1HG   GLU  11          2HG       GLU  11  -6.826   5.323 -10.018
   74   2HG   GLU  11          1HG       GLU  11  -5.253   5.992  -9.590
   75    H    TRP  12           H        TRP  12  -3.348   2.195  -9.744
   76    HA   TRP  12           HA       TRP  12  -3.063   2.674  -7.066
   77   1HB   TRP  12          2HB       TRP  12  -1.606   0.645  -7.071
   78   2HB   TRP  12          1HB       TRP  12  -3.048   0.467  -8.068
   79    HD1  TRP  12           HD       TRP  12  -2.739   0.404 -10.698
   80    HE1  TRP  12           1HE      TRP  12  -0.674   0.012 -12.194
   81    HE3  TRP  12           3HE      TRP  12   0.975   1.046  -7.256
   82    HZ2  TRP  12           2HZ      TRP  12   2.178  -0.023 -11.957
   83    HZ3  TRP  12           3HZ      TRP  12   3.353   0.829  -7.914
   84    HH2  TRP  12           HH       TRP  12   3.960   0.295 -10.259
   85    H    TYR  13           H        TYR  13  -0.675   3.455  -9.524
   86    HA   TYR  13           HA       TYR  13   1.469   3.885  -7.555
   87   1HB   TYR  13          2HB       TYR  13   1.726   3.122  -9.962
   88   2HB   TYR  13          1HB       TYR  13   1.312   4.768 -10.448
   89    HD1  TYR  13           1HD      TYR  13   3.959   2.594  -9.451
   90    HD2  TYR  13           2HD      TYR  13   2.670   6.688  -9.320
   91    HE1  TYR  13           1HE      TYR  13   6.291   3.315  -9.013
   92    HE2  TYR  13           2HE      TYR  13   4.997   7.406  -8.884
   93    HH   TYR  13           HH       TYR  13   7.464   6.128  -9.506
   94    H    SER  14           H        SER  14   1.947   5.800  -6.550
   95    HA   SER  14           HA       SER  14   0.865   8.356  -7.620
   96   1HB   SER  14          2HB       SER  14   0.341   7.275  -4.833
   97   2HB   SER  14          1HB       SER  14  -0.178   8.846  -5.438
   98    HG   SER  14           HG       SER  14  -1.491   7.808  -6.917
   99    H    LYS  15           H        LYS  15   2.287  10.025  -7.229
  100    HA   LYS  15           HA       LYS  15   4.909   9.509  -6.161
  101   1HB   LYS  15          2HB       LYS  15   3.360  11.659  -7.422
  102   2HB   LYS  15          1HB       LYS  15   4.547  12.263  -6.266
  103   1HG   LYS  15          2HG       LYS  15   5.545  12.072  -8.506
  104   2HG   LYS  15          1HG       LYS  15   6.307  10.940  -7.388
  105   1HD   LYS  15          2HD       LYS  15   4.459   9.280  -8.252
  106   2HD   LYS  15          1HD       LYS  15   4.391  10.380  -9.629
  107   1HE   LYS  15          2HE       LYS  15   6.014   8.659 -10.159
  108   2HE   LYS  15          1HE       LYS  15   6.927  10.138  -9.795
  109   1HZ   LYS  15          1HZ       LYS  15   7.481   9.394  -7.700
  110   2HZ   LYS  15          2HZ       LYS  15   7.539   7.943  -8.580
  111   3HZ   LYS  15          3HZ       LYS  15   6.188   8.300  -7.613
  112    H    HIS  16           H        HIS  16   4.815   8.910  -3.970
  113    HA   HIS  16           HA       HIS  16   4.756   9.247  -1.648
  114   1HB   HIS  16          2HB       HIS  16   4.784  12.113  -2.644
  115   2HB   HIS  16          1HB       HIS  16   5.160  11.612  -0.997
  116    HD1  HIS  16           1HD      HIS  16   7.246   9.874  -0.790
  117    HD2  HIS  16           2HD      HIS  16   6.949  11.980  -4.375
  118    HE1  HIS  16           1HE      HIS  16   9.503   9.682  -1.923
  119    H    MET  17           H        MET  17   2.357   8.488  -2.364
  120    HA   MET  17           HA       MET  17   0.254  10.462  -1.837
  121   1HB   MET  17          2HB       MET  17  -0.078   8.583  -3.364
  122   2HB   MET  17          1HB       MET  17   0.313   7.435  -2.085
  123   1HG   MET  17          2HG       MET  17  -1.879   7.378  -1.559
  124   2HG   MET  17          1HG       MET  17  -1.737   9.051  -1.024
  125   1HE   MET  17          1HE       MET  17  -1.583  10.914  -2.487
  126   2HE   MET  17          2HE       MET  17  -2.720  11.236  -3.795
  127   3HE   MET  17          3HE       MET  17  -1.151  10.519  -4.157
  128    H    THR  18           H        THR  18  -0.270  11.101   0.206
  129    HA   THR  18           HA       THR  18   0.852  10.162   2.606
  130    HB   THR  18           HB       THR  18  -1.950  11.259   2.407
  131    HG1  THR  18           1HG      THR  18  -0.962  13.296   2.082
  132   1HG2  THR  18          1HG2      THR  18  -0.672  12.747   4.237
  133   2HG2  THR  18          2HG2      THR  18   0.311  11.288   4.341
  134   3HG2  THR  18          3HG2      THR  18  -1.425  11.204   4.640
  135    H    ARG  19           H        ARG  19   0.467   8.410   3.883
  136    HA   ARG  19           HA       ARG  19  -0.998   6.133   3.165
  137   1HB   ARG  19          2HB       ARG  19  -0.682   5.512   5.504
  138   2HB   ARG  19          1HB       ARG  19   0.732   6.424   4.976
  139   1HG   ARG  19          2HG       ARG  19  -0.392   8.510   5.917
  140   2HG   ARG  19          1HG       ARG  19  -1.597   7.441   6.642
  141   1HD   ARG  19          2HD       ARG  19  -0.185   6.908   8.337
  142   2HD   ARG  19          1HD       ARG  19   1.112   6.495   7.197
  143    HE   ARG  19           HE       ARG  19   1.971   8.683   7.466
  144   1HH1  ARG  19          1HH1      ARG  19  -0.219   8.318   9.859
  145   2HH1  ARG  19          2HH1      ARG  19  -0.737   9.969   9.939
  146   1HH2  ARG  19          1HH2      ARG  19   0.848  10.887   6.995
  147   2HH2  ARG  19          2HH2      ARG  19  -0.132  11.422   8.319
  148    H    SER  20           H        SER  20  -2.028   8.925   5.057
  149    HA   SER  20           HA       SER  20  -4.619   7.900   5.790
  150   1HB   SER  20          2HB       SER  20  -4.183   9.634   7.169
  151   2HB   SER  20          1HB       SER  20  -2.914  10.224   6.106
  152    HG   SER  20           HG       SER  20  -4.350  11.480   5.075
  153    H    GLN  21           H        GLN  21  -3.425   9.926   3.116
  154    HA   GLN  21           HA       GLN  21  -5.975  10.620   2.014
  155   1HB   GLN  21          2HB       GLN  21  -3.160  10.331   0.958
  156   2HB   GLN  21          1HB       GLN  21  -4.485  10.827  -0.098
  157   1HG   GLN  21          2HG       GLN  21  -4.076  12.219   2.533
  158   2HG   GLN  21          1HG       GLN  21  -3.085  12.661   1.146
  159   1HE2  GLN  21          1HE2      GLN  21  -5.890  13.538   2.691
  160   2HE2  GLN  21          2HE2      GLN  21  -6.745  14.189   1.377
  161    H    ALA  22           H        ALA  22  -3.767   7.878   1.413
  162    HA   ALA  22           HA       ALA  22  -5.345   6.638  -0.626
  163   1HB   ALA  22          1HB       ALA  22  -3.683   5.058  -0.503
  164   2HB   ALA  22          2HB       ALA  22  -3.846   4.900   1.246
  165   3HB   ALA  22          3HB       ALA  22  -2.905   6.226   0.566
  166    H    GLU  23           H        GLU  23  -5.270   6.267   2.912
  167    HA   GLU  23           HA       GLU  23  -7.206   4.205   3.175
  168   1HB   GLU  23          2HB       GLU  23  -6.362   6.565   4.870
  169   2HB   GLU  23          1HB       GLU  23  -7.545   5.391   5.445
  170   1HG   GLU  23          2HG       GLU  23  -5.422   3.859   4.414
  171   2HG   GLU  23          1HG       GLU  23  -4.657   5.163   5.318
  172    H    GLN  24           H        GLN  24  -7.719   7.762   3.372
  173    HA   GLN  24           HA       GLN  24 -10.562   7.555   3.539
  174   1HB   GLN  24          2HB       GLN  24 -10.484   9.978   3.050
  175   2HB   GLN  24          1HB       GLN  24  -9.260   9.524   4.232
  176   1HG   GLN  24          2HG       GLN  24  -7.581   9.420   2.387
  177   2HG   GLN  24          1HG       GLN  24  -8.818  10.002   1.272
  178   1HE2  GLN  24          1HE2      GLN  24  -7.839  10.975   4.614
  179   2HE2  GLN  24          2HE2      GLN  24  -7.693  12.625   4.242
  180    H    LEU  25           H        LEU  25  -8.445   8.198   0.678
  181    HA   LEU  25           HA       LEU  25 -10.723   8.298  -1.102
  182   1HB   LEU  25          2HB       LEU  25  -9.046   8.397  -2.834
  183   2HB   LEU  25          1HB       LEU  25  -8.422   9.299  -1.461
  184    HG   LEU  25           HG       LEU  25  -7.325   7.015  -0.793
  185   1HD1  LEU  25          1HD1      LEU  25  -7.488   5.323  -2.277
  186   2HD1  LEU  25          2HD1      LEU  25  -6.912   6.362  -3.581
  187   3HD1  LEU  25          3HD1      LEU  25  -8.632   6.297  -3.200
  188   1HD2  LEU  25          1HD2      LEU  25  -5.631   8.440  -1.303
  189   2HD2  LEU  25          2HD2      LEU  25  -6.543   9.175  -2.616
  190   3HD2  LEU  25          3HD2      LEU  25  -5.637   7.691  -2.896
  191    H    LEU  26           H        LEU  26  -8.883   5.708   0.322
  192    HA   LEU  26           HA       LEU  26  -9.684   3.667  -1.612
  193   1HB   LEU  26          2HB       LEU  26  -8.316   3.866   1.031
  194   2HB   LEU  26          1HB       LEU  26  -9.099   2.339   0.681
  195    HG   LEU  26           HG       LEU  26  -7.140   3.685  -1.195
  196   1HD1  LEU  26          1HD1      LEU  26  -5.413   2.667  -0.129
  197   2HD1  LEU  26          2HD1      LEU  26  -6.325   1.176   0.099
  198   3HD1  LEU  26          3HD1      LEU  26  -6.519   2.509   1.236
  199   1HD2  LEU  26          1HD2      LEU  26  -8.996   1.877  -1.873
  200   2HD2  LEU  26          2HD2      LEU  26  -7.789   0.766  -1.229
  201   3HD2  LEU  26          3HD2      LEU  26  -7.376   1.836  -2.567
  202    H    LYS  27           H        LYS  27 -10.596   4.317   1.801
  203    HA   LYS  27           HA       LYS  27 -12.893   2.645   1.899
  204   1HB   LYS  27          2HB       LYS  27 -11.503   4.413   3.536
  205   2HB   LYS  27          1HB       LYS  27 -13.092   5.163   3.386
  206   1HG   LYS  27          2HG       LYS  27 -13.961   2.714   3.838
  207   2HG   LYS  27          1HG       LYS  27 -12.361   2.495   4.548
  208   1HD   LYS  27          2HD       LYS  27 -12.771   4.551   5.937
  209   2HD   LYS  27          1HD       LYS  27 -14.425   4.571   5.324
  210   1HE   LYS  27          2HE       LYS  27 -13.422   1.999   6.488
  211   2HE   LYS  27          1HE       LYS  27 -13.840   3.311   7.606
  212   1HZ   LYS  27          1HZ       LYS  27 -15.595   2.488   5.363
  213   2HZ   LYS  27          2HZ       LYS  27 -15.984   3.503   6.670
  214   3HZ   LYS  27          3HZ       LYS  27 -15.744   1.839   6.923
  215    H    GLN  28           H        GLN  28 -12.554   6.048   0.934
  216    HA   GLN  28           HA       GLN  28 -15.320   6.639   0.569
  217   1HB   GLN  28          2HB       GLN  28 -13.349   8.210   0.685
  218   2HB   GLN  28          1HB       GLN  28 -12.954   7.742  -0.969
  219   1HG   GLN  28          2HG       GLN  28 -14.260   9.666  -1.280
  220   2HG   GLN  28          1HG       GLN  28 -15.438   8.368  -1.476
  221   1HE2  GLN  28          1HE2      GLN  28 -17.336   8.872  -0.385
  222   2HE2  GLN  28          2HE2      GLN  28 -17.423   9.669   1.111
  223    H    GLU  29           H        GLU  29 -12.911   5.354  -1.793
  224    HA   GLU  29           HA       GLU  29 -14.683   5.409  -4.050
  225   1HB   GLU  29          2HB       GLU  29 -12.085   4.967  -3.786
  226   2HB   GLU  29          1HB       GLU  29 -12.582   3.280  -3.681
  227   1HG   GLU  29          2HG       GLU  29 -12.546   5.098  -6.006
  228   2HG   GLU  29          1HG       GLU  29 -12.438   3.343  -5.952
  229    H    GLY  30           H        GLY  30 -13.855   2.732  -1.812
  230   1HA   GLY  30          2HA       GLY  30 -15.537   1.268  -0.893
  231   2HA   GLY  30          1HA       GLY  30 -16.572   1.704  -2.244
  232    H    LYS  31           H        LYS  31 -13.374   1.010  -3.220
  233    HA   LYS  31           HA       LYS  31 -14.260  -1.436  -4.592
  234   1HB   LYS  31          2HB       LYS  31 -11.512  -0.161  -4.393
  235   2HB   LYS  31          1HB       LYS  31 -12.077  -1.261  -5.649
  236   1HG   LYS  31          2HG       LYS  31 -12.898   1.605  -5.160
  237   2HG   LYS  31          1HG       LYS  31 -12.248   0.894  -6.633
  238   1HD   LYS  31          2HD       LYS  31 -15.003   0.456  -5.443
  239   2HD   LYS  31          1HD       LYS  31 -14.613   1.240  -6.973
  240   1HE   LYS  31          2HE       LYS  31 -13.396  -1.282  -7.161
  241   2HE   LYS  31          1HE       LYS  31 -14.979  -1.594  -6.425
  242   1HZ   LYS  31          1HZ       LYS  31 -15.092  -1.481  -8.869
  243   2HZ   LYS  31          2HZ       LYS  31 -14.530   0.121  -8.811
  244   3HZ   LYS  31          3HZ       LYS  31 -16.031  -0.281  -8.125
  245    H    GLU  32           H        GLU  32 -14.351  -3.299  -3.310
  246    HA   GLU  32           HA       GLU  32 -12.778  -3.686  -0.951
  247   1HB   GLU  32          2HB       GLU  32 -13.478  -6.099  -1.267
  248   2HB   GLU  32          1HB       GLU  32 -14.791  -4.925  -1.208
  249   1HG   GLU  32          2HG       GLU  32 -13.853  -5.201  -3.930
  250   2HG   GLU  32          1HG       GLU  32 -14.248  -6.789  -3.272
  251    H    GLY  33           H        GLY  33 -10.576  -3.430  -1.317
  252   1HA   GLY  33          2HA       GLY  33  -8.586  -4.847  -1.600
  253   2HA   GLY  33          1HA       GLY  33  -9.334  -5.465  -3.071
  254    H    GLY  34           H        GLY  34  -9.560  -2.037  -2.390
  255   1HA   GLY  34          2HA       GLY  34  -8.454  -1.265  -4.878
  256   2HA   GLY  34          1HA       GLY  34  -8.569  -0.199  -3.474
  257    H    PHE  35           H        PHE  35  -6.328  -0.609  -5.466
  258    HA   PHE  35           HA       PHE  35  -4.217  -1.312  -3.450
  259   1HB   PHE  35          2HB       PHE  35  -4.747  -2.989  -5.287
  260   2HB   PHE  35          1HB       PHE  35  -4.121  -1.802  -6.430
  261    HD1  PHE  35           1HD      PHE  35  -1.742  -1.101  -6.338
  262    HD2  PHE  35           2HD      PHE  35  -3.281  -4.222  -3.825
  263    HE1  PHE  35           1HE      PHE  35   0.570  -1.860  -5.869
  264    HE2  PHE  35           2HE      PHE  35  -0.967  -4.981  -3.352
  265    HZ   PHE  35           HZ       PHE  35   0.959  -3.799  -4.374
  266    H    ILE  36           H        ILE  36  -2.850   0.361  -3.062
  267    HA   ILE  36           HA       ILE  36  -2.258   2.287  -5.283
  268    HB   ILE  36           HB       ILE  36  -2.906   2.826  -2.360
  269   1HG1  ILE  36          2HG1      ILE  36  -4.244   3.650  -4.956
  270   2HG1  ILE  36          1HG1      ILE  36  -4.884   2.521  -3.763
  271   1HG2  ILE  36          1HG2      ILE  36  -2.536   5.224  -2.949
  272   2HG2  ILE  36          2HG2      ILE  36  -1.931   4.715  -4.525
  273   3HG2  ILE  36          3HG2      ILE  36  -1.059   4.268  -3.060
  274   1HD1  ILE  36          1HD1      ILE  36  -4.421   5.497  -3.415
  275   2HD1  ILE  36          2HD1      ILE  36  -4.784   4.415  -2.070
  276   3HD1  ILE  36          3HD1      ILE  36  -5.959   4.638  -3.367
  277    H    VAL  37           H        VAL  37  -0.114   3.363  -4.937
  278    HA   VAL  37           HA       VAL  37   1.668   2.128  -2.921
  279    HB   VAL  37           HB       VAL  37   2.128   1.975  -5.918
  280   1HG1  VAL  37          1HG1      VAL  37   4.194   2.289  -4.557
  281   2HG1  VAL  37          2HG1      VAL  37   4.136   0.703  -5.327
  282   3HG1  VAL  37          3HG1      VAL  37   3.759   0.864  -3.612
  283   1HG2  VAL  37          1HG2      VAL  37   2.039  -0.528  -5.401
  284   2HG2  VAL  37          2HG2      VAL  37   0.496   0.324  -5.324
  285   3HG2  VAL  37          3HG2      VAL  37   1.353  -0.086  -3.838
  286    H    ARG  38           H        ARG  38   3.621   3.383  -2.610
  287    HA   ARG  38           HA       ARG  38   3.941   5.845  -4.242
  288   1HB   ARG  38          2HB       ARG  38   3.841   7.240  -2.179
  289   2HB   ARG  38          1HB       ARG  38   2.312   6.424  -2.504
  290   1HG   ARG  38          2HG       ARG  38   2.571   5.955  -0.244
  291   2HG   ARG  38          1HG       ARG  38   3.355   4.545  -0.954
  292   1HD   ARG  38          2HD       ARG  38   5.327   5.113   0.005
  293   2HD   ARG  38          1HD       ARG  38   5.254   6.728  -0.727
  294    HE   ARG  38           HE       ARG  38   4.042   5.989   1.897
  295   1HH1  ARG  38          1HH1      ARG  38   2.772   8.183   0.081
  296   2HH1  ARG  38          2HH1      ARG  38   3.436   9.601   0.820
  297   1HH2  ARG  38          1HH2      ARG  38   5.844   7.864   2.611
  298   2HH2  ARG  38          2HH2      ARG  38   5.175   9.421   2.252
  299    H    ASP  39           H        ASP  39   6.009   6.909  -3.839
  300    HA   ASP  39           HA       ASP  39   8.132   5.010  -3.110
  301   1HB   ASP  39          2HB       ASP  39   7.984   6.783  -5.023
  302   2HB   ASP  39          1HB       ASP  39   8.465   7.931  -3.774
  303    H    SER  40           H        SER  40   9.763   5.498  -1.472
  304    HA   SER  40           HA       SER  40   8.649   7.046   0.829
  305   1HB   SER  40          2HB       SER  40   9.271   4.566   0.917
  306   2HB   SER  40          1HB       SER  40  10.950   5.078   0.770
  307    HG   SER  40           HG       SER  40   9.205   5.253   2.894
  308    H    SER  41           H        SER  41  11.289   7.186   2.118
  309    HA   SER  41           HA       SER  41  12.872   8.951   0.322
  310   1HB   SER  41          2HB       SER  41  12.663  10.821   1.853
  311   2HB   SER  41          1HB       SER  41  11.039  10.254   1.467
  312    HG   SER  41           HG       SER  41  11.934  10.581   3.821
  313    H    LYS  42           H        LYS  42  12.564   7.891   3.740
  314    HA   LYS  42           HA       LYS  42  15.298   8.102   4.460
  315   1HB   LYS  42          2HB       LYS  42  13.133   6.156   5.330
  316   2HB   LYS  42          1HB       LYS  42  14.631   6.448   6.216
  317   1HG   LYS  42          2HG       LYS  42  14.006   8.604   6.838
  318   2HG   LYS  42          1HG       LYS  42  12.893   8.781   5.481
  319   1HD   LYS  42          2HD       LYS  42  11.279   7.330   6.499
  320   2HD   LYS  42          1HD       LYS  42  12.428   6.815   7.734
  321   1HE   LYS  42          2HE       LYS  42  11.052   8.427   8.833
  322   2HE   LYS  42          1HE       LYS  42  12.519   9.329   8.402
  323   1HZ   LYS  42          1HZ       LYS  42  10.520  10.505   7.678
  324   2HZ   LYS  42          2HZ       LYS  42  10.050   9.160   6.753
  325   3HZ   LYS  42          3HZ       LYS  42  11.457  10.023   6.349
  326    H    ALA  43           H        ALA  43  13.646   4.998   3.789
  327    HA   ALA  43           HA       ALA  43  16.217   3.748   3.041
  328   1HB   ALA  43          1HB       ALA  43  14.140   1.958   2.583
  329   2HB   ALA  43          2HB       ALA  43  13.504   2.986   3.867
  330   3HB   ALA  43          3HB       ALA  43  15.024   2.121   4.100
  331    H    GLY  44           H        GLY  44  13.581   5.311   1.479
  332   1HA   GLY  44          2HA       GLY  44  13.208   5.698  -0.820
  333   2HA   GLY  44          1HA       GLY  44  14.704   4.809  -1.161
  334    H    LYS  45           H        LYS  45  12.213   3.471   0.878
  335    HA   LYS  45           HA       LYS  45  11.920   1.187  -0.952
  336   1HB   LYS  45          2HB       LYS  45  10.800   0.195   0.981
  337   2HB   LYS  45          1HB       LYS  45  12.287   0.983   1.507
  338   1HG   LYS  45          2HG       LYS  45  10.510   3.046   1.723
  339   2HG   LYS  45          1HG       LYS  45   9.474   1.673   2.109
  340   1HD   LYS  45          2HD       LYS  45  10.558   1.237   4.065
  341   2HD   LYS  45          1HD       LYS  45  12.140   1.630   3.392
  342   1HE   LYS  45          2HE       LYS  45  11.730   4.008   3.637
  343   2HE   LYS  45          1HE       LYS  45  10.045   3.711   4.111
  344   1HZ   LYS  45          1HZ       LYS  45  12.464   2.757   5.551
  345   2HZ   LYS  45          2HZ       LYS  45  10.864   2.374   5.972
  346   3HZ   LYS  45          3HZ       LYS  45  11.412   3.979   6.075
  347    H    TYR  46           H        TYR  46   9.449   0.332  -0.930
  348    HA   TYR  46           HA       TYR  46   7.750   2.658  -1.778
  349   1HB   TYR  46          2HB       TYR  46   7.572  -0.248  -2.638
  350   2HB   TYR  46          1HB       TYR  46   6.753   1.125  -3.373
  351    HD1  TYR  46           1HD      TYR  46   8.594  -0.889  -4.787
  352    HD2  TYR  46           2HD      TYR  46   9.345   2.954  -3.026
  353    HE1  TYR  46           1HE      TYR  46  10.519  -0.565  -6.312
  354    HE2  TYR  46           2HE      TYR  46  11.270   3.278  -4.549
  355    HH   TYR  46           HH       TYR  46  11.768   1.504  -7.281
  356    H    THR  47           H        THR  47   5.416   2.411  -1.338
  357    HA   THR  47           HA       THR  47   4.810   0.541   0.927
  358    HB   THR  47           HB       THR  47   4.028   3.453   0.550
  359    HG1  THR  47           1HG      THR  47   5.243   3.637   2.510
  360   1HG2  THR  47          1HG2      THR  47   3.358   2.664   3.138
  361   2HG2  THR  47          2HG2      THR  47   2.837   1.307   2.141
  362   3HG2  THR  47          3HG2      THR  47   2.225   2.928   1.813
  363    H    VAL  48           H        VAL  48   3.018  -0.696   0.533
  364    HA   VAL  48           HA       VAL  48   1.363  -0.013  -1.863
  365    HB   VAL  48           HB       VAL  48   1.820  -2.519  -0.222
  366   1HG1  VAL  48          1HG1      VAL  48  -0.063  -1.966  -2.518
  367   2HG1  VAL  48          2HG1      VAL  48  -0.424  -2.726  -0.968
  368   3HG1  VAL  48          3HG1      VAL  48   0.529  -3.592  -2.172
  369   1HG2  VAL  48          1HG2      VAL  48   2.488  -1.856  -3.104
  370   2HG2  VAL  48          2HG2      VAL  48   2.952  -3.313  -2.224
  371   3HG2  VAL  48          3HG2      VAL  48   3.637  -1.752  -1.770
  372    H    SER  49           H        SER  49  -0.375   1.236  -1.279
  373    HA   SER  49           HA       SER  49  -1.755   0.810   1.316
  374   1HB   SER  49          2HB       SER  49  -1.723   2.844  -0.899
  375   2HB   SER  49          1HB       SER  49  -3.066   2.828   0.240
  376    HG   SER  49           HG       SER  49  -0.719   3.921   0.573
  377    H    VAL  50           H        VAL  50  -3.256  -0.897   1.231
  378    HA   VAL  50           HA       VAL  50  -5.076  -0.907  -1.157
  379    HB   VAL  50           HB       VAL  50  -5.013  -3.345  -1.083
  380   1HG1  VAL  50          1HG1      VAL  50  -2.267  -2.078  -0.873
  381   2HG1  VAL  50          2HG1      VAL  50  -3.200  -2.353  -2.341
  382   3HG1  VAL  50          3HG1      VAL  50  -2.549  -3.722  -1.443
  383   1HG2  VAL  50          1HG2      VAL  50  -3.743  -4.566   0.578
  384   2HG2  VAL  50          2HG2      VAL  50  -4.833  -3.478   1.430
  385   3HG2  VAL  50          3HG2      VAL  50  -3.124  -3.070   1.276
  386    H    PHE  51           H        PHE  51  -7.308  -1.175  -0.697
  387    HA   PHE  51           HA       PHE  51  -8.007  -1.679   2.180
  388   1HB   PHE  51          2HB       PHE  51  -8.721   0.460   2.328
  389   2HB   PHE  51          1HB       PHE  51  -8.159   0.742   0.686
  390    HD1  PHE  51           1HD      PHE  51 -11.053   0.336   2.820
  391    HD2  PHE  51           2HD      PHE  51  -9.705   0.181  -1.252
  392    HE1  PHE  51           1HE      PHE  51 -13.396   0.508   2.035
  393    HE2  PHE  51           2HE      PHE  51 -12.042   0.367  -2.032
  394    HZ   PHE  51           HZ       PHE  51 -13.890   0.523  -0.391
  395    H    ALA  52           H        ALA  52 -10.439  -2.121   2.391
  396    HA   ALA  52           HA       ALA  52 -11.906  -2.980   0.036
  397   1HB   ALA  52          1HB       ALA  52 -10.150  -4.782   0.447
  398   2HB   ALA  52          2HB       ALA  52 -11.821  -5.344   0.379
  399   3HB   ALA  52          3HB       ALA  52 -11.019  -5.152   1.938
  400    H    LYS  53           H        LYS  53 -14.065  -3.795   0.602
  401    HA   LYS  53           HA       LYS  53 -14.901  -2.959   3.367
  402   1HB   LYS  53          2HB       LYS  53 -16.113  -2.829   0.608
  403   2HB   LYS  53          1HB       LYS  53 -17.133  -2.708   2.042
  404   1HG   LYS  53          2HG       LYS  53 -15.364  -0.922   2.805
  405   2HG   LYS  53          1HG       LYS  53 -14.987  -0.838   1.084
  406   1HD   LYS  53          2HD       LYS  53 -17.288  -0.282   0.550
  407   2HD   LYS  53          1HD       LYS  53 -17.776  -0.526   2.229
  408   1HE   LYS  53          2HE       LYS  53 -15.816   1.291   2.623
  409   2HE   LYS  53          1HE       LYS  53 -16.343   1.776   0.999
  410   1HZ   LYS  53          1HZ       LYS  53 -18.666   1.627   1.838
  411   2HZ   LYS  53          2HZ       LYS  53 -17.755   2.866   2.559
  412   3HZ   LYS  53          3HZ       LYS  53 -18.048   1.421   3.404
  413    H    SER  54           H        SER  54 -14.055  -5.550   3.424
  414    HA   SER  54           HA       SER  54 -16.523  -7.059   3.850
  415   1HB   SER  54          2HB       SER  54 -15.844  -8.798   2.108
  416   2HB   SER  54          1HB       SER  54 -16.432  -7.266   1.470
  417    HG   SER  54           HG       SER  54 -13.722  -8.047   1.826
  418    H    THR  55           H        THR  55 -14.976  -6.812   5.895
  419    HA   THR  55           HA       THR  55 -13.941  -9.421   6.519
  420    HB   THR  55           HB       THR  55 -12.165  -8.686   4.955
  421    HG1  THR  55           1HG      THR  55 -10.591  -9.329   6.250
  422   1HG2  THR  55          1HG2      THR  55 -10.843  -6.695   6.454
  423   2HG2  THR  55          2HG2      THR  55 -12.533  -6.199   6.364
  424   3HG2  THR  55          3HG2      THR  55 -11.625  -6.508   4.885
  425    H    GLY  56           H        GLY  56 -11.766  -7.748   8.203
  426   1HA   GLY  56          2HA       GLY  56 -13.144  -7.642  10.646
  427   2HA   GLY  56          1HA       GLY  56 -11.748  -6.622  10.279
  428    H    ASP  57           H        ASP  57 -12.983  -5.298   8.039
  429    HA   ASP  57           HA       ASP  57 -15.073  -3.643   9.403
  430   1HB   ASP  57          2HB       ASP  57 -12.519  -2.932   8.785
  431   2HB   ASP  57          1HB       ASP  57 -13.342  -2.509   7.287
  432    HA   PRO  58           HA       PRO  58 -16.913  -5.733   5.698
  433   1HB   PRO  58          2HB       PRO  58 -19.425  -4.788   6.735
  434   2HB   PRO  58          1HB       PRO  58 -18.821  -6.446   6.659
  435   1HG   PRO  58          2HG       PRO  58 -19.070  -4.737   8.967
  436   2HG   PRO  58          1HG       PRO  58 -18.557  -6.425   8.905
  437   1HD   PRO  58          2HD       PRO  58 -16.922  -4.167   9.470
  438   2HD   PRO  58          1HD       PRO  58 -16.372  -5.838   9.192
  439    H    GLN  59           H        GLN  59 -17.147  -2.466   6.902
  440    HA   GLN  59           HA       GLN  59 -18.198  -1.603   4.230
  441   1HB   GLN  59          2HB       GLN  59 -18.978   0.414   5.580
  442   2HB   GLN  59          1HB       GLN  59 -19.755  -1.118   5.982
  443   1HG   GLN  59          2HG       GLN  59 -18.537  -1.360   7.975
  444   2HG   GLN  59          1HG       GLN  59 -17.286  -0.231   7.457
  445   1HE2  GLN  59          1HE2      GLN  59 -20.453  -0.479   8.955
  446   2HE2  GLN  59          2HE2      GLN  59 -20.633   1.174   9.297
  447    H    GLY  60           H        GLY  60 -15.242  -1.860   5.412
  448   1HA   GLY  60          2HA       GLY  60 -13.990  -0.009   3.825
  449   2HA   GLY  60          1HA       GLY  60 -14.362   0.901   5.278
  450    H    VAL  61           H        VAL  61 -12.201  -1.308   3.836
  451    HA   VAL  61           HA       VAL  61 -10.721  -1.582   6.435
  452    HB   VAL  61           HB       VAL  61 -10.753  -3.532   4.111
  453   1HG1  VAL  61          1HG1      VAL  61  -8.783  -3.479   5.694
  454   2HG1  VAL  61          2HG1      VAL  61  -9.630  -5.024   5.618
  455   3HG1  VAL  61          3HG1      VAL  61  -9.896  -3.939   6.983
  456   1HG2  VAL  61          1HG2      VAL  61 -12.093  -4.188   6.685
  457   2HG2  VAL  61          2HG2      VAL  61 -12.486  -4.703   5.044
  458   3HG2  VAL  61          3HG2      VAL  61 -12.939  -3.096   5.591
  459    H    ILE  62           H        ILE  62  -8.526  -1.214   6.308
  460    HA   ILE  62           HA       ILE  62  -7.309  -0.719   3.640
  461    HB   ILE  62           HB       ILE  62  -6.716   1.369   5.624
  462   1HG1  ILE  62          2HG1      ILE  62  -9.550   1.009   4.597
  463   2HG1  ILE  62          1HG1      ILE  62  -9.041   0.973   6.276
  464   1HG2  ILE  62          1HG2      ILE  62  -6.197   2.343   3.666
  465   2HG2  ILE  62          2HG2      ILE  62  -7.904   2.361   3.235
  466   3HG2  ILE  62          3HG2      ILE  62  -6.893   0.990   2.781
  467   1HD1  ILE  62          1HD1      ILE  62  -9.311   3.181   6.404
  468   2HD1  ILE  62          2HD1      ILE  62  -9.784   3.229   4.706
  469   3HD1  ILE  62          3HD1      ILE  62  -8.086   3.400   5.154
  470    H    ARG  63           H        ARG  63  -4.959  -0.510   3.747
  471    HA   ARG  63           HA       ARG  63  -3.448  -0.902   6.178
  472   1HB   ARG  63          2HB       ARG  63  -4.793  -3.140   5.378
  473   2HB   ARG  63          1HB       ARG  63  -3.278  -3.343   4.500
  474   1HG   ARG  63          2HG       ARG  63  -3.507  -2.823   7.480
  475   2HG   ARG  63          1HG       ARG  63  -3.183  -4.393   6.747
  476   1HD   ARG  63          2HD       ARG  63  -1.235  -2.956   5.543
  477   2HD   ARG  63          1HD       ARG  63  -1.372  -2.050   7.062
  478    HE   ARG  63           HE       ARG  63  -1.417  -4.840   7.668
  479   1HH1  ARG  63          1HH1      ARG  63   0.487  -2.125   7.875
  480   2HH1  ARG  63          2HH1      ARG  63   2.007  -2.955   7.877
  481   1HH2  ARG  63          1HH2      ARG  63   0.629  -6.034   7.073
  482   2HH2  ARG  63          2HH2      ARG  63   2.088  -5.169   7.423
  483    H    HIS  64           H        HIS  64  -1.509   0.049   5.626
  484    HA   HIS  64           HA       HIS  64  -0.722   0.091   2.753
  485   1HB   HIS  64          2HB       HIS  64   0.652   1.553   5.004
  486   2HB   HIS  64          1HB       HIS  64   0.526   2.014   3.308
  487    HD1  HIS  64           1HD      HIS  64  -1.749   3.030   2.509
  488    HD2  HIS  64           2HD      HIS  64  -1.561   2.307   6.608
  489    HE1  HIS  64           1HE      HIS  64  -3.707   4.256   3.541
  490    H    TYR  65           H        TYR  65   0.412  -1.794   2.309
  491    HA   TYR  65           HA       TYR  65   2.298  -2.959   4.237
  492   1HB   TYR  65          2HB       TYR  65   2.056  -3.504   1.280
  493   2HB   TYR  65          1HB       TYR  65   2.594  -4.604   2.542
  494    HD1  TYR  65           1HD      TYR  65   0.454  -3.998   4.608
  495    HD2  TYR  65           2HD      TYR  65   0.202  -4.710   0.379
  496    HE1  TYR  65           1HE      TYR  65  -1.858  -4.837   4.887
  497    HE2  TYR  65           2HE      TYR  65  -2.107  -5.548   0.660
  498    HH   TYR  65           HH       TYR  65  -3.380  -6.557   3.404
  499    H    VAL  66           H        VAL  66   4.339  -2.134   4.457
  500    HA   VAL  66           HA       VAL  66   5.463  -0.588   2.150
  501    HB   VAL  66           HB       VAL  66   6.177  -0.426   5.095
  502   1HG1  VAL  66          1HG1      VAL  66   7.017   1.862   4.269
  503   2HG1  VAL  66          2HG1      VAL  66   6.837   1.212   2.639
  504   3HG1  VAL  66          3HG1      VAL  66   7.953   0.451   3.773
  505   1HG2  VAL  66          1HG2      VAL  66   4.241   0.703   5.388
  506   2HG2  VAL  66          2HG2      VAL  66   3.850   0.556   3.676
  507   3HG2  VAL  66          3HG2      VAL  66   4.822   1.913   4.244
  508    H    VAL  67           H        VAL  67   7.913  -0.673   2.067
  509    HA   VAL  67           HA       VAL  67   8.845  -3.436   2.762
  510    HB   VAL  67           HB       VAL  67   9.612  -1.560   0.504
  511   1HG1  VAL  67          1HG1      VAL  67  10.307  -4.456   0.519
  512   2HG1  VAL  67          2HG1      VAL  67  11.241  -3.409   1.584
  513   3HG1  VAL  67          3HG1      VAL  67  11.200  -3.091  -0.148
  514   1HG2  VAL  67          1HG2      VAL  67   7.544  -3.631   0.846
  515   2HG2  VAL  67          2HG2      VAL  67   8.553  -3.869  -0.582
  516   3HG2  VAL  67          3HG2      VAL  67   7.667  -2.357  -0.367
  517    H    CYS  68           H        CYS  68  10.593  -3.553   4.089
  518    HA   CYS  68           HA       CYS  68  11.951  -1.050   4.901
  519   1HB   CYS  68          2HB       CYS  68  11.036  -2.771   6.513
  520   2HB   CYS  68          1HB       CYS  68  12.241  -3.903   5.900
  521    HG   CYS  68           HG       CYS  68  12.914  -2.220   8.086
  522    H    SER  69           H        SER  69  14.363  -1.008   4.885
  523    HA   SER  69           HA       SER  69  15.527  -2.855   2.834
  524   1HB   SER  69          2HB       SER  69  15.744   0.140   3.190
  525   2HB   SER  69          1HB       SER  69  16.794  -0.780   2.117
  526    HG   SER  69           HG       SER  69  14.125  -0.104   1.875
  527    H    THR  70           H        THR  70  17.545  -3.643   3.307
  528    HA   THR  70           HA       THR  70  18.843  -2.716   5.844
  529    HB   THR  70           HB       THR  70  17.958  -5.073   5.678
  530    HG1  THR  70           1HG      THR  70  19.898  -6.013   6.416
  531   1HG2  THR  70          1HG2      THR  70  18.804  -5.070   3.138
  532   2HG2  THR  70          2HG2      THR  70  18.644  -6.556   4.073
  533   3HG2  THR  70          3HG2      THR  70  20.224  -5.797   3.891
  534    HA   PRO  71           HA       PRO  71  22.216  -1.203   3.494
  535   1HB   PRO  71          2HB       PRO  71  24.268  -2.275   5.200
  536   2HB   PRO  71          1HB       PRO  71  23.625  -0.631   5.164
  537   1HG   PRO  71          2HG       PRO  71  23.220  -2.603   7.185
  538   2HG   PRO  71          1HG       PRO  71  22.502  -0.993   7.096
  539   1HD   PRO  71          2HD       PRO  71  21.226  -3.565   6.649
  540   2HD   PRO  71          1HD       PRO  71  20.473  -1.954   6.693
  541    H    GLN  72           H        GLN  72  21.667  -4.496   3.619
  542    HA   GLN  72           HA       GLN  72  24.144  -5.196   2.129
  543   1HB   GLN  72          2HB       GLN  72  23.337  -6.653   3.939
  544   2HB   GLN  72          1HB       GLN  72  21.771  -6.797   3.152
  545   1HG   GLN  72          2HG       GLN  72  23.265  -8.766   2.751
  546   2HG   GLN  72          1HG       GLN  72  22.771  -7.965   1.264
  547   1HE2  GLN  72          1HE2      GLN  72  25.514  -8.716   3.317
  548   2HE2  GLN  72          2HE2      GLN  72  26.700  -8.032   2.314
  549    H    SER  73           H        SER  73  21.848  -3.419   1.122
  550    HA   SER  73           HA       SER  73  20.738  -3.077  -0.935
  551   1HB   SER  73          2HB       SER  73  23.117  -4.387  -1.435
  552   2HB   SER  73          1HB       SER  73  21.945  -5.455  -2.199
  553    HG   SER  73           HG       SER  73  22.515  -2.742  -2.708
  554    H    GLN  74           H        GLN  74  19.314  -4.454   0.988
  555    HA   GLN  74           HA       GLN  74  17.812  -6.471  -0.638
  556   1HB   GLN  74          2HB       GLN  74  18.066  -6.873   2.292
  557   2HB   GLN  74          1HB       GLN  74  18.090  -8.065   0.999
  558   1HG   GLN  74          2HG       GLN  74  20.388  -7.037   0.382
  559   2HG   GLN  74          1HG       GLN  74  20.345  -6.325   1.994
  560   1HE2  GLN  74          1HE2      GLN  74  20.704  -9.338   0.207
  561   2HE2  GLN  74          2HE2      GLN  74  21.055 -10.315   1.551
  562    H    TYR  75           H        TYR  75  15.585  -6.876   0.401
  563    HA   TYR  75           HA       TYR  75  14.562  -4.534   1.953
  564   1HB   TYR  75          2HB       TYR  75  13.341  -5.502  -0.639
  565   2HB   TYR  75          1HB       TYR  75  12.877  -4.078   0.280
  566    HD1  TYR  75           1HD      TYR  75  14.000  -2.011   0.006
  567    HD2  TYR  75           2HD      TYR  75  15.635  -5.592  -1.698
  568    HE1  TYR  75           1HE      TYR  75  15.663  -0.664  -1.234
  569    HE2  TYR  75           2HE      TYR  75  17.302  -4.250  -2.934
  570    HH   TYR  75           HH       TYR  75  17.073  -1.194  -3.597
  571    H    TYR  76           H        TYR  76  12.391  -4.918   2.845
  572    HA   TYR  76           HA       TYR  76  10.914  -7.365   2.528
  573   1HB   TYR  76          2HB       TYR  76  11.571  -8.457   4.672
  574   2HB   TYR  76          1HB       TYR  76  12.938  -8.327   3.576
  575    HD1  TYR  76           1HD      TYR  76  11.314  -6.812   6.541
  576    HD2  TYR  76           2HD      TYR  76  14.864  -6.992   4.142
  577    HE1  TYR  76           1HE      TYR  76  12.547  -5.575   8.289
  578    HE2  TYR  76           2HE      TYR  76  16.103  -5.751   5.889
  579    HH   TYR  76           HH       TYR  76  15.517  -4.128   7.756
  580    H    LEU  77           H        LEU  77   9.155  -7.542   4.140
  581    HA   LEU  77           HA       LEU  77   8.476  -4.904   5.391
  582   1HB   LEU  77          2HB       LEU  77   7.018  -6.475   3.762
  583   2HB   LEU  77          1HB       LEU  77   6.637  -7.282   5.283
  584    HG   LEU  77           HG       LEU  77   6.478  -4.323   5.343
  585   1HD1  LEU  77          1HD1      LEU  77   5.518  -5.092   3.073
  586   2HD1  LEU  77          2HD1      LEU  77   4.465  -4.124   4.106
  587   3HD1  LEU  77          3HD1      LEU  77   4.250  -5.873   4.017
  588   1HD2  LEU  77          1HD2      LEU  77   4.720  -4.750   6.857
  589   2HD2  LEU  77          2HD2      LEU  77   5.839  -6.081   7.148
  590   3HD2  LEU  77          3HD2      LEU  77   4.394  -6.341   6.170
  591    H    ALA  78           H        ALA  78   9.732  -7.949   5.950
  592    HA   ALA  78           HA       ALA  78   9.790  -7.623   8.869
  593   1HB   ALA  78          1HB       ALA  78   9.134 -10.298   8.598
  594   2HB   ALA  78          2HB       ALA  78   8.125  -9.554   7.358
  595   3HB   ALA  78          3HB       ALA  78   7.981  -9.038   9.038
  596    H    GLU  79           H        GLU  79  11.956  -8.015   9.301
  597    HA   GLU  79           HA       GLU  79  13.906  -8.725   7.451
  598   1HB   GLU  79          2HB       GLU  79  13.611  -8.851  10.422
  599   2HB   GLU  79          1HB       GLU  79  15.027  -9.634   9.716
  600   1HG   GLU  79          2HG       GLU  79  15.444  -7.488   8.433
  601   2HG   GLU  79          1HG       GLU  79  14.190  -6.741   9.425
  602    H    LYS  80           H        LYS  80  11.610 -10.835   8.922
  603    HA   LYS  80           HA       LYS  80  12.725 -13.361   9.059
  604   1HB   LYS  80          2HB       LYS  80  10.145 -12.170   8.228
  605   2HB   LYS  80          1HB       LYS  80  10.391 -13.840   7.716
  606   1HG   LYS  80          2HG       LYS  80  11.185 -13.313  10.506
  607   2HG   LYS  80          1HG       LYS  80   9.463 -13.092  10.194
  608   1HD   LYS  80          2HD       LYS  80   9.368 -15.347  10.516
  609   2HD   LYS  80          1HD       LYS  80   9.923 -15.416   8.844
  610   1HE   LYS  80          2HE       LYS  80  12.116 -15.061  10.779
  611   2HE   LYS  80          1HE       LYS  80  11.238 -16.593  10.963
  612   1HZ   LYS  80          1HZ       LYS  80  12.157 -15.521   8.351
  613   2HZ   LYS  80          2HZ       LYS  80  11.495 -17.056   8.657
  614   3HZ   LYS  80          3HZ       LYS  80  13.035 -16.655   9.255
  615    H    HIS  81           H        HIS  81  11.899 -11.576   6.093
  616    HA   HIS  81           HA       HIS  81  13.779 -13.247   4.539
  617   1HB   HIS  81          2HB       HIS  81  10.775 -13.167   4.156
  618   2HB   HIS  81          1HB       HIS  81  11.870 -13.661   2.863
  619    HD1  HIS  81           1HD      HIS  81  10.075 -14.982   5.726
  620    HD2  HIS  81           2HD      HIS  81  13.619 -15.941   3.754
  621    HE1  HIS  81           1HE      HIS  81  10.672 -17.339   6.432
  622    H    LEU  82           H        LEU  82  14.595 -12.013   2.782
  623    HA   LEU  82           HA       LEU  82  13.145  -9.535   2.061
  624   1HB   LEU  82          2HB       LEU  82  15.100  -8.170   2.615
  625   2HB   LEU  82          1HB       LEU  82  14.611  -9.094   4.032
  626    HG   LEU  82           HG       LEU  82  16.724 -10.066   2.120
  627   1HD1  LEU  82          1HD1      LEU  82  17.597  -8.966   4.713
  628   2HD1  LEU  82          2HD1      LEU  82  16.960  -7.757   3.599
  629   3HD1  LEU  82          3HD1      LEU  82  18.313  -8.776   3.115
  630   1HD2  LEU  82          1HD2      LEU  82  17.263 -10.973   4.688
  631   2HD2  LEU  82          2HD2      LEU  82  16.439 -11.902   3.437
  632   3HD2  LEU  82          3HD2      LEU  82  15.500 -10.998   4.626
  633    H    PHE  83           H        PHE  83  13.563  -8.857  -0.034
  634    HA   PHE  83           HA       PHE  83  15.390 -10.596  -1.651
  635   1HB   PHE  83          2HB       PHE  83  12.823  -9.087  -2.189
  636   2HB   PHE  83          1HB       PHE  83  13.833  -9.683  -3.510
  637    HD1  PHE  83           1HD      PHE  83  13.608 -11.895  -4.246
  638    HD2  PHE  83           2HD      PHE  83  12.201 -10.816  -0.334
  639    HE1  PHE  83           1HE      PHE  83  12.648 -14.164  -3.965
  640    HE2  PHE  83           2HE      PHE  83  11.241 -13.085  -0.052
  641    HZ   PHE  83           HZ       PHE  83  11.465 -14.760  -1.869
  642    H    SER  84           H        SER  84  15.489  -8.868  -3.914
  643    HA   SER  84           HA       SER  84  17.265  -6.734  -2.825
  644   1HB   SER  84          2HB       SER  84  17.318  -8.622  -4.996
  645   2HB   SER  84          1HB       SER  84  17.428  -6.994  -5.659
  646    HG   SER  84           HG       SER  84  19.104  -8.304  -3.808
  647    H    THR  85           H        THR  85  14.085  -6.884  -3.672
  648    HA   THR  85           HA       THR  85  13.926  -4.021  -4.211
  649    HB   THR  85           HB       THR  85  12.857  -5.743  -6.433
  650    HG1  THR  85           1HG      THR  85  14.820  -6.348  -6.832
  651   1HG2  THR  85          1HG2      THR  85  12.484  -3.744  -7.392
  652   2HG2  THR  85          2HG2      THR  85  14.145  -3.227  -7.101
  653   3HG2  THR  85          3HG2      THR  85  12.921  -3.009  -5.850
  654    H    ILE  86           H        ILE  86  11.632  -3.301  -4.375
  655    HA   ILE  86           HA       ILE  86   9.885  -4.705  -2.593
  656    HB   ILE  86           HB       ILE  86   9.706  -2.405  -4.515
  657   1HG1  ILE  86          2HG1      ILE  86   8.838  -1.589  -2.054
  658   2HG1  ILE  86          1HG1      ILE  86   9.933  -2.896  -1.612
  659   1HG2  ILE  86          1HG2      ILE  86   7.503  -3.212  -4.803
  660   2HG2  ILE  86          2HG2      ILE  86   7.348  -2.065  -3.473
  661   3HG2  ILE  86          3HG2      ILE  86   7.406  -3.796  -3.142
  662   1HD1  ILE  86          1HD1      ILE  86  11.682  -1.533  -1.972
  663   2HD1  ILE  86          2HD1      ILE  86  10.591  -0.246  -2.482
  664   3HD1  ILE  86          3HD1      ILE  86  11.210  -1.398  -3.665
  665    HA   PRO  87           HA       PRO  87   7.400  -5.933  -6.641
  666   1HB   PRO  87          2HB       PRO  87   9.405  -6.221  -8.689
  667   2HB   PRO  87          1HB       PRO  87   7.998  -5.153  -8.686
  668   1HG   PRO  87          2HG       PRO  87  10.784  -4.461  -8.309
  669   2HG   PRO  87          1HG       PRO  87   9.392  -3.385  -8.455
  670   1HD   PRO  87          2HD       PRO  87  10.902  -3.886  -6.108
  671   2HD   PRO  87          1HD       PRO  87   9.356  -3.013  -6.201
  672    H    GLU  88           H        GLU  88  10.801  -6.814  -6.140
  673    HA   GLU  88           HA       GLU  88  10.607  -9.587  -6.863
  674   1HB   GLU  88          2HB       GLU  88  12.616  -7.949  -6.307
  675   2HB   GLU  88          1HB       GLU  88  12.387  -8.556  -4.667
  676   1HG   GLU  88          2HG       GLU  88  13.897 -10.118  -5.486
  677   2HG   GLU  88          1HG       GLU  88  12.371 -10.908  -5.882
  678    H    LEU  89           H        LEU  89  10.191  -7.849  -3.780
  679    HA   LEU  89           HA       LEU  89   9.679 -10.143  -2.124
  680   1HB   LEU  89          2HB       LEU  89   9.314  -7.189  -2.069
  681   2HB   LEU  89          1HB       LEU  89   8.323  -8.112  -0.941
  682    HG   LEU  89           HG       LEU  89  11.192  -8.871  -1.111
  683   1HD1  LEU  89          1HD1      LEU  89  10.245  -6.160  -0.424
  684   2HD1  LEU  89          2HD1      LEU  89  11.862  -6.711  -0.860
  685   3HD1  LEU  89          3HD1      LEU  89  11.281  -6.902   0.791
  686   1HD2  LEU  89          1HD2      LEU  89   9.548  -8.304   1.350
  687   2HD2  LEU  89          2HD2      LEU  89  10.859  -9.464   1.141
  688   3HD2  LEU  89          3HD2      LEU  89   9.280  -9.781   0.424
  689    H    ILE  90           H        ILE  90   7.390  -7.791  -3.577
  690    HA   ILE  90           HA       ILE  90   4.955  -8.969  -2.864
  691    HB   ILE  90           HB       ILE  90   5.765  -7.644  -5.475
  692   1HG1  ILE  90          2HG1      ILE  90   6.317  -6.254  -3.541
  693   2HG1  ILE  90          1HG1      ILE  90   4.900  -5.585  -4.347
  694   1HG2  ILE  90          1HG2      ILE  90   3.144  -8.451  -4.297
  695   2HG2  ILE  90          2HG2      ILE  90   3.640  -8.376  -5.987
  696   3HG2  ILE  90          3HG2      ILE  90   3.219  -6.896  -5.126
  697   1HD1  ILE  90          1HD1      ILE  90   4.072  -5.579  -2.209
  698   2HD1  ILE  90          2HD1      ILE  90   5.123  -6.896  -1.687
  699   3HD1  ILE  90          3HD1      ILE  90   3.667  -7.247  -2.617
  700    H    ASN  91           H        ASN  91   6.761  -9.608  -5.905
  701    HA   ASN  91           HA       ASN  91   5.082 -11.673  -6.897
  702   1HB   ASN  91          2HB       ASN  91   7.267 -10.333  -7.746
  703   2HB   ASN  91          1HB       ASN  91   8.033 -11.853  -7.283
  704   1HD2  ASN  91          1HD2      ASN  91   5.031 -10.831  -9.028
  705   2HD2  ASN  91          2HD2      ASN  91   5.179 -11.994 -10.255
  706    H    TYR  92           H        TYR  92   7.956 -11.862  -4.791
  707    HA   TYR  92           HA       TYR  92   8.105 -14.692  -4.548
  708   1HB   TYR  92          2HB       TYR  92   9.944 -13.851  -3.527
  709   2HB   TYR  92          1HB       TYR  92   9.181 -12.278  -3.331
  710    HD1  TYR  92           1HD      TYR  92   8.710 -11.514  -1.179
  711    HD2  TYR  92           2HD      TYR  92   9.086 -15.735  -1.871
  712    HE1  TYR  92           1HE      TYR  92   8.469 -11.930   1.250
  713    HE2  TYR  92           2HE      TYR  92   8.842 -16.153   0.560
  714    HH   TYR  92           HH       TYR  92   9.295 -14.754   2.721
  715    H    HIS  93           H        HIS  93   5.903 -12.382  -3.111
  716    HA   HIS  93           HA       HIS  93   5.005 -13.986  -0.888
  717   1HB   HIS  93          2HB       HIS  93   4.715 -11.503  -1.271
  718   2HB   HIS  93          1HB       HIS  93   3.498 -11.894  -2.488
  719    HD1  HIS  93           1HD      HIS  93   3.953 -11.468   1.127
  720    HD2  HIS  93           2HD      HIS  93   1.206 -13.384  -1.355
  721    HE1  HIS  93           1HE      HIS  93   1.921 -11.962   2.555
  722    H    GLN  94           H        GLN  94   3.861 -13.614  -4.247
  723    HA   GLN  94           HA       GLN  94   1.861 -15.784  -3.797
  724   1HB   GLN  94          2HB       GLN  94   1.311 -13.510  -4.809
  725   2HB   GLN  94          1HB       GLN  94   2.273 -13.993  -6.207
  726   1HG   GLN  94          2HG       GLN  94  -0.001 -14.549  -6.728
  727   2HG   GLN  94          1HG       GLN  94   0.811 -16.070  -6.349
  728   1HE2  GLN  94          1HE2      GLN  94  -0.255 -17.356  -4.841
  729   2HE2  GLN  94          2HE2      GLN  94  -1.385 -16.794  -3.706
  730    H    HIS  95           H        HIS  95   4.128 -14.828  -6.419
  731    HA   HIS  95           HA       HIS  95   5.354 -16.168  -7.933
  732   1HB   HIS  95          2HB       HIS  95   5.573 -17.248  -5.197
  733   2HB   HIS  95          1HB       HIS  95   5.989 -18.409  -6.457
  734    HD1  HIS  95           1HD      HIS  95   6.589 -14.810  -7.176
  735    HD2  HIS  95           2HD      HIS  95   8.784 -18.064  -5.775
  736    HE1  HIS  95           1HE      HIS  95   9.024 -14.132  -7.293
  737    H    ASN  96           H        ASN  96   3.019 -16.464  -8.906
  738    HA   ASN  96           HA       ASN  96   2.285 -19.373  -8.830
  739   1HB   ASN  96          2HB       ASN  96   0.756 -17.294  -8.096
  740   2HB   ASN  96          1HB       ASN  96   0.424 -17.261  -9.828
  741   1HD2  ASN  96          1HD2      ASN  96  -1.783 -17.905  -8.444
  742   2HD2  ASN  96          2HD2      ASN  96  -2.095 -19.573  -8.451
  743    H    SER  97           H        SER  97   3.366 -16.740 -10.818
  744    HA   SER  97           HA       SER  97   3.321 -18.537 -13.191
  745   1HB   SER  97          2HB       SER  97   1.454 -16.487 -12.700
  746   2HB   SER  97          1HB       SER  97   2.572 -15.815 -13.882
  747    HG   SER  97           HG       SER  97   1.307 -18.354 -14.070
  748    H    ALA  98           H        ALA  98   4.140 -16.451 -14.996
  749    HA   ALA  98           HA       ALA  98   6.977 -16.278 -14.299
  750   1HB   ALA  98          1HB       ALA  98   5.923 -16.718 -16.578
  751   2HB   ALA  98          2HB       ALA  98   7.174 -15.476 -16.560
  752   3HB   ALA  98          3HB       ALA  98   5.471 -15.013 -16.605
  753    H    GLY  99           H        GLY  99   7.516 -13.730 -15.519
  754   1HA   GLY  99          2HA       GLY  99   6.940 -11.985 -13.228
  755   2HA   GLY  99          1HA       GLY  99   7.985 -11.591 -14.593
  756    H    LEU 100           H        LEU 100   4.521 -12.429 -14.208
  757    HA   LEU 100           HA       LEU 100   3.766 -10.569 -16.346
  758   1HB   LEU 100          2HB       LEU 100   2.788 -12.899 -15.406
  759   2HB   LEU 100          1HB       LEU 100   1.788 -11.787 -14.472
  760    HG   LEU 100           HG       LEU 100   1.329 -10.589 -16.699
  761   1HD1  LEU 100          1HD1      LEU 100   1.489 -12.439 -18.589
  762   2HD1  LEU 100          2HD1      LEU 100   2.810 -13.038 -17.586
  763   3HD1  LEU 100          3HD1      LEU 100   2.869 -11.400 -18.236
  764   1HD2  LEU 100          1HD2      LEU 100   0.276 -13.397 -16.779
  765   2HD2  LEU 100          2HD2      LEU 100  -0.588 -11.874 -16.996
  766   3HD2  LEU 100          3HD2      LEU 100  -0.100 -12.389 -15.381
  767    H    ILE 101           H        ILE 101   1.236  -9.847 -14.839
  768    HA   ILE 101           HA       ILE 101   1.841  -7.243 -13.985
  769    HB   ILE 101           HB       ILE 101  -0.312  -9.145 -12.995
  770   1HG1  ILE 101          2HG1      ILE 101  -1.268  -7.309 -14.947
  771   2HG1  ILE 101          1HG1      ILE 101   0.224  -7.998 -15.588
  772   1HG2  ILE 101          1HG2      ILE 101  -0.275  -7.190 -11.594
  773   2HG2  ILE 101          2HG2      ILE 101  -1.600  -6.976 -12.737
  774   3HG2  ILE 101          3HG2      ILE 101  -0.075  -6.125 -12.986
  775   1HD1  ILE 101          1HD1      ILE 101  -1.456  -9.516 -16.278
  776   2HD1  ILE 101          2HD1      ILE 101  -2.282  -9.439 -14.721
  777   3HD1  ILE 101          3HD1      ILE 101  -0.738 -10.281 -14.859
  778    H    SER 102           H        SER 102   1.667  -6.411 -11.665
  779    HA   SER 102           HA       SER 102   3.468  -7.997  -9.926
  780   1HB   SER 102          2HB       SER 102   3.327  -5.372 -10.621
  781   2HB   SER 102          1HB       SER 102   2.422  -5.343  -9.110
  782    HG   SER 102           HG       SER 102   4.189  -5.827  -8.038
  783    H    ARG 103           H        ARG 103   0.723  -8.960 -10.216
  784    HA   ARG 103           HA       ARG 103  -1.102  -9.646  -8.880
  785   1HB   ARG 103          2HB       ARG 103   0.877 -10.592  -7.711
  786   2HB   ARG 103          1HB       ARG 103   0.996  -9.117  -6.751
  787   1HG   ARG 103          2HG       ARG 103  -0.603  -9.828  -5.331
  788   2HG   ARG 103          1HG       ARG 103  -1.706 -10.173  -6.663
  789   1HD   ARG 103          2HD       ARG 103   0.479 -12.126  -6.501
  790   2HD   ARG 103          1HD       ARG 103  -0.528 -12.092  -5.039
  791    HE   ARG 103           HE       ARG 103  -1.411 -12.940  -7.683
  792   1HH1  ARG 103          1HH2      ARG 103  -2.234 -13.133  -4.527
  793   2HH1  ARG 103          2HH2      ARG 103  -3.929 -12.836  -4.722
  794   1HH2  ARG 103          1HH1      ARG 103  -3.643 -11.833  -8.029
  795   2HH2  ARG 103          2HH1      ARG 103  -4.727 -12.100  -6.705
  796    H    LEU 104           H        LEU 104  -1.942  -7.333  -9.548
  797    HA   LEU 104           HA       LEU 104  -2.206  -5.572  -7.143
  798   1HB   LEU 104          2HB       LEU 104  -1.296  -4.793  -9.418
  799   2HB   LEU 104          1HB       LEU 104  -2.946  -4.972 -10.015
  800    HG   LEU 104           HG       LEU 104  -2.743  -3.493  -7.474
  801   1HD1  LEU 104          1HD1      LEU 104  -0.675  -2.852  -8.951
  802   2HD1  LEU 104          2HD1      LEU 104  -1.663  -1.570  -8.251
  803   3HD1  LEU 104          3HD1      LEU 104  -1.871  -2.019  -9.944
  804   1HD2  LEU 104          1HD2      LEU 104  -3.941  -2.405  -9.985
  805   2HD2  LEU 104          2HD2      LEU 104  -4.572  -2.381  -8.337
  806   3HD2  LEU 104          3HD2      LEU 104  -4.671  -3.857  -9.298
  807    H    LYS 105           H        LYS 105  -4.461  -4.442  -7.100
  808    HA   LYS 105           HA       LYS 105  -6.574  -6.489  -7.685
  809   1HB   LYS 105          2HB       LYS 105  -6.068  -4.614  -5.378
  810   2HB   LYS 105          1HB       LYS 105  -7.660  -5.327  -5.643
  811   1HG   LYS 105          2HG       LYS 105  -6.958  -7.443  -5.092
  812   2HG   LYS 105          1HG       LYS 105  -5.333  -7.181  -5.726
  813   1HD   LYS 105          2HD       LYS 105  -4.552  -6.334  -3.751
  814   2HD   LYS 105          1HD       LYS 105  -6.078  -5.535  -3.373
  815   1HE   LYS 105          2HE       LYS 105  -5.706  -7.371  -1.782
  816   2HE   LYS 105          1HE       LYS 105  -7.063  -7.793  -2.846
  817   1HZ   LYS 105          1HZ       LYS 105  -5.351  -9.570  -2.651
  818   2HZ   LYS 105          2HZ       LYS 105  -4.238  -8.526  -3.396
  819   3HZ   LYS 105          3HZ       LYS 105  -5.617  -9.046  -4.242
  820    H    TYR 106           H        TYR 106  -7.033  -3.143  -6.532
  821    HA   TYR 106           HA       TYR 106  -8.346  -2.546  -9.164
  822   1HB   TYR 106          2HB       TYR 106  -9.808  -3.031  -7.114
  823   2HB   TYR 106          1HB       TYR 106  -9.203  -1.509  -6.459
  824    HD1  TYR 106           1HD      TYR 106 -11.729  -2.974  -8.420
  825    HD2  TYR 106           2HD      TYR 106  -9.267   0.530  -8.154
  826    HE1  TYR 106           1HE      TYR 106 -13.359  -1.724  -9.814
  827    HE2  TYR 106           2HE      TYR 106 -10.894   1.784  -9.543
  828    HH   TYR 106           HH       TYR 106 -13.300   0.297 -11.341
  829    HA   PRO 107           HA       PRO 107  -5.200   0.709  -8.903
  830   1HB   PRO 107          2HB       PRO 107  -6.134   1.639 -11.452
  831   2HB   PRO 107          1HB       PRO 107  -4.659   0.739 -11.095
  832   1HG   PRO 107          2HG       PRO 107  -6.981  -0.207 -12.461
  833   2HG   PRO 107          1HG       PRO 107  -5.533  -1.124 -12.032
  834   1HD   PRO 107          2HD       PRO 107  -8.183  -1.286 -10.849
  835   2HD   PRO 107          1HD       PRO 107  -6.753  -2.288 -10.500
  836    H    VAL 108           H        VAL 108  -6.845   1.556  -7.196
  837    HA   VAL 108           HA       VAL 108  -8.279   3.933  -8.309
  838    HB   VAL 108           HB       VAL 108  -9.724   2.160  -7.390
  839   1HG1  VAL 108          1HG1      VAL 108  -9.151   2.394  -4.602
  840   2HG1  VAL 108          2HG1      VAL 108  -7.650   1.990  -5.436
  841   3HG1  VAL 108          3HG1      VAL 108  -9.065   0.953  -5.616
  842   1HG2  VAL 108          1HG2      VAL 108  -9.490   4.837  -6.117
  843   2HG2  VAL 108          2HG2      VAL 108 -10.549   3.677  -5.316
  844   3HG2  VAL 108          3HG2      VAL 108 -10.843   4.126  -6.997
  845    H    SER 109           H        SER 109  -6.141   5.061  -8.028
  846    HA   SER 109           HA       SER 109  -5.281   5.451  -5.218
  847   1HB   SER 109          2HB       SER 109  -4.173   6.049  -7.946
  848   2HB   SER 109          1HB       SER 109  -3.473   6.794  -6.510
  849    HG   SER 109           HG       SER 109  -2.408   4.974  -6.435
  850    H    GLN 110           H        GLN 110  -4.711   7.714  -4.610
  851    HA   GLN 110           HA       GLN 110  -5.469   9.867  -4.087
  852   1HB   GLN 110          2HB       GLN 110  -6.021   9.979  -7.061
  853   2HB   GLN 110          1HB       GLN 110  -5.442  11.277  -6.019
  854   1HG   GLN 110          2HG       GLN 110  -3.537   9.265  -5.695
  855   2HG   GLN 110          1HG       GLN 110  -3.929   9.204  -7.413
  856   1HE2  GLN 110          1HE2      GLN 110  -1.422  10.246  -6.126
  857   2HE2  GLN 110          2HE2      GLN 110  -1.288  11.860  -6.634
  858    H    GLN 111           H        GLN 111  -7.427  11.495  -4.994
  859    HA   GLN 111           HA       GLN 111  -9.853  10.304  -4.025
  860   1HB   GLN 111          2HB       GLN 111  -9.345  12.852  -5.597
  861   2HB   GLN 111          1HB       GLN 111 -10.781  12.512  -4.628
  862   1HG   GLN 111          2HG       GLN 111  -8.469  12.044  -3.000
  863   2HG   GLN 111          1HG       GLN 111  -8.302  13.628  -3.757
  864   1HE2  GLN 111          1HE2      GLN 111 -10.292  11.714  -1.539
  865   2HE2  GLN 111          2HE2      GLN 111 -11.210  13.018  -0.956
  866    H    ASN 112           H        ASN 112 -11.389  11.788  -6.310
  867    HA   ASN 112           HA       ASN 112 -12.402  11.226  -8.364
  868   1HB   ASN 112          2HB       ASN 112  -9.699  10.774  -8.651
  869   2HB   ASN 112          1HB       ASN 112 -10.371   9.193  -9.052
  870   1HD2  ASN 112          1HD2      ASN 112 -10.703  12.678  -9.883
  871   2HD2  ASN 112          2HD2      ASN 112 -11.242  12.403 -11.469
  872    H    LYS 113           H        LYS 113 -13.559  10.058  -6.295
  873    HA   LYS 113           HA       LYS 113 -13.491   7.141  -6.372
  874   1HB   LYS 113          2HB       LYS 113 -15.446   9.087  -5.105
  875   2HB   LYS 113          1HB       LYS 113 -15.238   7.390  -4.670
  876   1HG   LYS 113          2HG       LYS 113 -13.066   9.497  -4.468
  877   2HG   LYS 113          1HG       LYS 113 -14.040   8.928  -3.115
  878   1HD   LYS 113          2HD       LYS 113 -12.708   7.138  -2.854
  879   2HD   LYS 113          1HD       LYS 113 -12.973   6.658  -4.529
  880   1HE   LYS 113          2HE       LYS 113 -11.185   8.945  -4.403
  881   2HE   LYS 113          1HE       LYS 113 -10.564   7.597  -3.432
  882   1HZ   LYS 113          1HZ       LYS 113 -11.552   7.405  -6.228
  883   2HZ   LYS 113          2HZ       LYS 113 -10.987   6.107  -5.289
  884   3HZ   LYS 113          3HZ       LYS 113  -9.925   7.350  -5.754
  885    H    ASN 114           H        ASN 114 -14.043   6.832  -8.698
  886    HA   ASN 114           HA       ASN 114 -16.975   6.775  -9.110
  887   1HB   ASN 114          2HB       ASN 114 -15.243   8.811 -10.110
  888   2HB   ASN 114          1HB       ASN 114 -15.794   7.848 -11.477
  889   1HD2  ASN 114          1HD2      ASN 114 -17.867   8.317 -12.251
  890   2HD2  ASN 114          2HD2      ASN 114 -19.031   9.218 -11.406
  891    H    ALA 115           H        ALA 115 -14.259   6.599 -11.412
  892    HA   ALA 115           HA       ALA 115 -13.596   4.852 -12.859
  893   1HB   ALA 115          1HB       ALA 115 -14.525   3.194 -10.491
  894   2HB   ALA 115          2HB       ALA 115 -12.967   4.017 -10.575
  895   3HB   ALA 115          3HB       ALA 115 -13.338   2.716 -11.705
  896    HA   PRO 116           HA       PRO 116 -18.100   4.182 -13.967
  897   1HB   PRO 116          2HB       PRO 116 -17.331   4.905 -16.644
  898   2HB   PRO 116          1HB       PRO 116 -18.372   5.799 -15.532
  899   1HG   PRO 116          2HG       PRO 116 -15.706   6.459 -16.355
  900   2HG   PRO 116          1HG       PRO 116 -16.745   7.342 -15.233
  901   1HD   PRO 116          2HD       PRO 116 -14.394   5.783 -14.618
  902   2HD   PRO 116          1HD       PRO 116 -15.439   6.680 -13.488
  903    H    SER 117           H        SER 117 -15.121   3.408 -15.782
  904    HA   SER 117           HA       SER 117 -16.128   1.220 -17.306
  905   1HB   SER 117          2HB       SER 117 -13.876   2.555 -17.323
  906   2HB   SER 117          1HB       SER 117 -13.344   1.344 -16.162
  907    HG   SER 117           HG       SER 117 -12.866   0.646 -18.244
  908    H    THR 118           H        THR 118 -17.308  -0.353 -16.198
  909    HA   THR 118           HA       THR 118 -16.137  -1.518 -13.709
  910    HB   THR 118           HB       THR 118 -18.501  -2.570 -13.690
  911    HG1  THR 118           1HG      THR 118 -18.869  -2.133 -15.924
  912   1HG2  THR 118          1HG2      THR 118 -17.578  -0.362 -12.554
  913   2HG2  THR 118          2HG2      THR 118 -19.300  -0.741 -12.514
  914   3HG2  THR 118          3HG2      THR 118 -18.679   0.418 -13.690
  Start of MODEL    4
    1    H    THR   1           1H       THR   1  18.631  -7.226 -11.313
    2    HA   THR   1           HA       THR   1  18.141  -6.179  -9.080
    3    HB   THR   1           HB       THR   1  18.508  -3.612  -9.310
    4    HG1  THR   1           1HG      THR   1  20.183  -3.079 -10.707
    5   1HG2  THR   1          1HG2      THR   1  20.896  -3.869  -8.547
    6   2HG2  THR   1          2HG2      THR   1  20.785  -5.578  -8.965
    7   3HG2  THR   1          3HG2      THR   1  19.753  -4.910  -7.700
    8    H    GLU   2           H        GLU   2  15.945  -6.231  -9.327
    9    HA   GLU   2           HA       GLU   2  14.695  -5.339 -11.851
   10   1HB   GLU   2          2HB       GLU   2  14.183  -7.167  -9.674
   11   2HB   GLU   2          1HB       GLU   2  12.787  -6.112  -9.894
   12   1HG   GLU   2          2HG       GLU   2  12.977  -6.631 -12.396
   13   2HG   GLU   2          1HG       GLU   2  14.088  -7.922 -11.936
   14    H    ALA   3           H        ALA   3  12.398  -4.190 -11.294
   15    HA   ALA   3           HA       ALA   3  12.436  -2.252  -9.117
   16   1HB   ALA   3          1HB       ALA   3  13.584  -1.660 -11.796
   17   2HB   ALA   3          2HB       ALA   3  13.971  -0.950 -10.229
   18   3HB   ALA   3          3HB       ALA   3  12.540  -0.414 -11.111
   19    H    GLU   4           H        GLU   4  10.747  -0.385  -9.871
   20    HA   GLU   4           HA       GLU   4   8.541  -1.605 -11.463
   21   1HB   GLU   4          2HB       GLU   4   7.033  -0.892  -9.490
   22   2HB   GLU   4          1HB       GLU   4   8.028  -2.327  -9.256
   23   1HG   GLU   4          2HG       GLU   4   9.250  -1.344  -7.616
   24   2HG   GLU   4          1HG       GLU   4   9.417   0.156  -8.530
   25    H    ASP   5           H        ASP   5  10.488   0.854 -11.448
   26    HA   ASP   5           HA       ASP   5   8.500   3.060 -11.444
   27   1HB   ASP   5          2HB       ASP   5  11.269   2.710 -10.841
   28   2HB   ASP   5          1HB       ASP   5  11.142   3.868 -12.161
   29    H    SER   6           H        SER   6   8.408   0.995 -13.543
   30    HA   SER   6           HA       SER   6   9.630   2.062 -15.967
   31   1HB   SER   6          2HB       SER   6   8.497   0.203 -16.989
   32   2HB   SER   6          1HB       SER   6   9.015  -0.346 -15.397
   33    HG   SER   6           HG       SER   6   6.795  -0.830 -15.918
   34    H    ILE   7           H        ILE   7   7.472   1.841 -17.772
   35    HA   ILE   7           HA       ILE   7   6.245   4.469 -17.487
   36    HB   ILE   7           HB       ILE   7   7.020   3.479 -19.621
   37   1HG1  ILE   7          2HG1      ILE   7   4.227   3.559 -20.357
   38   2HG1  ILE   7          1HG1      ILE   7   4.548   4.786 -19.131
   39   1HG2  ILE   7          1HG2      ILE   7   5.864   1.165 -18.695
   40   2HG2  ILE   7          2HG2      ILE   7   6.359   1.437 -20.366
   41   3HG2  ILE   7          3HG2      ILE   7   4.682   1.702 -19.889
   42   1HD1  ILE   7          1HD1      ILE   7   6.399   4.453 -21.484
   43   2HD1  ILE   7          2HD1      ILE   7   6.164   5.866 -20.456
   44   3HD1  ILE   7          3HD1      ILE   7   4.927   5.413 -21.627
   45    H    GLU   8           H        GLU   8   5.433   1.499 -16.145
   46    HA   GLU   8           HA       GLU   8   2.602   1.362 -16.519
   47   1HB   GLU   8          2HB       GLU   8   4.567   0.420 -14.426
   48   2HB   GLU   8          1HB       GLU   8   2.843   0.075 -14.281
   49   1HG   GLU   8          2HG       GLU   8   3.131  -0.723 -16.794
   50   2HG   GLU   8          1HG       GLU   8   4.812  -0.926 -16.302
   51    H    MET   9           H        MET   9   0.961   2.535 -15.541
   52    HA   MET   9           HA       MET   9   1.252   3.832 -12.979
   53   1HB   MET   9          2HB       MET   9   0.988   6.169 -14.101
   54   2HB   MET   9          1HB       MET   9   2.587   5.430 -14.080
   55   1HG   MET   9          2HG       MET   9   2.368   6.139 -16.310
   56   2HG   MET   9          1HG       MET   9   1.909   4.442 -16.397
   57   1HE   MET   9          1HE       MET   9  -1.393   4.336 -17.832
   58   2HE   MET   9          2HE       MET   9  -0.496   3.541 -16.542
   59   3HE   MET   9          3HE       MET   9   0.321   3.955 -18.045
   60    H    TYR  10           H        TYR  10  -0.695   2.085 -14.153
   61    HA   TYR  10           HA       TYR  10  -2.996   3.230 -15.274
   62   1HB   TYR  10          2HB       TYR  10  -2.399   0.980 -13.383
   63   2HB   TYR  10          1HB       TYR  10  -4.085   1.383 -13.703
   64    HD1  TYR  10           1HD      TYR  10  -1.586  -0.755 -14.699
   65    HD2  TYR  10           2HD      TYR  10  -4.406   2.007 -16.393
   66    HE1  TYR  10           1HE      TYR  10  -1.465  -1.959 -16.864
   67    HE2  TYR  10           2HE      TYR  10  -4.285   0.803 -18.558
   68    HH   TYR  10           HH       TYR  10  -1.876  -1.488 -19.253
   69    H    GLU  11           H        GLU  11  -2.957   2.437 -11.793
   70    HA   GLU  11           HA       GLU  11  -3.868   5.188 -11.118
   71   1HB   GLU  11          2HB       GLU  11  -5.737   3.343 -11.737
   72   2HB   GLU  11          1HB       GLU  11  -5.472   2.912 -10.049
   73   1HG   GLU  11          2HG       GLU  11  -7.201   4.522  -9.988
   74   2HG   GLU  11          1HG       GLU  11  -5.743   5.405  -9.535
   75    H    TRP  12           H        TRP  12  -3.400   1.885  -9.850
   76    HA   TRP  12           HA       TRP  12  -3.101   2.351  -7.148
   77   1HB   TRP  12          2HB       TRP  12  -1.625   0.347  -7.197
   78   2HB   TRP  12          1HB       TRP  12  -3.075   0.153  -8.180
   79    HD1  TRP  12           HD       TRP  12  -2.793   0.067 -10.801
   80    HE1  TRP  12           1HE      TRP  12  -0.741  -0.277 -12.323
   81    HE3  TRP  12           3HE      TRP  12   0.951   0.844  -7.420
   82    HZ2  TRP  12           2HZ      TRP  12   2.112  -0.231 -12.130
   83    HZ3  TRP  12           3HZ      TRP  12   3.323   0.689  -8.113
   84    HH2  TRP  12           HH       TRP  12   3.909   0.153 -10.463
   85    H    TYR  13           H        TYR  13  -0.859   3.318  -9.661
   86    HA   TYR  13           HA       TYR  13   1.365   3.711  -7.771
   87   1HB   TYR  13          2HB       TYR  13   1.469   3.122 -10.276
   88   2HB   TYR  13          1HB       TYR  13   1.106   4.826 -10.568
   89    HD1  TYR  13           1HD      TYR  13   2.549   6.512  -9.066
   90    HD2  TYR  13           2HD      TYR  13   3.722   2.520 -10.122
   91    HE1  TYR  13           1HE      TYR  13   4.907   7.088  -8.611
   92    HE2  TYR  13           2HE      TYR  13   6.090   3.101  -9.676
   93    HH   TYR  13           HH       TYR  13   7.340   4.779  -8.294
   94    H    SER  14           H        SER  14   1.926   5.637  -6.784
   95    HA   SER  14           HA       SER  14   0.618   8.167  -7.620
   96   1HB   SER  14          2HB       SER  14   0.456   7.188  -4.770
   97   2HB   SER  14          1HB       SER  14  -0.447   8.500  -5.521
   98    HG   SER  14           HG       SER  14  -0.815   5.740  -5.655
   99    H    LYS  15           H        LYS  15   2.094   9.778  -7.458
  100    HA   LYS  15           HA       LYS  15   4.758   9.353  -6.438
  101   1HB   LYS  15          2HB       LYS  15   3.159  11.391  -7.824
  102   2HB   LYS  15          1HB       LYS  15   4.384  12.086  -6.763
  103   1HG   LYS  15          2HG       LYS  15   5.305  11.714  -9.010
  104   2HG   LYS  15          1HG       LYS  15   6.104  10.669  -7.835
  105   1HD   LYS  15          2HD       LYS  15   4.203   8.967  -8.509
  106   2HD   LYS  15          1HD       LYS  15   4.130   9.950  -9.973
  107   1HE   LYS  15          2HE       LYS  15   5.717   8.081 -10.279
  108   2HE   LYS  15          1HE       LYS  15   6.597   9.623 -10.265
  109   1HZ   LYS  15          1HZ       LYS  15   7.425   9.251  -8.198
  110   2HZ   LYS  15          2HZ       LYS  15   7.263   7.629  -8.674
  111   3HZ   LYS  15          3HZ       LYS  15   6.085   8.348  -7.684
  112    H    HIS  16           H        HIS  16   4.944   9.072  -4.239
  113    HA   HIS  16           HA       HIS  16   4.955   9.607  -1.949
  114   1HB   HIS  16          2HB       HIS  16   4.681  12.326  -3.262
  115   2HB   HIS  16          1HB       HIS  16   5.081  12.090  -1.561
  116    HD1  HIS  16           1HD      HIS  16   6.832  12.985  -4.361
  117    HD2  HIS  16           2HD      HIS  16   7.354   9.790  -1.736
  118    HE1  HIS  16           1HE      HIS  16   9.238  12.235  -4.615
  119    H    MET  17           H        MET  17   2.514   8.636  -2.661
  120    HA   MET  17           HA       MET  17   0.351  10.491  -1.962
  121   1HB   MET  17          2HB       MET  17  -0.003   8.686  -3.548
  122   2HB   MET  17          1HB       MET  17   0.550   7.489  -2.379
  123   1HG   MET  17          2HG       MET  17  -1.717   9.243  -1.556
  124   2HG   MET  17          1HG       MET  17  -2.058   8.008  -2.769
  125   1HE   MET  17          1HE       MET  17   0.012   5.252  -1.333
  126   2HE   MET  17          2HE       MET  17  -0.830   5.951  -2.713
  127   3HE   MET  17          3HE       MET  17  -1.686   4.855  -1.631
  128    H    THR  18           H        THR  18  -0.320  10.904   0.105
  129    HA   THR  18           HA       THR  18   1.053   9.856   2.405
  130    HB   THR  18           HB       THR  18  -1.649  11.206   2.335
  131    HG1  THR  18           1HG      THR  18   0.943  12.285   1.962
  132   1HG2  THR  18          1HG2      THR  18   0.261  10.511   4.367
  133   2HG2  THR  18          2HG2      THR  18  -1.306  11.298   4.551
  134   3HG2  THR  18          3HG2      THR  18   0.138  12.267   4.262
  135    H    ARG  19           H        ARG  19   0.514   8.213   3.795
  136    HA   ARG  19           HA       ARG  19  -1.058   5.994   3.083
  137   1HB   ARG  19          2HB       ARG  19  -0.797   5.399   5.437
  138   2HB   ARG  19          1HB       ARG  19   0.669   6.224   4.910
  139   1HG   ARG  19          2HG       ARG  19  -0.348   8.383   5.802
  140   2HG   ARG  19          1HG       ARG  19  -1.619   7.398   6.527
  141   1HD   ARG  19          2HD       ARG  19   1.125   6.434   7.087
  142   2HD   ARG  19          1HD       ARG  19   0.728   8.010   7.801
  143    HE   ARG  19           HE       ARG  19  -1.103   5.661   8.122
  144   1HH1  ARG  19          1HH2      ARG  19   1.373   7.180   9.741
  145   2HH1  ARG  19          2HH2      ARG  19   0.462   7.570  11.162
  146   1HH2  ARG  19          1HH1      ARG  19  -2.585   6.660   9.781
  147   2HH2  ARG  19          2HH1      ARG  19  -1.778   7.276  11.184
  148    H    SER  20           H        SER  20  -1.933   8.875   4.915
  149    HA   SER  20           HA       SER  20  -4.588   8.035   5.643
  150   1HB   SER  20          2HB       SER  20  -4.063   9.783   6.974
  151   2HB   SER  20          1HB       SER  20  -2.747  10.258   5.911
  152    HG   SER  20           HG       SER  20  -4.024  11.896   5.509
  153    H    GLN  21           H        GLN  21  -3.212   9.805   2.895
  154    HA   GLN  21           HA       GLN  21  -5.692  10.654   1.724
  155   1HB   GLN  21          2HB       GLN  21  -2.891  10.105   0.734
  156   2HB   GLN  21          1HB       GLN  21  -4.160  10.637  -0.371
  157   1HG   GLN  21          2HG       GLN  21  -3.587  12.124   2.191
  158   2HG   GLN  21          1HG       GLN  21  -2.692  12.464   0.711
  159   1HE2  GLN  21          1HE2      GLN  21  -5.240  13.637   2.413
  160   2HE2  GLN  21          2HE2      GLN  21  -6.208  14.220   1.147
  161    H    ALA  22           H        ALA  22  -3.701   7.720   1.336
  162    HA   ALA  22           HA       ALA  22  -5.300   6.467  -0.677
  163   1HB   ALA  22          1HB       ALA  22  -3.405   5.222  -0.442
  164   2HB   ALA  22          2HB       ALA  22  -4.222   4.448   0.915
  165   3HB   ALA  22          3HB       ALA  22  -3.142   5.813   1.199
  166    H    GLU  23           H        GLU  23  -5.342   6.220   2.874
  167    HA   GLU  23           HA       GLU  23  -7.462   4.382   3.164
  168   1HB   GLU  23          2HB       GLU  23  -6.401   6.701   4.775
  169   2HB   GLU  23          1HB       GLU  23  -7.770   5.758   5.362
  170   1HG   GLU  23          2HG       GLU  23  -6.476   3.732   5.364
  171   2HG   GLU  23          1HG       GLU  23  -5.145   4.517   4.516
  172    H    GLN  24           H        GLN  24  -7.669   7.972   3.119
  173    HA   GLN  24           HA       GLN  24 -10.527   7.990   3.239
  174   1HB   GLN  24          2HB       GLN  24 -10.254  10.374   2.646
  175   2HB   GLN  24          1HB       GLN  24  -9.099   9.886   3.882
  176   1HG   GLN  24          2HG       GLN  24  -7.378   9.589   2.111
  177   2HG   GLN  24          1HG       GLN  24  -8.537  10.173   0.919
  178   1HE2  GLN  24          1HE2      GLN  24  -6.596  11.154   3.732
  179   2HE2  GLN  24          2HE2      GLN  24  -6.766  12.824   3.479
  180    H    LEU  25           H        LEU  25  -8.299   8.342   0.401
  181    HA   LEU  25           HA       LEU  25 -10.524   8.533  -1.426
  182   1HB   LEU  25          2HB       LEU  25  -8.802   8.175  -3.156
  183   2HB   LEU  25          1HB       LEU  25  -8.246   9.333  -1.950
  184    HG   LEU  25           HG       LEU  25  -7.267   7.150  -0.806
  185   1HD1  LEU  25          1HD1      LEU  25  -8.254   6.201  -3.329
  186   2HD1  LEU  25          2HD1      LEU  25  -7.440   5.295  -2.058
  187   3HD1  LEU  25          3HD1      LEU  25  -6.496   6.078  -3.320
  188   1HD2  LEU  25          1HD2      LEU  25  -5.271   8.055  -1.447
  189   2HD2  LEU  25          2HD2      LEU  25  -6.249   9.253  -2.289
  190   3HD2  LEU  25          3HD2      LEU  25  -5.637   7.847  -3.158
  191    H    LEU  26           H        LEU  26  -8.906   5.844   0.128
  192    HA   LEU  26           HA       LEU  26  -9.922   3.811  -1.706
  193   1HB   LEU  26          2HB       LEU  26  -8.542   3.972   0.938
  194   2HB   LEU  26          1HB       LEU  26  -9.445   2.503   0.612
  195    HG   LEU  26           HG       LEU  26  -7.429   3.638  -1.335
  196   1HD1  LEU  26          1HD1      LEU  26  -6.217   1.429  -0.328
  197   2HD1  LEU  26          2HD1      LEU  26  -7.058   2.003   1.112
  198   3HD1  LEU  26          3HD1      LEU  26  -5.916   3.057   0.280
  199   1HD2  LEU  26          1HD2      LEU  26  -7.785   0.787  -1.416
  200   2HD2  LEU  26          2HD2      LEU  26  -8.156   1.970  -2.670
  201   3HD2  LEU  26          3HD2      LEU  26  -9.373   1.553  -1.465
  202    H    LYS  27           H        LYS  27 -10.769   4.640   1.696
  203    HA   LYS  27           HA       LYS  27 -13.224   3.254   1.874
  204   1HB   LYS  27          2HB       LYS  27 -11.952   4.452   3.673
  205   2HB   LYS  27          1HB       LYS  27 -12.495   5.982   2.983
  206   1HG   LYS  27          2HG       LYS  27 -13.962   5.371   4.837
  207   2HG   LYS  27          1HG       LYS  27 -14.858   5.256   3.321
  208   1HD   LYS  27          2HD       LYS  27 -14.893   2.936   3.355
  209   2HD   LYS  27          1HD       LYS  27 -13.435   2.826   4.341
  210   1HE   LYS  27          2HE       LYS  27 -15.778   4.165   5.608
  211   2HE   LYS  27          1HE       LYS  27 -15.884   2.407   5.388
  212   1HZ   LYS  27          1HZ       LYS  27 -14.753   2.715   7.414
  213   2HZ   LYS  27          2HZ       LYS  27 -13.767   3.945   6.781
  214   3HZ   LYS  27          3HZ       LYS  27 -13.543   2.335   6.289
  215    H    GLN  28           H        GLN  28 -12.646   6.607   0.822
  216    HA   GLN  28           HA       GLN  28 -15.322   7.362   0.283
  217   1HB   GLN  28          2HB       GLN  28 -13.214   8.762   0.386
  218   2HB   GLN  28          1HB       GLN  28 -12.847   8.202  -1.247
  219   1HG   GLN  28          2HG       GLN  28 -13.983  10.235  -1.610
  220   2HG   GLN  28          1HG       GLN  28 -15.242   9.019  -1.829
  221   1HE2  GLN  28          1HE2      GLN  28 -15.550  11.862  -0.897
  222   2HE2  GLN  28          2HE2      GLN  28 -16.296  11.760   0.625
  223    H    GLU  29           H        GLU  29 -12.938   5.865  -1.971
  224    HA   GLU  29           HA       GLU  29 -14.761   5.872  -4.220
  225   1HB   GLU  29          2HB       GLU  29 -12.136   5.618  -3.988
  226   2HB   GLU  29          1HB       GLU  29 -12.514   3.901  -3.887
  227   1HG   GLU  29          2HG       GLU  29 -12.034   4.666  -6.220
  228   2HG   GLU  29          1HG       GLU  29 -13.645   3.978  -6.047
  229    H    GLY  30           H        GLY  30 -13.983   3.535  -1.676
  230   1HA   GLY  30          2HA       GLY  30 -15.359   1.824  -0.835
  231   2HA   GLY  30          1HA       GLY  30 -16.555   2.263  -2.049
  232    H    LYS  31           H        LYS  31 -13.188   1.335  -2.688
  233    HA   LYS  31           HA       LYS  31 -14.221  -0.927  -4.354
  234   1HB   LYS  31          2HB       LYS  31 -11.407   0.177  -4.217
  235   2HB   LYS  31          1HB       LYS  31 -12.163  -0.702  -5.545
  236   1HG   LYS  31          2HG       LYS  31 -12.856   2.104  -4.612
  237   2HG   LYS  31          1HG       LYS  31 -12.047   1.671  -6.114
  238   1HD   LYS  31          2HD       LYS  31 -14.542   0.216  -5.859
  239   2HD   LYS  31          1HD       LYS  31 -14.818   1.950  -5.710
  240   1HE   LYS  31          2HE       LYS  31 -14.168   2.376  -7.881
  241   2HE   LYS  31          1HE       LYS  31 -12.984   1.053  -7.894
  242   1HZ   LYS  31          1HZ       LYS  31 -15.066   0.625  -9.205
  243   2HZ   LYS  31          2HZ       LYS  31 -15.911   0.603  -7.731
  244   3HZ   LYS  31          3HZ       LYS  31 -14.698  -0.547  -8.036
  245    H    GLU  32           H        GLU  32 -14.317  -2.792  -3.045
  246    HA   GLU  32           HA       GLU  32 -12.568  -3.177  -0.796
  247   1HB   GLU  32          2HB       GLU  32 -13.389  -5.596  -1.014
  248   2HB   GLU  32          1HB       GLU  32 -14.617  -4.359  -0.755
  249   1HG   GLU  32          2HG       GLU  32 -14.026  -4.752  -3.597
  250   2HG   GLU  32          1HG       GLU  32 -14.597  -6.230  -2.823
  251    H    GLY  33           H        GLY  33 -10.479  -3.697  -0.845
  252   1HA   GLY  33          2HA       GLY  33  -8.584  -4.980  -1.460
  253   2HA   GLY  33          1HA       GLY  33  -9.468  -5.538  -2.882
  254    H    GLY  34           H        GLY  34  -9.672  -2.124  -2.394
  255   1HA   GLY  34          2HA       GLY  34  -8.482  -1.478  -4.873
  256   2HA   GLY  34          1HA       GLY  34  -8.652  -0.336  -3.534
  257    H    PHE  35           H        PHE  35  -6.350  -0.980  -5.461
  258    HA   PHE  35           HA       PHE  35  -4.291  -1.484  -3.333
  259   1HB   PHE  35          2HB       PHE  35  -4.739  -3.323  -4.968
  260   2HB   PHE  35          1HB       PHE  35  -4.247  -2.234  -6.264
  261    HD1  PHE  35           1HD      PHE  35  -1.903  -1.304  -6.275
  262    HD2  PHE  35           2HD      PHE  35  -3.139  -4.435  -3.611
  263    HE1  PHE  35           1HE      PHE  35   0.471  -1.905  -5.882
  264    HE2  PHE  35           2HE      PHE  35  -0.765  -5.035  -3.213
  265    HZ   PHE  35           HZ       PHE  35   1.040  -3.769  -4.349
  266    H    ILE  36           H        ILE  36  -2.923   0.218  -3.051
  267    HA   ILE  36           HA       ILE  36  -2.305   1.974  -5.406
  268    HB   ILE  36           HB       ILE  36  -2.737   2.852  -2.530
  269   1HG1  ILE  36          2HG1      ILE  36  -4.598   3.137  -4.908
  270   2HG1  ILE  36          1HG1      ILE  36  -4.851   2.043  -3.548
  271   1HG2  ILE  36          1HG2      ILE  36  -1.259   4.324  -3.775
  272   2HG2  ILE  36          2HG2      ILE  36  -2.826   5.113  -3.593
  273   3HG2  ILE  36          3HG2      ILE  36  -2.387   4.367  -5.128
  274   1HD1  ILE  36          1HD1      ILE  36  -4.903   3.967  -1.999
  275   2HD1  ILE  36          2HD1      ILE  36  -6.129   4.143  -3.252
  276   3HD1  ILE  36          3HD1      ILE  36  -4.630   5.067  -3.349
  277    H    VAL  37           H        VAL  37  -0.209   3.194  -5.015
  278    HA   VAL  37           HA       VAL  37   1.588   2.034  -2.971
  279    HB   VAL  37           HB       VAL  37   2.084   1.861  -5.962
  280   1HG1  VAL  37          1HG1      VAL  37   4.006   0.341  -4.919
  281   2HG1  VAL  37          2HG1      VAL  37   3.782   1.413  -3.535
  282   3HG1  VAL  37          3HG1      VAL  37   4.227   2.082  -5.105
  283   1HG2  VAL  37          1HG2      VAL  37   1.383  -0.196  -3.852
  284   2HG2  VAL  37          2HG2      VAL  37   2.105  -0.636  -5.399
  285   3HG2  VAL  37          3HG2      VAL  37   0.525   0.147  -5.354
  286    H    ARG  38           H        ARG  38   3.635   3.280  -2.829
  287    HA   ARG  38           HA       ARG  38   3.868   5.749  -4.421
  288   1HB   ARG  38          2HB       ARG  38   3.641   7.189  -2.390
  289   2HB   ARG  38          1HB       ARG  38   2.149   6.336  -2.781
  290   1HG   ARG  38          2HG       ARG  38   2.213   5.748  -0.575
  291   2HG   ARG  38          1HG       ARG  38   3.344   4.518  -1.138
  292   1HD   ARG  38          2HD       ARG  38   5.207   5.674  -0.344
  293   2HD   ARG  38          1HD       ARG  38   4.396   7.250  -0.444
  294    HE   ARG  38           HE       ARG  38   3.250   5.299   1.463
  295   1HH1  ARG  38          1HH1      ARG  38   5.953   6.169   2.433
  296   2HH1  ARG  38          2HH1      ARG  38   5.567   7.580   3.360
  297   1HH2  ARG  38          1HH2      ARG  38   2.408   7.950   1.976
  298   2HH2  ARG  38          2HH2      ARG  38   3.558   8.588   3.102
  299    H    ASP  39           H        ASP  39   5.891   6.875  -3.981
  300    HA   ASP  39           HA       ASP  39   8.056   5.089  -3.184
  301   1HB   ASP  39          2HB       ASP  39   8.143   6.791  -5.008
  302   2HB   ASP  39          1HB       ASP  39   8.014   8.063  -3.793
  303    H    SER  40           H        SER  40   9.674   5.736  -1.496
  304    HA   SER  40           HA       SER  40   8.315   6.965   0.877
  305   1HB   SER  40          2HB       SER  40   9.031   4.546   0.906
  306   2HB   SER  40          1HB       SER  40  10.697   5.091   0.731
  307    HG   SER  40           HG       SER  40   8.957   5.257   2.896
  308    H    SER  41           H        SER  41  10.896   7.153   2.298
  309    HA   SER  41           HA       SER  41  12.442   9.139   0.714
  310   1HB   SER  41          2HB       SER  41  11.093   9.720   3.370
  311   2HB   SER  41          1HB       SER  41  12.100  10.842   2.460
  312    HG   SER  41           HG       SER  41   9.519   9.882   1.927
  313    H    LYS  42           H        LYS  42  12.064   7.930   4.078
  314    HA   LYS  42           HA       LYS  42  14.745   8.191   4.913
  315   1HB   LYS  42          2HB       LYS  42  12.432   6.388   5.572
  316   2HB   LYS  42          1HB       LYS  42  13.990   6.102   6.346
  317   1HG   LYS  42          2HG       LYS  42  13.327   8.929   6.386
  318   2HG   LYS  42          1HG       LYS  42  12.043   7.975   7.125
  319   1HD   LYS  42          2HD       LYS  42  13.295   7.602   8.958
  320   2HD   LYS  42          1HD       LYS  42  14.621   6.979   7.977
  321   1HE   LYS  42          2HE       LYS  42  15.554   8.879   9.064
  322   2HE   LYS  42          1HE       LYS  42  15.118   9.491   7.457
  323   1HZ   LYS  42          1HZ       LYS  42  14.207  10.962   9.099
  324   2HZ   LYS  42          2HZ       LYS  42  13.483   9.671   9.932
  325   3HZ   LYS  42          3HZ       LYS  42  12.928  10.105   8.386
  326    H    ALA  43           H        ALA  43  13.297   5.047   4.017
  327    HA   ALA  43           HA       ALA  43  15.954   3.980   3.295
  328   1HB   ALA  43          1HB       ALA  43  13.265   3.035   3.982
  329   2HB   ALA  43          2HB       ALA  43  14.819   2.229   4.204
  330   3HB   ALA  43          3HB       ALA  43  13.981   2.121   2.655
  331    H    GLY  44           H        GLY  44  13.296   5.493   1.719
  332   1HA   GLY  44          2HA       GLY  44  12.988   5.989  -0.570
  333   2HA   GLY  44          1HA       GLY  44  14.540   5.200  -0.898
  334    H    LYS  45           H        LYS  45  12.067   3.614   0.968
  335    HA   LYS  45           HA       LYS  45  11.954   1.430  -0.997
  336   1HB   LYS  45          2HB       LYS  45  10.848   0.266   0.837
  337   2HB   LYS  45          1HB       LYS  45  12.258   1.118   1.465
  338   1HG   LYS  45          2HG       LYS  45  10.335   3.044   1.714
  339   2HG   LYS  45          1HG       LYS  45   9.386   1.586   1.991
  340   1HD   LYS  45          2HD       LYS  45  10.414   1.138   3.972
  341   2HD   LYS  45          1HD       LYS  45  11.995   1.640   3.375
  342   1HE   LYS  45          2HE       LYS  45  11.433   3.989   3.685
  343   2HE   LYS  45          1HE       LYS  45   9.766   3.565   4.126
  344   1HZ   LYS  45          1HZ       LYS  45  10.522   2.377   6.016
  345   2HZ   LYS  45          2HZ       LYS  45  11.309   3.883   6.057
  346   3HZ   LYS  45          3HZ       LYS  45  12.146   2.497   5.541
  347    H    TYR  46           H        TYR  46   9.502   0.442  -1.013
  348    HA   TYR  46           HA       TYR  46   7.731   2.712  -1.861
  349   1HB   TYR  46          2HB       TYR  46   7.676  -0.194  -2.745
  350   2HB   TYR  46          1HB       TYR  46   6.814   1.151  -3.482
  351    HD1  TYR  46           1HD      TYR  46   9.333   3.073  -3.069
  352    HD2  TYR  46           2HD      TYR  46   8.745  -0.765  -4.898
  353    HE1  TYR  46           1HE      TYR  46  11.267   3.490  -4.559
  354    HE2  TYR  46           2HE      TYR  46  10.682  -0.350  -6.386
  355    HH   TYR  46           HH       TYR  46  12.797   1.101  -6.290
  356    H    THR  47           H        THR  47   5.427   2.446  -1.388
  357    HA   THR  47           HA       THR  47   4.852   0.508   0.831
  358    HB   THR  47           HB       THR  47   4.015   3.410   0.494
  359    HG1  THR  47           1HG      THR  47   6.122   3.089   1.275
  360   1HG2  THR  47          1HG2      THR  47   2.189   2.765   1.685
  361   2HG2  THR  47          2HG2      THR  47   3.304   2.650   3.046
  362   3HG2  THR  47          3HG2      THR  47   2.905   1.209   2.110
  363    H    VAL  48           H        VAL  48   2.984  -0.669   0.543
  364    HA   VAL  48           HA       VAL  48   1.338  -0.034  -1.884
  365    HB   VAL  48           HB       VAL  48   1.908  -2.526  -0.262
  366   1HG1  VAL  48          1HG1      VAL  48  -0.100  -2.095  -2.488
  367   2HG1  VAL  48          2HG1      VAL  48  -0.421  -2.686  -0.858
  368   3HG1  VAL  48          3HG1      VAL  48   0.478  -3.687  -1.997
  369   1HG2  VAL  48          1HG2      VAL  48   3.556  -1.671  -1.992
  370   2HG2  VAL  48          2HG2      VAL  48   2.309  -1.950  -3.209
  371   3HG2  VAL  48          3HG2      VAL  48   2.957  -3.304  -2.283
  372    H    SER  49           H        SER  49  -0.569   0.984  -1.419
  373    HA   SER  49           HA       SER  49  -1.813   0.616   1.271
  374   1HB   SER  49          2HB       SER  49  -1.929   2.656  -0.944
  375   2HB   SER  49          1HB       SER  49  -3.140   2.647   0.334
  376    HG   SER  49           HG       SER  49  -0.360   3.089   0.474
  377    H    VAL  50           H        VAL  50  -3.435  -0.938   1.312
  378    HA   VAL  50           HA       VAL  50  -5.236  -1.071  -1.085
  379    HB   VAL  50           HB       VAL  50  -5.279  -3.501  -0.792
  380   1HG1  VAL  50          1HG1      VAL  50  -2.362  -2.956  -0.538
  381   2HG1  VAL  50          2HG1      VAL  50  -3.221  -2.125  -1.833
  382   3HG1  VAL  50          3HG1      VAL  50  -3.230  -3.885  -1.757
  383   1HG2  VAL  50          1HG2      VAL  50  -5.036  -3.426   1.714
  384   2HG2  VAL  50          2HG2      VAL  50  -3.324  -3.075   1.489
  385   3HG2  VAL  50          3HG2      VAL  50  -3.990  -4.611   0.936
  386    H    PHE  51           H        PHE  51  -7.492  -1.199  -0.604
  387    HA   PHE  51           HA       PHE  51  -8.176  -1.458   2.313
  388   1HB   PHE  51          2HB       PHE  51  -8.596   0.765   2.216
  389   2HB   PHE  51          1HB       PHE  51  -8.457   0.779   0.469
  390    HD1  PHE  51           1HD      PHE  51 -10.691   1.090   3.221
  391    HD2  PHE  51           2HD      PHE  51 -10.500  -0.178  -0.876
  392    HE1  PHE  51           1HE      PHE  51 -13.143   1.345   3.030
  393    HE2  PHE  51           2HE      PHE  51 -12.958   0.072  -1.059
  394    HZ   PHE  51           HZ       PHE  51 -14.281   0.832   0.889
  395    H    ALA  52           H        ALA  52 -10.274  -2.371   2.744
  396    HA   ALA  52           HA       ALA  52 -11.904  -3.220   0.421
  397   1HB   ALA  52          1HB       ALA  52 -11.862  -5.557   1.758
  398   2HB   ALA  52          2HB       ALA  52 -10.244  -4.967   2.138
  399   3HB   ALA  52          3HB       ALA  52 -10.734  -5.179   0.457
  400    H    LYS  53           H        LYS  53 -14.000  -4.177   1.113
  401    HA   LYS  53           HA       LYS  53 -14.883  -3.073   3.768
  402   1HB   LYS  53          2HB       LYS  53 -16.121  -3.333   1.027
  403   2HB   LYS  53          1HB       LYS  53 -17.120  -3.064   2.456
  404   1HG   LYS  53          2HG       LYS  53 -15.381  -1.139   2.931
  405   2HG   LYS  53          1HG       LYS  53 -15.090  -1.254   1.195
  406   1HD   LYS  53          2HD       LYS  53 -17.472  -0.897   0.746
  407   2HD   LYS  53          1HD       LYS  53 -17.810  -0.854   2.478
  408   1HE   LYS  53          2HE       LYS  53 -15.961   1.053   2.467
  409   2HE   LYS  53          1HE       LYS  53 -16.450   1.198   0.768
  410   1HZ   LYS  53          1HZ       LYS  53 -18.759   1.304   1.474
  411   2HZ   LYS  53          2HZ       LYS  53 -17.863   2.556   2.195
  412   3HZ   LYS  53          3HZ       LYS  53 -18.293   1.183   3.100
  413    H    SER  54           H        SER  54 -13.862  -5.620   4.015
  414    HA   SER  54           HA       SER  54 -16.252  -7.213   4.626
  415   1HB   SER  54          2HB       SER  54 -16.016  -7.576   2.225
  416   2HB   SER  54          1HB       SER  54 -14.318  -7.999   2.427
  417    HG   SER  54           HG       SER  54 -14.897  -9.852   3.438
  418    H    THR  55           H        THR  55 -14.732  -6.638   6.635
  419    HA   THR  55           HA       THR  55 -13.546  -9.098   7.545
  420    HB   THR  55           HB       THR  55 -11.809  -8.418   5.910
  421    HG1  THR  55           1HG      THR  55 -10.109  -8.578   7.327
  422   1HG2  THR  55          1HG2      THR  55 -11.338  -6.243   5.627
  423   2HG2  THR  55          2HG2      THR  55 -10.660  -6.190   7.255
  424   3HG2  THR  55          3HG2      THR  55 -12.367  -5.829   6.998
  425    H    GLY  56           H        GLY  56 -11.498  -7.132   9.047
  426   1HA   GLY  56          2HA       GLY  56 -12.916  -6.838  11.452
  427   2HA   GLY  56          1HA       GLY  56 -11.564  -5.796  10.991
  428    H    ASP  57           H        ASP  57 -12.844  -4.797   8.598
  429    HA   ASP  57           HA       ASP  57 -15.016  -3.098   9.767
  430   1HB   ASP  57          2HB       ASP  57 -12.485  -2.354   9.079
  431   2HB   ASP  57          1HB       ASP  57 -13.326  -2.118   7.549
  432    HA   PRO  58           HA       PRO  58 -16.731  -5.640   6.290
  433   1HB   PRO  58          2HB       PRO  58 -19.292  -4.720   7.224
  434   2HB   PRO  58          1HB       PRO  58 -18.608  -6.344   7.316
  435   1HG   PRO  58          2HG       PRO  58 -18.959  -4.428   9.442
  436   2HG   PRO  58          1HG       PRO  58 -18.354  -6.084   9.551
  437   1HD   PRO  58          2HD       PRO  58 -16.850  -3.688   9.878
  438   2HD   PRO  58          1HD       PRO  58 -16.210  -5.348   9.789
  439    H    GLN  59           H        GLN  59 -17.131  -2.286   7.163
  440    HA   GLN  59           HA       GLN  59 -18.237  -1.742   4.429
  441   1HB   GLN  59          2HB       GLN  59 -19.080   0.366   5.568
  442   2HB   GLN  59          1HB       GLN  59 -19.770  -1.139   6.177
  443   1HG   GLN  59          2HG       GLN  59 -18.618  -1.025   8.175
  444   2HG   GLN  59          1HG       GLN  59 -17.273  -0.129   7.469
  445   1HE2  GLN  59          1HE2      GLN  59 -18.735   0.651   9.907
  446   2HE2  GLN  59          2HE2      GLN  59 -19.451   2.156   9.586
  447    H    GLY  60           H        GLY  60 -15.260  -1.728   5.664
  448   1HA   GLY  60          2HA       GLY  60 -14.079  -0.054   3.835
  449   2HA   GLY  60          1HA       GLY  60 -14.480   1.016   5.166
  450    H    VAL  61           H        VAL  61 -12.198  -1.189   3.975
  451    HA   VAL  61           HA       VAL  61 -10.743  -1.153   6.604
  452    HB   VAL  61           HB       VAL  61 -10.683  -3.314   4.473
  453   1HG1  VAL  61          1HG1      VAL  61  -9.324  -4.522   5.907
  454   2HG1  VAL  61          2HG1      VAL  61  -9.913  -3.681   7.343
  455   3HG1  VAL  61          3HG1      VAL  61  -8.787  -2.878   6.248
  456   1HG2  VAL  61          1HG2      VAL  61 -12.347  -4.485   5.540
  457   2HG2  VAL  61          2HG2      VAL  61 -12.892  -2.851   5.890
  458   3HG2  VAL  61          3HG2      VAL  61 -12.001  -3.759   7.110
  459    H    ILE  62           H        ILE  62  -8.521  -0.806   6.450
  460    HA   ILE  62           HA       ILE  62  -7.339  -0.431   3.748
  461    HB   ILE  62           HB       ILE  62  -6.731   1.718   5.675
  462   1HG1  ILE  62          2HG1      ILE  62  -9.541   1.341   4.596
  463   2HG1  ILE  62          1HG1      ILE  62  -9.076   1.377   6.284
  464   1HG2  ILE  62          1HG2      ILE  62  -6.261   2.740   3.722
  465   2HG2  ILE  62          2HG2      ILE  62  -7.909   2.492   3.144
  466   3HG2  ILE  62          3HG2      ILE  62  -6.689   1.243   2.896
  467   1HD1  ILE  62          1HD1      ILE  62  -8.825   3.671   4.342
  468   2HD1  ILE  62          2HD1      ILE  62  -8.330   3.702   6.035
  469   3HD1  ILE  62          3HD1      ILE  62 -10.032   3.518   5.617
  470    H    ARG  63           H        ARG  63  -5.003  -0.373   3.778
  471    HA   ARG  63           HA       ARG  63  -3.474  -0.670   6.236
  472   1HB   ARG  63          2HB       ARG  63  -4.860  -2.906   5.394
  473   2HB   ARG  63          1HB       ARG  63  -3.278  -3.152   4.656
  474   1HG   ARG  63          2HG       ARG  63  -2.442  -3.787   6.644
  475   2HG   ARG  63          1HG       ARG  63  -2.859  -2.216   7.326
  476   1HD   ARG  63          2HD       ARG  63  -5.245  -3.130   7.606
  477   2HD   ARG  63          1HD       ARG  63  -4.546  -4.730   7.284
  478    HE   ARG  63           HE       ARG  63  -3.447  -2.966   9.440
  479   1HH1  ARG  63          1HH2      ARG  63  -5.635  -5.434   9.103
  480   2HH1  ARG  63          2HH2      ARG  63  -4.826  -6.558  10.143
  481   1HH2  ARG  63          1HH1      ARG  63  -1.948  -4.642  10.415
  482   2HH2  ARG  63          2HH1      ARG  63  -2.738  -6.109  10.886
  483    H    HIS  64           H        HIS  64  -1.469   0.154   5.686
  484    HA   HIS  64           HA       HIS  64  -0.712   0.161   2.801
  485   1HB   HIS  64          2HB       HIS  64   0.652   1.658   5.040
  486   2HB   HIS  64          1HB       HIS  64   0.596   2.065   3.326
  487    HD1  HIS  64           1HD      HIS  64  -1.664   3.031   2.400
  488    HD2  HIS  64           2HD      HIS  64  -1.574   2.554   6.538
  489    HE1  HIS  64           1HE      HIS  64  -3.641   4.318   3.306
  490    H    TYR  65           H        TYR  65   0.410  -1.720   2.374
  491    HA   TYR  65           HA       TYR  65   2.304  -2.889   4.294
  492   1HB   TYR  65          2HB       TYR  65   2.043  -3.455   1.342
  493   2HB   TYR  65          1HB       TYR  65   2.541  -4.558   2.619
  494    HD1  TYR  65           1HD      TYR  65   0.435  -3.942   4.676
  495    HD2  TYR  65           2HD      TYR  65   0.135  -4.545   0.433
  496    HE1  TYR  65           1HE      TYR  65  -1.905  -4.698   4.950
  497    HE2  TYR  65           2HE      TYR  65  -2.203  -5.304   0.708
  498    HH   TYR  65           HH       TYR  65  -3.542  -6.083   3.738
  499    H    VAL  66           H        VAL  66   4.395  -2.132   4.450
  500    HA   VAL  66           HA       VAL  66   5.464  -0.585   2.115
  501    HB   VAL  66           HB       VAL  66   6.199  -0.392   5.054
  502   1HG1  VAL  66          1HG1      VAL  66   6.994   1.926   4.063
  503   2HG1  VAL  66          2HG1      VAL  66   7.012   1.038   2.539
  504   3HG1  VAL  66          3HG1      VAL  66   8.012   0.497   3.887
  505   1HG2  VAL  66          1HG2      VAL  66   4.369   0.898   5.347
  506   2HG2  VAL  66          2HG2      VAL  66   3.862   0.536   3.698
  507   3HG2  VAL  66          3HG2      VAL  66   4.874   1.943   4.021
  508    H    VAL  67           H        VAL  67   7.893  -0.687   1.947
  509    HA   VAL  67           HA       VAL  67   8.851  -3.435   2.658
  510    HB   VAL  67           HB       VAL  67   9.543  -1.549   0.386
  511   1HG1  VAL  67          1HG1      VAL  67  11.386  -2.792   0.044
  512   2HG1  VAL  67          2HG1      VAL  67  10.418  -4.265   0.011
  513   3HG1  VAL  67          3HG1      VAL  67  11.055  -3.662   1.541
  514   1HG2  VAL  67          1HG2      VAL  67   7.321  -3.134   0.669
  515   2HG2  VAL  67          2HG2      VAL  67   8.435  -4.240  -0.135
  516   3HG2  VAL  67          3HG2      VAL  67   8.033  -2.695  -0.883
  517    H    CYS  68           H        CYS  68  10.496  -3.473   4.115
  518    HA   CYS  68           HA       CYS  68  11.907  -0.969   4.805
  519   1HB   CYS  68          2HB       CYS  68  10.965  -2.543   6.509
  520   2HB   CYS  68          1HB       CYS  68  12.072  -3.788   5.929
  521    HG   CYS  68           HG       CYS  68  13.385  -1.149   6.876
  522    H    SER  69           H        SER  69  14.314  -0.956   4.829
  523    HA   SER  69           HA       SER  69  15.511  -2.937   2.927
  524   1HB   SER  69          2HB       SER  69  16.833  -0.798   2.200
  525   2HB   SER  69          1HB       SER  69  15.189  -1.032   1.609
  526    HG   SER  69           HG       SER  69  16.030   1.042   2.831
  527    H    THR  70           H        THR  70  17.418  -3.777   3.611
  528    HA   THR  70           HA       THR  70  18.666  -2.674   6.086
  529    HB   THR  70           HB       THR  70  17.929  -5.072   5.908
  530    HG1  THR  70           1HG      THR  70  19.834  -5.890   6.746
  531   1HG2  THR  70          1HG2      THR  70  18.854  -4.981   3.371
  532   2HG2  THR  70          2HG2      THR  70  18.649  -6.484   4.270
  533   3HG2  THR  70          3HG2      THR  70  20.236  -5.724   4.170
  534    HA   PRO  71           HA       PRO  71  22.057  -0.997   3.866
  535   1HB   PRO  71          2HB       PRO  71  24.093  -2.010   5.626
  536   2HB   PRO  71          1HB       PRO  71  23.389  -0.392   5.587
  537   1HG   PRO  71          2HG       PRO  71  22.995  -2.404   7.571
  538   2HG   PRO  71          1HG       PRO  71  22.225  -0.818   7.479
  539   1HD   PRO  71          2HD       PRO  71  21.051  -3.423   6.970
  540   2HD   PRO  71          1HD       PRO  71  20.244  -1.838   6.996
  541    H    GLN  72           H        GLN  72  21.639  -4.317   3.967
  542    HA   GLN  72           HA       GLN  72  24.180  -4.932   2.559
  543   1HB   GLN  72          2HB       GLN  72  23.322  -6.435   4.308
  544   2HB   GLN  72          1HB       GLN  72  21.796  -6.593   3.448
  545   1HG   GLN  72          2HG       GLN  72  23.319  -8.534   3.076
  546   2HG   GLN  72          1HG       GLN  72  22.914  -7.699   1.581
  547   1HE2  GLN  72          1HE2      GLN  72  24.973  -8.540   0.646
  548   2HE2  GLN  72          2HE2      GLN  72  26.448  -7.806   1.053
  549    H    SER  73           H        SER  73  21.911  -3.180   1.466
  550    HA   SER  73           HA       SER  73  20.896  -2.825  -0.637
  551   1HB   SER  73          2HB       SER  73  23.293  -3.831  -1.150
  552   2HB   SER  73          1HB       SER  73  22.370  -5.248  -1.643
  553    HG   SER  73           HG       SER  73  22.084  -2.586  -2.598
  554    H    GLN  74           H        GLN  74  19.413  -4.248   1.220
  555    HA   GLN  74           HA       GLN  74  17.990  -6.246  -0.496
  556   1HB   GLN  74          2HB       GLN  74  18.144  -6.708   2.432
  557   2HB   GLN  74          1HB       GLN  74  18.224  -7.872   1.115
  558   1HG   GLN  74          2HG       GLN  74  20.531  -6.809   0.601
  559   2HG   GLN  74          1HG       GLN  74  20.426  -6.134   2.226
  560   1HE2  GLN  74          1HE2      GLN  74  20.823  -9.119   0.384
  561   2HE2  GLN  74          2HE2      GLN  74  21.162 -10.116   1.715
  562    H    TYR  75           H        TYR  75  15.733  -6.695   0.457
  563    HA   TYR  75           HA       TYR  75  14.627  -4.395   2.014
  564   1HB   TYR  75          2HB       TYR  75  13.512  -5.336  -0.638
  565   2HB   TYR  75          1HB       TYR  75  12.983  -3.941   0.295
  566    HD1  TYR  75           1HD      TYR  75  15.820  -5.353  -1.636
  567    HD2  TYR  75           2HD      TYR  75  14.101  -1.846   0.140
  568    HE1  TYR  75           1HE      TYR  75  17.509  -3.957  -2.776
  569    HE2  TYR  75           2HE      TYR  75  15.787  -0.445  -1.004
  570    HH   TYR  75           HH       TYR  75  18.044  -0.692  -1.964
  571    H    TYR  76           H        TYR  76  12.404  -4.817   2.791
  572    HA   TYR  76           HA       TYR  76  10.971  -7.267   2.406
  573   1HB   TYR  76          2HB       TYR  76  11.591  -8.417   4.530
  574   2HB   TYR  76          1HB       TYR  76  12.989  -8.239   3.480
  575    HD1  TYR  76           1HD      TYR  76  14.875  -6.881   4.136
  576    HD2  TYR  76           2HD      TYR  76  11.258  -6.845   6.441
  577    HE1  TYR  76           1HE      TYR  76  16.041  -5.674   5.956
  578    HE2  TYR  76           2HE      TYR  76  12.418  -5.638   8.259
  579    HH   TYR  76           HH       TYR  76  15.149  -4.010   7.924
  580    H    LEU  77           H        LEU  77   9.196  -7.501   4.013
  581    HA   LEU  77           HA       LEU  77   8.476  -4.886   5.294
  582   1HB   LEU  77          2HB       LEU  77   7.039  -6.443   3.636
  583   2HB   LEU  77          1HB       LEU  77   6.667  -7.288   5.139
  584    HG   LEU  77           HG       LEU  77   6.469  -4.339   5.288
  585   1HD1  LEU  77          1HD1      LEU  77   4.586  -4.049   3.942
  586   2HD1  LEU  77          2HD1      LEU  77   4.193  -5.767   3.945
  587   3HD1  LEU  77          3HD1      LEU  77   5.533  -5.171   2.965
  588   1HD2  LEU  77          1HD2      LEU  77   4.170  -5.248   6.266
  589   2HD2  LEU  77          2HD2      LEU  77   5.663  -5.387   7.194
  590   3HD2  LEU  77          3HD2      LEU  77   5.049  -6.776   6.298
  591    H    ALA  78           H        ALA  78   9.575  -8.059   5.788
  592    HA   ALA  78           HA       ALA  78   9.662  -7.732   8.727
  593   1HB   ALA  78          1HB       ALA  78   9.025 -10.326   8.616
  594   2HB   ALA  78          2HB       ALA  78   8.250  -9.843   7.107
  595   3HB   ALA  78          3HB       ALA  78   7.754  -9.103   8.629
  596    H    GLU  79           H        GLU  79  11.819  -8.111   9.212
  597    HA   GLU  79           HA       GLU  79  13.830  -8.713   7.385
  598   1HB   GLU  79          2HB       GLU  79  13.462  -8.933  10.341
  599   2HB   GLU  79          1HB       GLU  79  14.908  -9.673   9.652
  600   1HG   GLU  79          2HG       GLU  79  15.322  -7.484   8.442
  601   2HG   GLU  79          1HG       GLU  79  14.033  -6.787   9.425
  602    H    LYS  80           H        LYS  80  11.539 -10.918   8.710
  603    HA   LYS  80           HA       LYS  80  12.724 -13.417   8.810
  604   1HB   LYS  80          2HB       LYS  80  10.130 -12.258   8.117
  605   2HB   LYS  80          1HB       LYS  80  10.400 -13.804   7.313
  606   1HG   LYS  80          2HG       LYS  80  11.077 -14.752   9.559
  607   2HG   LYS  80          1HG       LYS  80  10.529 -13.241  10.286
  608   1HD   LYS  80          2HD       LYS  80   8.281 -13.611   9.644
  609   2HD   LYS  80          1HD       LYS  80   8.733 -14.853   8.474
  610   1HE   LYS  80          2HE       LYS  80   9.564 -15.419  11.262
  611   2HE   LYS  80          1HE       LYS  80   7.812 -15.433  10.975
  612   1HZ   LYS  80          1HZ       LYS  80   8.110 -16.904   9.129
  613   2HZ   LYS  80          2HZ       LYS  80   8.898 -17.586  10.470
  614   3HZ   LYS  80          3HZ       LYS  80   9.799 -16.816   9.252
  615    H    HIS  81           H        HIS  81  11.901 -11.586   5.865
  616    HA   HIS  81           HA       HIS  81  13.852 -13.198   4.321
  617   1HB   HIS  81          2HB       HIS  81  10.879 -13.024   3.715
  618   2HB   HIS  81          1HB       HIS  81  12.079 -13.695   2.611
  619    HD1  HIS  81           1HD      HIS  81  13.675 -15.626   3.951
  620    HD2  HIS  81           2HD      HIS  81   9.766 -15.010   5.263
  621    HE1  HIS  81           1HE      HIS  81  13.030 -17.688   5.272
  622    H    LEU  82           H        LEU  82  14.751 -11.891   2.668
  623    HA   LEU  82           HA       LEU  82  13.299  -9.414   1.944
  624   1HB   LEU  82          2HB       LEU  82  15.210  -8.042   2.624
  625   2HB   LEU  82          1HB       LEU  82  14.673  -9.014   3.991
  626    HG   LEU  82           HG       LEU  82  16.879  -9.899   2.144
  627   1HD1  LEU  82          1HD1      LEU  82  17.623  -8.865   4.804
  628   2HD1  LEU  82          2HD1      LEU  82  17.019  -7.633   3.697
  629   3HD1  LEU  82          3HD1      LEU  82  18.406  -8.621   3.245
  630   1HD2  LEU  82          1HD2      LEU  82  15.562 -10.927   4.563
  631   2HD2  LEU  82          2HD2      LEU  82  17.319 -10.876   4.706
  632   3HD2  LEU  82          3HD2      LEU  82  16.567 -11.778   3.391
  633    H    PHE  83           H        PHE  83  13.780  -8.695  -0.122
  634    HA   PHE  83           HA       PHE  83  15.730 -10.344  -1.686
  635   1HB   PHE  83          2HB       PHE  83  13.073  -9.049  -2.212
  636   2HB   PHE  83          1HB       PHE  83  14.179  -9.286  -3.570
  637    HD1  PHE  83           1HD      PHE  83  12.802 -11.149  -0.616
  638    HD2  PHE  83           2HD      PHE  83  14.160 -11.336  -4.686
  639    HE1  PHE  83           1HE      PHE  83  12.177 -13.546  -0.715
  640    HE2  PHE  83           2HE      PHE  83  13.532 -13.732  -4.786
  641    HZ   PHE  83           HZ       PHE  83  12.542 -14.838  -2.800
  642    H    SER  84           H        SER  84  15.872  -8.567  -3.917
  643    HA   SER  84           HA       SER  84  17.527  -6.403  -2.703
  644   1HB   SER  84          2HB       SER  84  17.411  -7.380  -5.569
  645   2HB   SER  84          1HB       SER  84  18.702  -6.458  -4.804
  646    HG   SER  84           HG       SER  84  19.143  -8.238  -3.505
  647    H    THR  85           H        THR  85  14.395  -6.596  -3.667
  648    HA   THR  85           HA       THR  85  14.194  -3.732  -4.173
  649    HB   THR  85           HB       THR  85  13.240  -5.413  -6.473
  650    HG1  THR  85           1HG      THR  85  15.874  -4.403  -6.278
  651   1HG2  THR  85          1HG2      THR  85  14.578  -2.863  -6.968
  652   2HG2  THR  85          2HG2      THR  85  13.226  -2.715  -5.847
  653   3HG2  THR  85          3HG2      THR  85  12.970  -3.400  -7.451
  654    H    ILE  86           H        ILE  86  11.865  -3.078  -4.475
  655    HA   ILE  86           HA       ILE  86  10.097  -4.597  -2.786
  656    HB   ILE  86           HB       ILE  86   9.907  -2.227  -4.624
  657   1HG1  ILE  86          2HG1      ILE  86   8.981  -1.513  -2.157
  658   2HG1  ILE  86          1HG1      ILE  86  10.100  -2.807  -1.735
  659   1HG2  ILE  86          1HG2      ILE  86   7.513  -2.108  -3.391
  660   2HG2  ILE  86          2HG2      ILE  86   7.659  -3.858  -3.541
  661   3HG2  ILE  86          3HG2      ILE  86   7.716  -2.842  -4.981
  662   1HD1  ILE  86          1HD1      ILE  86  11.453  -1.300  -3.675
  663   2HD1  ILE  86          2HD1      ILE  86  11.768  -1.308  -1.940
  664   3HD1  ILE  86          3HD1      ILE  86  10.679  -0.106  -2.631
  665    HA   PRO  87           HA       PRO  87   7.823  -5.727  -6.970
  666   1HB   PRO  87          2HB       PRO  87   9.882  -5.807  -8.980
  667   2HB   PRO  87          1HB       PRO  87   8.430  -4.801  -8.950
  668   1HG   PRO  87          2HG       PRO  87  11.166  -4.003  -8.495
  669   2HG   PRO  87          1HG       PRO  87   9.723  -2.988  -8.561
  670   1HD   PRO  87          2HD       PRO  87  11.264  -3.630  -6.253
  671   2HD   PRO  87          1HD       PRO  87   9.717  -2.756  -6.296
  672    H    GLU  88           H        GLU  88  11.270  -6.470  -6.519
  673    HA   GLU  88           HA       GLU  88  11.216  -9.202  -7.376
  674   1HB   GLU  88          2HB       GLU  88  13.168  -7.588  -6.813
  675   2HB   GLU  88          1HB       GLU  88  12.905  -8.069  -5.136
  676   1HG   GLU  88          2HG       GLU  88  14.478  -9.648  -5.786
  677   2HG   GLU  88          1HG       GLU  88  12.984 -10.509  -6.157
  678    H    LEU  89           H        LEU  89  10.632  -7.654  -4.224
  679    HA   LEU  89           HA       LEU  89  10.262 -10.048  -2.678
  680   1HB   LEU  89          2HB       LEU  89   9.993  -7.168  -2.449
  681   2HB   LEU  89          1HB       LEU  89   8.623  -7.962  -1.675
  682    HG   LEU  89           HG       LEU  89  11.405  -8.972  -1.165
  683   1HD1  LEU  89          1HD1      LEU  89  10.080  -6.749   0.413
  684   2HD1  LEU  89          2HD1      LEU  89  11.339  -6.467  -0.791
  685   3HD1  LEU  89          3HD1      LEU  89  11.693  -7.417   0.649
  686   1HD2  LEU  89          1HD2      LEU  89  10.416 -10.063   0.601
  687   2HD2  LEU  89          2HD2      LEU  89   8.983  -9.894  -0.412
  688   3HD2  LEU  89          3HD2      LEU  89   9.272  -8.754   0.903
  689    H    ILE  90           H        ILE  90   7.818  -7.823  -4.083
  690    HA   ILE  90           HA       ILE  90   5.493  -9.280  -3.478
  691    HB   ILE  90           HB       ILE  90   6.178  -7.666  -5.960
  692   1HG1  ILE  90          2HG1      ILE  90   6.609  -6.395  -3.915
  693   2HG1  ILE  90          1HG1      ILE  90   5.130  -5.797  -4.665
  694   1HG2  ILE  90          1HG2      ILE  90   3.586  -7.181  -5.593
  695   2HG2  ILE  90          2HG2      ILE  90   3.635  -8.774  -4.839
  696   3HG2  ILE  90          3HG2      ILE  90   4.127  -8.578  -6.522
  697   1HD1  ILE  90          1HD1      ILE  90   4.078  -7.715  -3.079
  698   2HD1  ILE  90          2HD1      ILE  90   4.307  -6.051  -2.542
  699   3HD1  ILE  90          3HD1      ILE  90   5.494  -7.286  -2.118
  700    H    ASN  91           H        ASN  91   7.491  -9.527  -6.448
  701    HA   ASN  91           HA       ASN  91   6.005 -11.618  -7.698
  702   1HB   ASN  91          2HB       ASN  91   8.359 -10.096  -8.107
  703   2HB   ASN  91          1HB       ASN  91   8.858 -11.785  -8.186
  704   1HD2  ASN  91          1HD2      ASN  91   7.029  -9.284  -9.819
  705   2HD2  ASN  91          2HD2      ASN  91   6.584 -10.216 -11.166
  706    H    TYR  92           H        TYR  92   8.701 -11.711  -5.383
  707    HA   TYR  92           HA       TYR  92   9.066 -14.567  -5.403
  708   1HB   TYR  92          2HB       TYR  92  10.865 -13.707  -4.325
  709   2HB   TYR  92          1HB       TYR  92  10.032 -12.184  -4.046
  710    HD1  TYR  92           1HD      TYR  92   9.400 -11.578  -1.872
  711    HD2  TYR  92           2HD      TYR  92  10.221 -15.696  -2.766
  712    HE1  TYR  92           1HE      TYR  92   9.178 -12.140   0.530
  713    HE2  TYR  92           2HE      TYR  92   9.999 -16.261  -0.362
  714    HH   TYR  92           HH       TYR  92   8.986 -15.389   1.646
  715    H    HIS  93           H        HIS  93   6.706 -12.488  -3.899
  716    HA   HIS  93           HA       HIS  93   5.833 -14.644  -2.036
  717   1HB   HIS  93          2HB       HIS  93   6.169 -12.313  -1.243
  718   2HB   HIS  93          1HB       HIS  93   4.955 -11.760  -2.394
  719    HD1  HIS  93           1HD      HIS  93   4.340 -15.020  -0.717
  720    HD2  HIS  93           2HD      HIS  93   3.261 -11.032  -0.156
  721    HE1  HIS  93           1HE      HIS  93   2.439 -15.021   0.955
  722    H    GLN  94           H        GLN  94   4.477 -12.499  -4.568
  723    HA   GLN  94           HA       GLN  94   1.971 -14.023  -4.679
  724   1HB   GLN  94          2HB       GLN  94   2.451 -11.489  -5.056
  725   2HB   GLN  94          1HB       GLN  94   2.952 -11.983  -6.674
  726   1HG   GLN  94          2HG       GLN  94   0.616 -11.396  -6.794
  727   2HG   GLN  94          1HG       GLN  94   0.725 -13.154  -6.910
  728   1HE2  GLN  94          1HE2      GLN  94  -0.076 -14.425  -5.118
  729   2HE2  GLN  94          2HE2      GLN  94  -0.956 -13.732  -3.842
  730    H    HIS  95           H        HIS  95   4.369 -13.218  -7.228
  731    HA   HIS  95           HA       HIS  95   3.532 -15.308  -9.009
  732   1HB   HIS  95          2HB       HIS  95   5.907 -13.492  -8.681
  733   2HB   HIS  95          1HB       HIS  95   5.963 -14.771  -9.894
  734    HD1  HIS  95           1HD      HIS  95   4.873 -11.364  -9.459
  735    HD2  HIS  95           2HD      HIS  95   3.498 -14.624 -11.665
  736    HE1  HIS  95           1HE      HIS  95   3.348 -10.426 -11.249
  737    H    ASN  96           H        ASN  96   3.477 -17.253  -7.667
  738    HA   ASN  96           HA       ASN  96   6.053 -18.669  -7.599
  739   1HB   ASN  96          2HB       ASN  96   5.851 -17.181  -5.518
  740   2HB   ASN  96          1HB       ASN  96   4.535 -18.243  -5.014
  741   1HD2  ASN  96          1HD2      ASN  96   5.164 -20.694  -5.034
  742   2HD2  ASN  96          2HD2      ASN  96   6.732 -21.076  -4.506
  743    H    SER  97           H        SER  97   2.826 -18.842  -6.030
  744    HA   SER  97           HA       SER  97   2.645 -21.708  -6.815
  745   1HB   SER  97          2HB       SER  97   2.164 -20.446  -4.489
  746   2HB   SER  97          1HB       SER  97   0.563 -20.300  -5.208
  747    HG   SER  97           HG       SER  97   2.051 -22.709  -4.963
  748    H    ALA  98           H        ALA  98   0.152 -22.277  -7.286
  749    HA   ALA  98           HA       ALA  98  -0.752 -20.406  -9.451
  750   1HB   ALA  98          1HB       ALA  98  -1.074 -22.271 -10.747
  751   2HB   ALA  98          2HB       ALA  98  -1.638 -23.238  -9.385
  752   3HB   ALA  98          3HB       ALA  98   0.089 -22.988  -9.631
  753    H    GLY  99           H        GLY  99  -2.953 -19.837  -9.490
  754   1HA   GLY  99          2HA       GLY  99  -5.163 -19.613  -8.722
  755   2HA   GLY  99          1HA       GLY  99  -4.966 -21.162  -7.899
  756    H    LEU 100           H        LEU 100  -3.410 -17.954  -7.561
  757    HA   LEU 100           HA       LEU 100  -4.377 -17.811  -4.752
  758   1HB   LEU 100          2HB       LEU 100  -2.176 -19.085  -4.937
  759   2HB   LEU 100          1HB       LEU 100  -1.449 -17.580  -5.501
  760    HG   LEU 100           HG       LEU 100  -2.603 -16.588  -3.332
  761   1HD1  LEU 100          1HD1      LEU 100  -2.224 -18.509  -1.548
  762   2HD1  LEU 100          2HD1      LEU 100  -2.565 -19.558  -2.924
  763   3HD1  LEU 100          3HD1      LEU 100  -3.762 -18.374  -2.401
  764   1HD2  LEU 100          1HD2      LEU 100  -0.112 -16.862  -3.945
  765   2HD2  LEU 100          2HD2      LEU 100  -0.159 -18.330  -2.970
  766   3HD2  LEU 100          3HD2      LEU 100  -0.505 -16.767  -2.228
  767    H    ILE 101           H        ILE 101  -5.504 -15.886  -5.227
  768    HA   ILE 101           HA       ILE 101  -5.783 -13.568  -5.560
  769    HB   ILE 101           HB       ILE 101  -2.774 -13.582  -5.144
  770   1HG1  ILE 101          2HG1      ILE 101  -3.895 -14.810  -3.338
  771   2HG1  ILE 101          1HG1      ILE 101  -3.340 -13.246  -2.742
  772   1HG2  ILE 101          1HG2      ILE 101  -2.962 -11.313  -4.593
  773   2HG2  ILE 101          2HG2      ILE 101  -4.697 -11.426  -4.302
  774   3HG2  ILE 101          3HG2      ILE 101  -4.075 -11.468  -5.951
  775   1HD1  ILE 101          1HD1      ILE 101  -5.480 -13.073  -1.965
  776   2HD1  ILE 101          2HD1      ILE 101  -6.101 -14.251  -3.121
  777   3HD1  ILE 101          3HD1      ILE 101  -5.831 -12.582  -3.622
  778    H    SER 102           H        SER 102  -5.575 -11.984  -7.252
  779    HA   SER 102           HA       SER 102  -4.229 -13.030  -9.714
  780   1HB   SER 102          2HB       SER 102  -6.822 -12.445  -9.295
  781   2HB   SER 102          1HB       SER 102  -6.258 -10.843  -9.762
  782    HG   SER 102           HG       SER 102  -5.932 -13.267 -11.209
  783    H    ARG 103           H        ARG 103  -2.275 -11.929  -8.423
  784    HA   ARG 103           HA       ARG 103  -0.721 -10.149  -8.323
  785   1HB   ARG 103          2HB       ARG 103  -2.267  -9.299 -10.797
  786   2HB   ARG 103          1HB       ARG 103  -0.589  -8.909 -10.420
  787   1HG   ARG 103          2HG       ARG 103  -1.658 -11.718 -10.846
  788   2HG   ARG 103          1HG       ARG 103  -0.779 -10.781 -12.054
  789   1HD   ARG 103          2HD       ARG 103   1.223 -10.767 -10.716
  790   2HD   ARG 103          1HD       ARG 103   0.358 -11.425  -9.314
  791    HE   ARG 103           HE       ARG 103   0.966 -12.936 -11.810
  792   1HH1  ARG 103          1HH2      ARG 103   1.911 -13.590  -8.955
  793   2HH1  ARG 103          2HH2      ARG 103   0.869 -14.918  -8.570
  794   1HH2  ARG 103          1HH1      ARG 103  -1.335 -14.288 -11.172
  795   2HH2  ARG 103          2HH1      ARG 103  -0.968 -15.315  -9.826
  796    H    LEU 104           H        LEU 104  -1.427  -7.413  -9.435
  797    HA   LEU 104           HA       LEU 104  -2.234  -6.077  -7.103
  798   1HB   LEU 104          2HB       LEU 104  -1.295  -5.235  -9.359
  799   2HB   LEU 104          1HB       LEU 104  -2.974  -5.195  -9.899
  800    HG   LEU 104           HG       LEU 104  -2.301  -3.909  -7.282
  801   1HD1  LEU 104          1HD1      LEU 104  -0.613  -3.207  -9.124
  802   2HD1  LEU 104          2HD1      LEU 104  -1.469  -1.928  -8.261
  803   3HD1  LEU 104          3HD1      LEU 104  -1.991  -2.403  -9.877
  804   1HD2  LEU 104          1HD2      LEU 104  -3.998  -2.261  -8.586
  805   2HD2  LEU 104          2HD2      LEU 104  -4.554  -3.655  -7.660
  806   3HD2  LEU 104          3HD2      LEU 104  -4.378  -3.774  -9.411
  807    H    LYS 105           H        LYS 105  -4.273  -5.338  -6.329
  808    HA   LYS 105           HA       LYS 105  -6.564  -7.020  -7.065
  809   1HB   LYS 105          2HB       LYS 105  -6.037  -4.847  -5.027
  810   2HB   LYS 105          1HB       LYS 105  -7.580  -5.695  -5.149
  811   1HG   LYS 105          2HG       LYS 105  -5.386  -7.589  -5.146
  812   2HG   LYS 105          1HG       LYS 105  -5.294  -6.539  -3.733
  813   1HD   LYS 105          2HD       LYS 105  -6.779  -8.045  -2.865
  814   2HD   LYS 105          1HD       LYS 105  -7.952  -7.065  -3.745
  815   1HE   LYS 105          2HE       LYS 105  -6.624  -9.173  -5.357
  816   2HE   LYS 105          1HE       LYS 105  -7.724  -9.755  -4.090
  817   1HZ   LYS 105          1HZ       LYS 105  -9.450  -8.357  -4.892
  818   2HZ   LYS 105          2HZ       LYS 105  -8.835  -9.187  -6.242
  819   3HZ   LYS 105          3HZ       LYS 105  -8.410  -7.565  -5.972
  820    H    TYR 106           H        TYR 106  -7.066  -3.607  -6.245
  821    HA   TYR 106           HA       TYR 106  -8.215  -3.229  -8.993
  822   1HB   TYR 106          2HB       TYR 106  -9.787  -3.565  -6.995
  823   2HB   TYR 106          1HB       TYR 106  -9.222  -1.997  -6.422
  824    HD1  TYR 106           1HD      TYR 106  -9.152  -0.122  -8.371
  825    HD2  TYR 106           2HD      TYR 106 -11.711  -3.568  -8.286
  826    HE1  TYR 106           1HE      TYR 106 -10.725   1.012  -9.913
  827    HE2  TYR 106           2HE      TYR 106 -13.288  -2.434  -9.829
  828    HH   TYR 106           HH       TYR 106 -13.110   0.893 -10.518
  829    HA   PRO 107           HA       PRO 107  -5.201   0.129  -8.899
  830   1HB   PRO 107          2HB       PRO 107  -6.224   1.009 -11.431
  831   2HB   PRO 107          1HB       PRO 107  -4.728   0.128 -11.108
  832   1HG   PRO 107          2HG       PRO 107  -7.077  -0.864 -12.391
  833   2HG   PRO 107          1HG       PRO 107  -5.613  -1.763 -11.985
  834   1HD   PRO 107          2HD       PRO 107  -8.231  -1.909 -10.720
  835   2HD   PRO 107          1HD       PRO 107  -6.794  -2.913 -10.409
  836    H    VAL 108           H        VAL 108  -6.851   0.922  -7.168
  837    HA   VAL 108           HA       VAL 108  -8.332   3.288  -8.243
  838    HB   VAL 108           HB       VAL 108  -9.742   1.437  -7.419
  839   1HG1  VAL 108          1HG1      VAL 108  -9.213   0.237  -5.595
  840   2HG1  VAL 108          2HG1      VAL 108  -9.170   1.690  -4.596
  841   3HG1  VAL 108          3HG1      VAL 108  -7.727   1.179  -5.471
  842   1HG2  VAL 108          1HG2      VAL 108 -10.931   3.351  -7.019
  843   2HG2  VAL 108          2HG2      VAL 108  -9.629   4.087  -6.086
  844   3HG2  VAL 108          3HG2      VAL 108 -10.675   2.880  -5.340
  845    H    SER 109           H        SER 109  -6.508   4.715  -7.852
  846    HA   SER 109           HA       SER 109  -5.528   4.860  -5.056
  847   1HB   SER 109          2HB       SER 109  -4.597   6.103  -7.652
  848   2HB   SER 109          1HB       SER 109  -3.780   6.300  -6.100
  849    HG   SER 109           HG       SER 109  -2.821   4.582  -7.062
  850    H    GLN 110           H        GLN 110  -4.801   7.784  -5.831
  851    HA   GLN 110           HA       GLN 110  -6.537   9.206  -4.278
  852   1HB   GLN 110          2HB       GLN 110  -5.902  11.152  -5.737
  853   2HB   GLN 110          1HB       GLN 110  -4.534  10.127  -5.305
  854   1HG   GLN 110          2HG       GLN 110  -5.152   8.877  -7.546
  855   2HG   GLN 110          1HG       GLN 110  -5.930  10.410  -7.943
  856   1HE2  GLN 110          1HE2      GLN 110  -2.850   9.594  -6.235
  857   2HE2  GLN 110          2HE2      GLN 110  -1.879  10.595  -7.203
  858    H    GLN 111           H        GLN 111  -7.068   8.446  -7.723
  859    HA   GLN 111           HA       GLN 111  -9.002   8.708  -9.069
  860   1HB   GLN 111          2HB       GLN 111  -9.926   7.677  -6.381
  861   2HB   GLN 111          1HB       GLN 111 -10.959   7.679  -7.814
  862   1HG   GLN 111          2HG       GLN 111  -8.332   6.580  -8.414
  863   2HG   GLN 111          1HG       GLN 111  -9.106   5.700  -7.097
  864   1HE2  GLN 111          1HE2      GLN 111 -10.643   7.315  -9.920
  865   2HE2  GLN 111          2HE2      GLN 111 -11.372   5.906 -10.522
  866    H    ASN 112           H        ASN 112 -11.604   9.379  -8.495
  867    HA   ASN 112           HA       ASN 112 -11.406  12.167  -7.476
  868   1HB   ASN 112          2HB       ASN 112 -12.457  10.921  -9.923
  869   2HB   ASN 112          1HB       ASN 112 -13.571  12.070  -9.182
  870   1HD2  ASN 112          1HD2      ASN 112 -11.391  12.056 -11.564
  871   2HD2  ASN 112          2HD2      ASN 112 -10.695  13.593 -11.384
  872    H    LYS 113           H        LYS 113 -12.416   9.297  -6.445
  873    HA   LYS 113           HA       LYS 113 -14.061   8.575  -4.915
  874   1HB   LYS 113          2HB       LYS 113 -14.665  11.538  -4.660
  875   2HB   LYS 113          1HB       LYS 113 -14.868  10.289  -3.433
  876   1HG   LYS 113          2HG       LYS 113 -12.229  11.250  -4.581
  877   2HG   LYS 113          1HG       LYS 113 -12.849  11.599  -2.967
  878   1HD   LYS 113          2HD       LYS 113 -11.905   9.700  -2.224
  879   2HD   LYS 113          1HD       LYS 113 -12.964   8.780  -3.289
  880   1HE   LYS 113          2HE       LYS 113 -11.107   9.626  -5.092
  881   2HE   LYS 113          1HE       LYS 113 -10.105   9.482  -3.638
  882   1HZ   LYS 113          1HZ       LYS 113 -11.386   7.293  -3.303
  883   2HZ   LYS 113          2HZ       LYS 113 -10.136   7.325  -4.451
  884   3HZ   LYS 113          3HZ       LYS 113 -11.756   7.419  -4.952
  885    H    ASN 114           H        ASN 114 -16.602   9.652  -4.372
  886    HA   ASN 114           HA       ASN 114 -18.064  10.321  -6.790
  887   1HB   ASN 114          2HB       ASN 114 -19.240   8.088  -6.902
  888   2HB   ASN 114          1HB       ASN 114 -17.537   8.020  -7.345
  889   1HD2  ASN 114          1HD2      ASN 114 -17.623   5.675  -6.698
  890   2HD2  ASN 114          2HD2      ASN 114 -17.526   5.264  -5.053
  891    H    ALA 115           H        ALA 115 -20.549   9.788  -6.290
  892    HA   ALA 115           HA       ALA 115 -21.485   9.501  -3.623
  893   1HB   ALA 115          1HB       ALA 115 -21.953  12.255  -3.750
  894   2HB   ALA 115          2HB       ALA 115 -20.290  12.075  -4.306
  895   3HB   ALA 115          3HB       ALA 115 -20.763  11.450  -2.727
  896    HA   PRO 116           HA       PRO 116 -24.968  11.679  -6.208
  897   1HB   PRO 116          2HB       PRO 116 -23.981  12.020  -8.889
  898   2HB   PRO 116          1HB       PRO 116 -24.508  13.268  -7.757
  899   1HG   PRO 116          2HG       PRO 116 -21.830  12.674  -8.605
  900   2HG   PRO 116          1HG       PRO 116 -22.363  13.932  -7.487
  901   1HD   PRO 116          2HD       PRO 116 -20.931  11.517  -6.867
  902   2HD   PRO 116          1HD       PRO 116 -21.504  12.765  -5.735
  903    H    SER 117           H        SER 117 -22.633   9.628  -7.947
  904    HA   SER 117           HA       SER 117 -24.857   7.699  -8.507
  905   1HB   SER 117          2HB       SER 117 -23.763   9.330 -10.379
  906   2HB   SER 117          1HB       SER 117 -22.643   7.974 -10.474
  907    HG   SER 117           HG       SER 117 -24.567   7.846 -11.839
  908    H    THR 118           H        THR 118 -24.292   5.563  -8.105
  909    HA   THR 118           HA       THR 118 -21.857   4.988  -6.645
  910    HB   THR 118           HB       THR 118 -22.799   2.600  -6.992
  911    HG1  THR 118           1HG      THR 118 -24.883   2.567  -7.837
  912   1HG2  THR 118          1HG2      THR 118 -24.198   2.925  -5.189
  913   2HG2  THR 118          2HG2      THR 118 -24.927   4.373  -5.882
  914   3HG2  THR 118          3HG2      THR 118 -23.325   4.456  -5.149
  Start of MODEL    5
    1    H    THR   1           1H       THR   1  21.996  -5.136  -9.517
    2    HA   THR   1           HA       THR   1  19.893  -5.935  -8.714
    3    HB   THR   1           HB       THR   1  19.169  -3.640  -7.719
    4    HG1  THR   1           1HG      THR   1  19.995  -2.441  -9.497
    5   1HG2  THR   1          1HG2      THR   1  20.879  -3.814  -6.170
    6   2HG2  THR   1          2HG2      THR   1  22.111  -4.081  -7.403
    7   3HG2  THR   1          3HG2      THR   1  21.014  -5.387  -6.956
    8    H    GLU   2           H        GLU   2  17.538  -5.689  -8.718
    9    HA   GLU   2           HA       GLU   2  16.468  -5.067 -11.394
   10   1HB   GLU   2          2HB       GLU   2  15.815  -6.669  -9.051
   11   2HB   GLU   2          1HB       GLU   2  14.406  -5.771  -9.617
   12   1HG   GLU   2          2HG       GLU   2  14.220  -7.592 -11.007
   13   2HG   GLU   2          1HG       GLU   2  15.321  -6.628 -11.992
   14    H    ALA   3           H        ALA   3  14.916  -3.432 -11.801
   15    HA   ALA   3           HA       ALA   3  14.377  -1.509  -9.564
   16   1HB   ALA   3          1HB       ALA   3  16.236  -1.045 -11.419
   17   2HB   ALA   3          2HB       ALA   3  15.188   0.252 -10.844
   18   3HB   ALA   3          3HB       ALA   3  14.831  -0.561 -12.369
   19    H    GLU   4           H        GLU   4  12.680   0.202 -10.611
   20    HA   GLU   4           HA       GLU   4  10.765  -0.888 -12.509
   21   1HB   GLU   4          2HB       GLU   4   8.978  -1.226 -10.745
   22   2HB   GLU   4          1HB       GLU   4  10.303  -2.387 -10.662
   23   1HG   GLU   4          2HG       GLU   4  10.978  -1.641  -8.629
   24   2HG   GLU   4          1HG       GLU   4  10.804   0.049  -9.100
   25    H    ASP   5           H        ASP   5  11.833   1.555 -12.675
   26    HA   ASP   5           HA       ASP   5   9.994   3.480 -11.327
   27   1HB   ASP   5          2HB       ASP   5  12.767   3.377 -11.986
   28   2HB   ASP   5          1HB       ASP   5  12.050   4.711 -12.885
   29    H    SER   6           H        SER   6   8.408   4.470 -12.527
   30    HA   SER   6           HA       SER   6   8.730   4.908 -15.420
   31   1HB   SER   6          2HB       SER   6   7.253   2.653 -14.226
   32   2HB   SER   6          1HB       SER   6   6.327   3.565 -15.414
   33    HG   SER   6           HG       SER   6   8.877   2.357 -15.732
   34    H    ILE   7           H        ILE   7   6.571   5.896 -16.282
   35    HA   ILE   7           HA       ILE   7   5.410   7.650 -14.140
   36    HB   ILE   7           HB       ILE   7   5.875   8.096 -17.109
   37   1HG1  ILE   7          2HG1      ILE   7   7.324   9.989 -15.814
   38   2HG1  ILE   7          1HG1      ILE   7   7.410   8.684 -14.632
   39   1HG2  ILE   7          1HG2      ILE   7   5.403  10.552 -16.099
   40   2HG2  ILE   7          2HG2      ILE   7   4.384   9.601 -15.018
   41   3HG2  ILE   7          3HG2      ILE   7   4.123   9.537 -16.761
   42   1HD1  ILE   7          1HD1      ILE   7   8.593   8.859 -17.342
   43   2HD1  ILE   7          2HD1      ILE   7   7.887   7.297 -16.923
   44   3HD1  ILE   7          3HD1      ILE   7   9.163   7.986 -15.918
   45    H    GLU   8           H        GLU   8   4.518   6.608 -17.450
   46    HA   GLU   8           HA       GLU   8   1.707   6.808 -17.086
   47   1HB   GLU   8          2HB       GLU   8   3.403   5.084 -18.920
   48   2HB   GLU   8          1HB       GLU   8   1.680   5.388 -19.146
   49   1HG   GLU   8          2HG       GLU   8   2.009   7.556 -19.823
   50   2HG   GLU   8          1HG       GLU   8   3.417   7.776 -18.783
   51    H    MET   9           H        MET   9   0.192   5.335 -16.301
   52    HA   MET   9           HA       MET   9   0.684   2.524 -15.960
   53   1HB   MET   9          2HB       MET   9   0.665   2.768 -13.369
   54   2HB   MET   9          1HB       MET   9   2.170   3.101 -14.221
   55   1HG   MET   9          2HG       MET   9   1.955   4.932 -12.750
   56   2HG   MET   9          1HG       MET   9   1.353   5.565 -14.276
   57   1HE   MET   9          1HE       MET   9  -2.001   6.149 -14.252
   58   2HE   MET   9          2HE       MET   9  -0.342   6.422 -14.778
   59   3HE   MET   9          3HE       MET   9  -1.020   7.404 -13.483
   60    H    TYR  10           H        TYR  10  -1.072   1.670 -14.245
   61    HA   TYR  10           HA       TYR  10  -3.643   2.547 -15.200
   62   1HB   TYR  10          2HB       TYR  10  -2.584   0.637 -13.129
   63   2HB   TYR  10          1HB       TYR  10  -4.318   0.941 -13.241
   64    HD1  TYR  10           1HD      TYR  10  -5.587  -0.342 -14.717
   65    HD2  TYR  10           2HD      TYR  10  -1.384   0.159 -15.449
   66    HE1  TYR  10           1HE      TYR  10  -5.737  -1.891 -16.648
   67    HE2  TYR  10           2HE      TYR  10  -1.534  -1.388 -17.380
   68    HH   TYR  10           HH       TYR  10  -4.136  -2.126 -18.942
   69    H    GLU  11           H        GLU  11  -3.182   2.154 -11.723
   70    HA   GLU  11           HA       GLU  11  -3.608   5.057 -11.244
   71   1HB   GLU  11          2HB       GLU  11  -5.784   3.502 -11.548
   72   2HB   GLU  11          1HB       GLU  11  -5.434   3.143  -9.859
   73   1HG   GLU  11          2HG       GLU  11  -6.867   4.999  -9.746
   74   2HG   GLU  11          1HG       GLU  11  -5.257   5.693  -9.549
   75    H    TRP  12           H        TRP  12  -3.453   1.830  -9.745
   76    HA   TRP  12           HA       TRP  12  -2.952   2.355  -7.111
   77   1HB   TRP  12          2HB       TRP  12  -1.539   0.288  -7.173
   78   2HB   TRP  12          1HB       TRP  12  -3.070   0.125  -8.031
   79    HD1  TRP  12           HD       TRP  12  -3.007  -0.163 -10.633
   80    HE1  TRP  12           1HE      TRP  12  -1.103  -0.600 -12.315
   81    HE3  TRP  12           3HE      TRP  12   1.034   0.804  -7.665
   82    HZ2  TRP  12           2HZ      TRP  12   1.755  -0.547 -12.392
   83    HZ3  TRP  12           3HZ      TRP  12   3.333   0.603  -8.566
   84    HH2  TRP  12           HH       TRP  12   3.698  -0.071 -10.925
   85    H    TYR  13           H        TYR  13  -0.741   3.054  -9.746
   86    HA   TYR  13           HA       TYR  13   1.543   3.467  -7.932
   87   1HB   TYR  13          2HB       TYR  13   1.649   2.691 -10.344
   88   2HB   TYR  13          1HB       TYR  13   1.193   4.330 -10.815
   89    HD1  TYR  13           1HD      TYR  13   2.910   5.843 -11.259
   90    HD2  TYR  13           2HD      TYR  13   3.614   2.610  -8.519
   91    HE1  TYR  13           1HE      TYR  13   5.260   6.583 -10.986
   92    HE2  TYR  13           2HE      TYR  13   5.964   3.347  -8.250
   93    HH   TYR  13           HH       TYR  13   7.469   5.477 -10.330
   94    H    SER  14           H        SER  14   1.828   5.313  -6.768
   95    HA   SER  14           HA       SER  14   0.744   7.885  -7.854
   96   1HB   SER  14          2HB       SER  14   0.531   6.975  -4.974
   97   2HB   SER  14          1HB       SER  14  -0.265   8.356  -5.725
   98    HG   SER  14           HG       SER  14  -1.730   6.678  -5.631
   99    H    LYS  15           H        LYS  15   2.198   9.544  -7.641
  100    HA   LYS  15           HA       LYS  15   4.825   9.008  -6.461
  101   1HB   LYS  15          2HB       LYS  15   3.570  10.786  -8.371
  102   2HB   LYS  15          1HB       LYS  15   4.569  11.708  -7.248
  103   1HG   LYS  15          2HG       LYS  15   5.816  10.882  -9.273
  104   2HG   LYS  15          1HG       LYS  15   6.504  10.339  -7.744
  105   1HD   LYS  15          2HD       LYS  15   4.451   8.509  -8.739
  106   2HD   LYS  15          1HD       LYS  15   5.781   8.703  -9.880
  107   1HE   LYS  15          2HE       LYS  15   7.155   7.458  -8.575
  108   2HE   LYS  15          1HE       LYS  15   6.783   8.453  -7.156
  109   1HZ   LYS  15          1HZ       LYS  15   5.052   7.130  -6.551
  110   2HZ   LYS  15          2HZ       LYS  15   5.994   5.951  -7.325
  111   3HZ   LYS  15          3HZ       LYS  15   4.686   6.664  -8.140
  112    H    HIS  16           H        HIS  16   5.144   9.273  -4.326
  113    HA   HIS  16           HA       HIS  16   5.077  10.178  -2.160
  114   1HB   HIS  16          2HB       HIS  16   4.484  12.550  -3.942
  115   2HB   HIS  16          1HB       HIS  16   4.720  12.711  -2.203
  116    HD1  HIS  16           1HD      HIS  16   6.556  11.137  -5.161
  117    HD2  HIS  16           2HD      HIS  16   7.377  13.021  -1.534
  118    HE1  HIS  16           1HE      HIS  16   9.077  11.338  -5.012
  119    H    MET  17           H        MET  17   2.669   8.835  -2.967
  120    HA   MET  17           HA       MET  17   0.379  10.518  -2.224
  121   1HB   MET  17          2HB       MET  17   0.223   8.673  -3.848
  122   2HB   MET  17          1HB       MET  17   0.732   7.525  -2.611
  123   1HG   MET  17          2HG       MET  17  -1.482   7.250  -2.204
  124   2HG   MET  17          1HG       MET  17  -1.382   8.808  -1.383
  125   1HE   MET  17          1HE       MET  17  -0.933  10.892  -3.995
  126   2HE   MET  17          2HE       MET  17  -1.576  10.936  -2.355
  127   3HE   MET  17          3HE       MET  17  -2.603  11.399  -3.710
  128    H    THR  18           H        THR  18  -0.152  10.939  -0.124
  129    HA   THR  18           HA       THR  18   1.283   9.868   2.115
  130    HB   THR  18           HB       THR  18  -1.448  11.145   2.201
  131    HG1  THR  18           1HG      THR  18   1.055  12.396   1.742
  132   1HG2  THR  18          1HG2      THR  18  -0.764  10.797   4.383
  133   2HG2  THR  18          2HG2      THR  18  -0.045  12.380   4.081
  134   3HG2  THR  18          3HG2      THR  18   0.947  10.925   3.977
  135    H    ARG  19           H        ARG  19   0.724   8.298   3.613
  136    HA   ARG  19           HA       ARG  19  -0.834   6.038   2.854
  137   1HB   ARG  19          2HB       ARG  19  -0.390   5.336   5.135
  138   2HB   ARG  19          1HB       ARG  19   1.017   6.245   4.585
  139   1HG   ARG  19          2HG       ARG  19   0.041   8.298   5.683
  140   2HG   ARG  19          1HG       ARG  19  -1.235   7.279   6.350
  141   1HD   ARG  19          2HD       ARG  19   0.159   6.860   8.094
  142   2HD   ARG  19          1HD       ARG  19   1.168   5.931   6.968
  143    HE   ARG  19           HE       ARG  19   1.728   8.708   6.605
  144   1HH1  ARG  19          1HH1      ARG  19   1.528   7.310   9.600
  145   2HH1  ARG  19          2HH1      ARG  19   3.210   7.443   9.993
  146   1HH2  ARG  19          1HH2      ARG  19   4.157   8.387   6.795
  147   2HH2  ARG  19          2HH2      ARG  19   4.699   8.053   8.405
  148    H    SER  20           H        SER  20  -1.576   8.844   4.852
  149    HA   SER  20           HA       SER  20  -4.181   8.000   5.717
  150   1HB   SER  20          2HB       SER  20  -3.586   9.735   7.036
  151   2HB   SER  20          1HB       SER  20  -2.321  10.210   5.912
  152    HG   SER  20           HG       SER  20  -3.702  11.889   5.866
  153    H    GLN  21           H        GLN  21  -2.969   9.810   2.923
  154    HA   GLN  21           HA       GLN  21  -5.499  10.683   1.897
  155   1HB   GLN  21          2HB       GLN  21  -2.764  10.101   0.758
  156   2HB   GLN  21          1HB       GLN  21  -4.085  10.622  -0.288
  157   1HG   GLN  21          2HG       GLN  21  -3.471  12.156   2.223
  158   2HG   GLN  21          1HG       GLN  21  -2.513  12.430   0.768
  159   1HE2  GLN  21          1HE2      GLN  21  -5.258  13.511   2.361
  160   2HE2  GLN  21          2HE2      GLN  21  -6.089  14.176   1.038
  161    H    ALA  22           H        ALA  22  -3.582   7.717   1.460
  162    HA   ALA  22           HA       ALA  22  -5.263   6.457  -0.476
  163   1HB   ALA  22          1HB       ALA  22  -3.103   5.546  -0.090
  164   2HB   ALA  22          2HB       ALA  22  -4.190   4.364   0.638
  165   3HB   ALA  22          3HB       ALA  22  -3.338   5.524   1.657
  166    H    GLU  23           H        GLU  23  -5.196   6.204   3.084
  167    HA   GLU  23           HA       GLU  23  -7.376   4.457   3.451
  168   1HB   GLU  23          2HB       GLU  23  -6.468   6.862   5.068
  169   2HB   GLU  23          1HB       GLU  23  -7.538   5.600   5.675
  170   1HG   GLU  23          2HG       GLU  23  -5.786   3.916   5.306
  171   2HG   GLU  23          1HG       GLU  23  -4.717   5.163   4.664
  172    H    GLN  24           H        GLN  24  -7.479   8.051   3.401
  173    HA   GLN  24           HA       GLN  24 -10.333   8.155   3.582
  174   1HB   GLN  24          2HB       GLN  24  -9.999  10.531   3.007
  175   2HB   GLN  24          1HB       GLN  24  -8.821   9.996   4.202
  176   1HG   GLN  24          2HG       GLN  24  -7.163   9.666   2.381
  177   2HG   GLN  24          1HG       GLN  24  -8.341  10.288   1.224
  178   1HE2  GLN  24          1HE2      GLN  24  -8.563  12.557   1.052
  179   2HE2  GLN  24          2HE2      GLN  24  -7.737  13.662   2.042
  180    H    LEU  25           H        LEU  25  -8.155   8.427   0.707
  181    HA   LEU  25           HA       LEU  25 -10.415   8.712  -1.070
  182   1HB   LEU  25          2HB       LEU  25  -8.751   8.466  -2.832
  183   2HB   LEU  25          1HB       LEU  25  -8.083   9.473  -1.550
  184    HG   LEU  25           HG       LEU  25  -7.195   7.146  -0.642
  185   1HD1  LEU  25          1HD1      LEU  25  -6.585   6.259  -3.277
  186   2HD1  LEU  25          2HD1      LEU  25  -8.333   6.469  -3.187
  187   3HD1  LEU  25          3HD1      LEU  25  -7.512   5.414  -2.040
  188   1HD2  LEU  25          1HD2      LEU  25  -5.610   7.952  -2.991
  189   2HD2  LEU  25          2HD2      LEU  25  -5.171   7.984  -1.287
  190   3HD2  LEU  25          3HD2      LEU  25  -6.103   9.307  -1.977
  191    H    LEU  26           H        LEU  26  -8.879   5.986   0.462
  192    HA   LEU  26           HA       LEU  26  -9.933   3.991  -1.416
  193   1HB   LEU  26          2HB       LEU  26  -8.496   4.082   1.209
  194   2HB   LEU  26          1HB       LEU  26  -9.398   2.622   0.842
  195    HG   LEU  26           HG       LEU  26  -7.330   3.854  -0.998
  196   1HD1  LEU  26          1HD1      LEU  26  -5.907   2.975   0.564
  197   2HD1  LEU  26          2HD1      LEU  26  -6.294   1.459  -0.251
  198   3HD1  LEU  26          3HD1      LEU  26  -7.139   1.905   1.229
  199   1HD2  LEU  26          1HD2      LEU  26  -7.915   1.048  -1.402
  200   2HD2  LEU  26          2HD2      LEU  26  -8.066   2.383  -2.544
  201   3HD2  LEU  26          3HD2      LEU  26  -9.408   1.986  -1.470
  202    H    LYS  27           H        LYS  27 -10.662   4.844   1.996
  203    HA   LYS  27           HA       LYS  27 -13.091   3.455   2.317
  204   1HB   LYS  27          2HB       LYS  27 -11.720   4.752   3.995
  205   2HB   LYS  27          1HB       LYS  27 -12.392   6.232   3.313
  206   1HG   LYS  27          2HG       LYS  27 -13.681   5.563   5.290
  207   2HG   LYS  27          1HG       LYS  27 -14.677   5.419   3.841
  208   1HD   LYS  27          2HD       LYS  27 -14.810   3.155   4.003
  209   2HD   LYS  27          1HD       LYS  27 -13.129   2.996   4.513
  210   1HE   LYS  27          2HE       LYS  27 -14.137   2.439   6.521
  211   2HE   LYS  27          1HE       LYS  27 -14.161   4.203   6.718
  212   1HZ   LYS  27          1HZ       LYS  27 -16.331   4.311   5.785
  213   2HZ   LYS  27          2HZ       LYS  27 -16.375   3.116   6.992
  214   3HZ   LYS  27          3HZ       LYS  27 -16.306   2.671   5.353
  215    H    GLN  28           H        GLN  28 -12.595   6.779   1.132
  216    HA   GLN  28           HA       GLN  28 -15.336   7.421   0.673
  217   1HB   GLN  28          2HB       GLN  28 -13.139   8.827   0.736
  218   2HB   GLN  28          1HB       GLN  28 -13.057   8.467  -0.988
  219   1HG   GLN  28          2HG       GLN  28 -14.248  10.520  -0.851
  220   2HG   GLN  28          1HG       GLN  28 -15.490   9.293  -1.104
  221   1HE2  GLN  28          1HE2      GLN  28 -14.067  11.461   1.322
  222   2HE2  GLN  28          2HE2      GLN  28 -15.316  11.287   2.459
  223    H    GLU  29           H        GLU  29 -12.886   6.112  -1.632
  224    HA   GLU  29           HA       GLU  29 -14.694   6.055  -3.878
  225   1HB   GLU  29          2HB       GLU  29 -12.083   5.886  -3.701
  226   2HB   GLU  29          1HB       GLU  29 -12.377   4.162  -3.483
  227   1HG   GLU  29          2HG       GLU  29 -11.988   4.720  -5.864
  228   2HG   GLU  29          1HG       GLU  29 -13.611   4.087  -5.612
  229    H    GLY  30           H        GLY  30 -13.878   3.740  -1.332
  230   1HA   GLY  30          2HA       GLY  30 -15.162   1.954  -0.519
  231   2HA   GLY  30          1HA       GLY  30 -16.412   2.408  -1.674
  232    H    LYS  31           H        LYS  31 -13.143   1.776  -2.757
  233    HA   LYS  31           HA       LYS  31 -14.130  -0.459  -4.425
  234   1HB   LYS  31          2HB       LYS  31 -11.319   0.638  -4.109
  235   2HB   LYS  31          1HB       LYS  31 -11.974  -0.238  -5.490
  236   1HG   LYS  31          2HG       LYS  31 -12.729   2.554  -4.575
  237   2HG   LYS  31          1HG       LYS  31 -11.905   2.114  -6.068
  238   1HD   LYS  31          2HD       LYS  31 -14.276   0.594  -6.054
  239   2HD   LYS  31          1HD       LYS  31 -14.747   2.205  -5.513
  240   1HE   LYS  31          2HE       LYS  31 -14.121   3.210  -7.518
  241   2HE   LYS  31          1HE       LYS  31 -12.919   1.956  -7.887
  242   1HZ   LYS  31          1HZ       LYS  31 -14.911   1.666  -9.238
  243   2HZ   LYS  31          2HZ       LYS  31 -15.867   1.570  -7.836
  244   3HZ   LYS  31          3HZ       LYS  31 -14.717   0.364  -8.168
  245    H    GLU  32           H        GLU  32 -14.454  -2.225  -2.884
  246    HA   GLU  32           HA       GLU  32 -12.645  -2.857  -0.800
  247   1HB   GLU  32          2HB       GLU  32 -13.567  -5.231  -1.130
  248   2HB   GLU  32          1HB       GLU  32 -14.733  -3.959  -0.777
  249   1HG   GLU  32          2HG       GLU  32 -15.725  -4.140  -2.820
  250   2HG   GLU  32          1HG       GLU  32 -14.178  -4.283  -3.654
  251    H    GLY  33           H        GLY  33 -10.643  -3.710  -0.808
  252   1HA   GLY  33          2HA       GLY  33  -8.784  -4.935  -1.555
  253   2HA   GLY  33          1HA       GLY  33  -9.720  -5.407  -2.975
  254    H    GLY  34           H        GLY  34  -9.812  -2.015  -2.383
  255   1HA   GLY  34          2HA       GLY  34  -8.632  -1.324  -4.855
  256   2HA   GLY  34          1HA       GLY  34  -8.774  -0.217  -3.483
  257    H    PHE  35           H        PHE  35  -6.502  -0.797  -5.432
  258    HA   PHE  35           HA       PHE  35  -4.435  -1.415  -3.341
  259   1HB   PHE  35          2HB       PHE  35  -4.978  -3.176  -5.070
  260   2HB   PHE  35          1HB       PHE  35  -4.368  -2.064  -6.293
  261    HD1  PHE  35           1HD      PHE  35  -1.990  -1.484  -6.403
  262    HD2  PHE  35           2HD      PHE  35  -3.484  -4.231  -3.460
  263    HE1  PHE  35           1HE      PHE  35   0.324  -2.245  -5.940
  264    HE2  PHE  35           2HE      PHE  35  -1.169  -4.990  -2.993
  265    HZ   PHE  35           HZ       PHE  35   0.735  -3.998  -4.234
  266    H    ILE  36           H        ILE  36  -3.012   0.239  -3.040
  267    HA   ILE  36           HA       ILE  36  -2.379   2.028  -5.359
  268    HB   ILE  36           HB       ILE  36  -2.845   2.797  -2.451
  269   1HG1  ILE  36          2HG1      ILE  36  -4.485   3.333  -4.950
  270   2HG1  ILE  36          1HG1      ILE  36  -4.944   2.270  -3.619
  271   1HG2  ILE  36          1HG2      ILE  36  -1.122   4.159  -3.624
  272   2HG2  ILE  36          2HG2      ILE  36  -2.563   5.100  -3.237
  273   3HG2  ILE  36          3HG2      ILE  36  -2.299   4.527  -4.884
  274   1HD1  ILE  36          1HD1      ILE  36  -4.795   4.266  -2.076
  275   2HD1  ILE  36          2HD1      ILE  36  -6.066   4.395  -3.289
  276   3HD1  ILE  36          3HD1      ILE  36  -4.555   5.280  -3.499
  277    H    VAL  37           H        VAL  37  -0.203   2.959  -5.203
  278    HA   VAL  37           HA       VAL  37   1.584   1.893  -3.094
  279    HB   VAL  37           HB       VAL  37   2.019   1.417  -6.060
  280   1HG1  VAL  37          1HG1      VAL  37   3.962   1.711  -4.263
  281   2HG1  VAL  37          2HG1      VAL  37   4.055   0.459  -5.502
  282   3HG1  VAL  37          3HG1      VAL  37   3.533   0.047  -3.868
  283   1HG2  VAL  37          1HG2      VAL  37   1.098  -0.407  -3.821
  284   2HG2  VAL  37          2HG2      VAL  37   1.752  -1.016  -5.341
  285   3HG2  VAL  37          3HG2      VAL  37   0.268  -0.063  -5.339
  286    H    ARG  38           H        ARG  38   3.453   3.208  -2.836
  287    HA   ARG  38           HA       ARG  38   4.001   5.324  -4.837
  288   1HB   ARG  38          2HB       ARG  38   3.650   7.106  -3.144
  289   2HB   ARG  38          1HB       ARG  38   2.166   6.205  -3.445
  290   1HG   ARG  38          2HG       ARG  38   2.131   6.123  -1.149
  291   2HG   ARG  38          1HG       ARG  38   3.159   4.717  -1.431
  292   1HD   ARG  38          2HD       ARG  38   5.013   5.759  -0.592
  293   2HD   ARG  38          1HD       ARG  38   4.599   7.308  -1.354
  294    HE   ARG  38           HE       ARG  38   2.689   7.271   0.491
  295   1HH1  ARG  38          1HH2      ARG  38   5.797   8.031   0.860
  296   2HH1  ARG  38          2HH2      ARG  38   5.983   7.511   2.501
  297   1HH2  ARG  38          1HH1      ARG  38   2.975   5.786   2.573
  298   2HH2  ARG  38          2HH1      ARG  38   4.384   6.241   3.472
  299    H    ASP  39           H        ASP  39   5.968   6.589  -4.204
  300    HA   ASP  39           HA       ASP  39   8.021   4.824  -3.090
  301   1HB   ASP  39          2HB       ASP  39   8.245   6.391  -5.058
  302   2HB   ASP  39          1HB       ASP  39   8.158   7.738  -3.921
  303    H    SER  40           H        SER  40   9.393   5.424  -1.258
  304    HA   SER  40           HA       SER  40   7.887   6.908   0.850
  305   1HB   SER  40          2HB       SER  40   8.601   4.561   1.218
  306   2HB   SER  40          1HB       SER  40  10.276   5.039   0.957
  307    HG   SER  40           HG       SER  40  10.009   5.143   3.117
  308    H    SER  41           H        SER  41  10.323   7.309   2.448
  309    HA   SER  41           HA       SER  41  11.886   9.258   0.817
  310   1HB   SER  41          2HB       SER  41  10.069  10.547   1.731
  311   2HB   SER  41          1HB       SER  41  10.252   9.794   3.313
  312    HG   SER  41           HG       SER  41  11.987  11.602   1.991
  313    H    LYS  42           H        LYS  42  11.475   8.125   4.205
  314    HA   LYS  42           HA       LYS  42  14.121   8.520   5.095
  315   1HB   LYS  42          2HB       LYS  42  11.986   6.472   5.736
  316   2HB   LYS  42          1HB       LYS  42  13.482   6.592   6.664
  317   1HG   LYS  42          2HG       LYS  42  12.986   8.842   7.334
  318   2HG   LYS  42          1HG       LYS  42  11.646   8.952   6.194
  319   1HD   LYS  42          2HD       LYS  42  10.687   8.559   8.367
  320   2HD   LYS  42          1HD       LYS  42  10.541   7.055   7.457
  321   1HE   LYS  42          2HE       LYS  42  11.384   6.386   9.589
  322   2HE   LYS  42          1HE       LYS  42  12.820   6.419   8.544
  323   1HZ   LYS  42          1HZ       LYS  42  13.055   7.675  10.685
  324   2HZ   LYS  42          2HZ       LYS  42  11.885   8.764  10.106
  325   3HZ   LYS  42          3HZ       LYS  42  13.365   8.586   9.289
  326    H    ALA  43           H        ALA  43  12.812   5.319   4.169
  327    HA   ALA  43           HA       ALA  43  15.545   4.360   3.549
  328   1HB   ALA  43          1HB       ALA  43  14.603   2.407   4.203
  329   2HB   ALA  43          2HB       ALA  43  13.363   2.545   2.957
  330   3HB   ALA  43          3HB       ALA  43  13.117   3.297   4.533
  331    H    GLY  44           H        GLY  44  12.837   5.687   1.898
  332   1HA   GLY  44          2HA       GLY  44  12.517   6.083  -0.405
  333   2HA   GLY  44          1HA       GLY  44  14.125   5.395  -0.692
  334    H    LYS  45           H        LYS  45  11.678   3.728   1.161
  335    HA   LYS  45           HA       LYS  45  11.791   1.459  -0.704
  336   1HB   LYS  45          2HB       LYS  45  10.589   0.335   1.131
  337   2HB   LYS  45          1HB       LYS  45  11.992   1.205   1.749
  338   1HG   LYS  45          2HG       LYS  45   9.686   2.954   1.690
  339   2HG   LYS  45          1HG       LYS  45   9.311   1.484   2.589
  340   1HD   LYS  45          2HD       LYS  45  11.610   1.875   3.741
  341   2HD   LYS  45          1HD       LYS  45  11.462   3.521   3.126
  342   1HE   LYS  45          2HE       LYS  45  10.310   3.876   5.080
  343   2HE   LYS  45          1HE       LYS  45   8.964   3.120   4.204
  344   1HZ   LYS  45          1HZ       LYS  45   9.796   0.946   4.949
  345   2HZ   LYS  45          2HZ       LYS  45   9.337   1.935   6.253
  346   3HZ   LYS  45          3HZ       LYS  45  10.982   1.723   5.880
  347    H    TYR  46           H        TYR  46   9.368   0.327  -0.687
  348    HA   TYR  46           HA       TYR  46   7.584   2.386  -1.938
  349   1HB   TYR  46          2HB       TYR  46   7.954  -0.599  -2.256
  350   2HB   TYR  46          1HB       TYR  46   6.650   0.287  -3.041
  351    HD1  TYR  46           1HD      TYR  46   7.028   0.993  -5.218
  352    HD2  TYR  46           2HD      TYR  46  10.380   0.608  -2.557
  353    HE1  TYR  46           1HE      TYR  46   8.561   1.656  -7.048
  354    HE2  TYR  46           2HE      TYR  46  11.909   1.273  -4.386
  355    HH   TYR  46           HH       TYR  46  11.107   1.230  -7.557
  356    H    THR  47           H        THR  47   5.260   2.189  -1.504
  357    HA   THR  47           HA       THR  47   4.559   0.587   0.932
  358    HB   THR  47           HB       THR  47   3.835   3.476   0.326
  359    HG1  THR  47           1HG      THR  47   5.282   3.973   1.848
  360   1HG2  THR  47          1HG2      THR  47   2.077   3.095   1.699
  361   2HG2  THR  47          2HG2      THR  47   3.246   2.857   2.998
  362   3HG2  THR  47          3HG2      THR  47   2.652   1.472   2.083
  363    H    VAL  48           H        VAL  48   2.843  -0.706   0.468
  364    HA   VAL  48           HA       VAL  48   1.142  -0.018  -1.898
  365    HB   VAL  48           HB       VAL  48   1.817  -2.522  -0.352
  366   1HG1  VAL  48          1HG1      VAL  48  -0.322  -2.146  -2.466
  367   2HG1  VAL  48          2HG1      VAL  48  -0.559  -2.694  -0.806
  368   3HG1  VAL  48          3HG1      VAL  48   0.300  -3.717  -1.958
  369   1HG2  VAL  48          1HG2      VAL  48   1.936  -2.227  -3.323
  370   2HG2  VAL  48          2HG2      VAL  48   2.993  -3.136  -2.246
  371   3HG2  VAL  48          3HG2      VAL  48   3.149  -1.383  -2.361
  372    H    SER  49           H        SER  49  -0.693   1.088  -1.327
  373    HA   SER  49           HA       SER  49  -1.973   0.593   1.317
  374   1HB   SER  49          2HB       SER  49  -1.859   2.730  -0.749
  375   2HB   SER  49          1HB       SER  49  -3.360   2.604   0.163
  376    HG   SER  49           HG       SER  49  -1.555   3.949   1.044
  377    H    VAL  50           H        VAL  50  -3.608  -0.941   1.335
  378    HA   VAL  50           HA       VAL  50  -5.383  -1.048  -1.079
  379    HB   VAL  50           HB       VAL  50  -5.407  -3.472  -0.873
  380   1HG1  VAL  50          1HG1      VAL  50  -3.184  -3.944  -1.533
  381   2HG1  VAL  50          2HG1      VAL  50  -2.519  -2.687  -0.490
  382   3HG1  VAL  50          3HG1      VAL  50  -3.406  -2.245  -1.947
  383   1HG2  VAL  50          1HG2      VAL  50  -4.159  -4.635   0.876
  384   2HG2  VAL  50          2HG2      VAL  50  -5.305  -3.527   1.624
  385   3HG2  VAL  50          3HG2      VAL  50  -3.597  -3.100   1.535
  386    H    PHE  51           H        PHE  51  -7.625  -1.067  -0.613
  387    HA   PHE  51           HA       PHE  51  -8.331  -1.388   2.297
  388   1HB   PHE  51          2HB       PHE  51  -8.699   0.847   2.184
  389   2HB   PHE  51          1HB       PHE  51  -8.612   0.842   0.431
  390    HD1  PHE  51           1HD      PHE  51 -10.709  -0.125  -0.837
  391    HD2  PHE  51           2HD      PHE  51 -10.751   1.222   3.239
  392    HE1  PHE  51           1HE      PHE  51 -13.170   0.155  -0.949
  393    HE2  PHE  51           2HE      PHE  51 -13.207   1.501   3.122
  394    HZ   PHE  51           HZ       PHE  51 -14.419   0.965   1.029
  395    H    ALA  52           H        ALA  52 -10.426  -2.297   2.727
  396    HA   ALA  52           HA       ALA  52 -12.079  -3.118   0.413
  397   1HB   ALA  52          1HB       ALA  52 -10.358  -4.879   0.789
  398   2HB   ALA  52          2HB       ALA  52 -12.008  -5.461   1.013
  399   3HB   ALA  52          3HB       ALA  52 -11.001  -5.099   2.415
  400    H    LYS  53           H        LYS  53 -14.185  -4.018   1.086
  401    HA   LYS  53           HA       LYS  53 -15.061  -2.895   3.726
  402   1HB   LYS  53          2HB       LYS  53 -16.417  -3.467   1.078
  403   2HB   LYS  53          1HB       LYS  53 -17.293  -2.945   2.517
  404   1HG   LYS  53          2HG       LYS  53 -15.253  -1.113   2.428
  405   2HG   LYS  53          1HG       LYS  53 -15.551  -1.394   0.713
  406   1HD   LYS  53          2HD       LYS  53 -17.846  -0.768   0.909
  407   2HD   LYS  53          1HD       LYS  53 -17.782  -0.819   2.671
  408   1HE   LYS  53          2HE       LYS  53 -15.961   1.024   2.457
  409   2HE   LYS  53          1HE       LYS  53 -16.589   1.239   0.811
  410   1HZ   LYS  53          1HZ       LYS  53 -18.868   1.232   1.917
  411   2HZ   LYS  53          2HZ       LYS  53 -17.919   2.627   2.117
  412   3HZ   LYS  53          3HZ       LYS  53 -18.043   1.494   3.376
  413    H    SER  54           H        SER  54 -13.862  -5.416   3.929
  414    HA   SER  54           HA       SER  54 -16.140  -7.076   4.790
  415   1HB   SER  54          2HB       SER  54 -15.363  -8.979   3.332
  416   2HB   SER  54          1HB       SER  54 -15.999  -7.609   2.425
  417    HG   SER  54           HG       SER  54 -13.335  -8.447   2.799
  418    H    THR  55           H        THR  55 -14.546  -6.212   6.647
  419    HA   THR  55           HA       THR  55 -13.032  -8.527   7.583
  420    HB   THR  55           HB       THR  55 -11.302  -6.147   7.442
  421    HG1  THR  55           1HG      THR  55 -10.897  -6.307   5.287
  422   1HG2  THR  55          1HG2      THR  55 -10.676  -8.908   6.452
  423   2HG2  THR  55          2HG2      THR  55 -10.807  -8.593   8.182
  424   3HG2  THR  55          3HG2      THR  55  -9.603  -7.737   7.218
  425    H    GLY  56           H        GLY  56 -11.362  -6.633   9.309
  426   1HA   GLY  56          2HA       GLY  56 -13.005  -6.423  11.575
  427   2HA   GLY  56          1HA       GLY  56 -11.617  -5.368  11.287
  428    H    ASP  57           H        ASP  57 -12.722  -4.339   8.785
  429    HA   ASP  57           HA       ASP  57 -14.889  -2.567   9.852
  430   1HB   ASP  57          2HB       ASP  57 -12.338  -1.930   9.107
  431   2HB   ASP  57          1HB       ASP  57 -13.186  -1.747   7.573
  432    HA   PRO  58           HA       PRO  58 -16.553  -5.339   6.474
  433   1HB   PRO  58          2HB       PRO  58 -19.126  -4.529   7.484
  434   2HB   PRO  58          1HB       PRO  58 -18.367  -6.121   7.558
  435   1HG   PRO  58          2HG       PRO  58 -18.710  -4.192   9.683
  436   2HG   PRO  58          1HG       PRO  58 -18.073  -5.836   9.784
  437   1HD   PRO  58          2HD       PRO  58 -16.598  -3.437  10.085
  438   2HD   PRO  58          1HD       PRO  58 -15.923  -5.076   9.904
  439    H    GLN  59           H        GLN  59 -17.112  -2.014   7.357
  440    HA   GLN  59           HA       GLN  59 -18.337  -1.511   4.674
  441   1HB   GLN  59          2HB       GLN  59 -19.024   0.660   5.837
  442   2HB   GLN  59          1HB       GLN  59 -19.742  -0.815   6.484
  443   1HG   GLN  59          2HG       GLN  59 -18.468  -0.762   8.411
  444   2HG   GLN  59          1HG       GLN  59 -17.144   0.109   7.636
  445   1HE2  GLN  59          1HE2      GLN  59 -18.590   0.843  10.162
  446   2HE2  GLN  59          2HE2      GLN  59 -19.230   2.391   9.889
  447    H    GLY  60           H        GLY  60 -15.293  -1.523   5.789
  448   1HA   GLY  60          2HA       GLY  60 -14.149   0.009   3.824
  449   2HA   GLY  60          1HA       GLY  60 -14.486   1.172   5.094
  450    H    VAL  61           H        VAL  61 -12.406  -1.379   4.069
  451    HA   VAL  61           HA       VAL  61 -10.852  -1.190   6.634
  452    HB   VAL  61           HB       VAL  61 -10.854  -3.329   4.476
  453   1HG1  VAL  61          1HG1      VAL  61  -8.786  -3.042   5.915
  454   2HG1  VAL  61          2HG1      VAL  61  -9.537  -4.636   5.979
  455   3HG1  VAL  61          3HG1      VAL  61  -9.786  -3.491   7.296
  456   1HG2  VAL  61          1HG2      VAL  61 -12.161  -4.685   6.031
  457   2HG2  VAL  61          2HG2      VAL  61 -13.019  -3.192   5.658
  458   3HG2  VAL  61          3HG2      VAL  61 -12.175  -3.363   7.195
  459    H    ILE  62           H        ILE  62  -8.611  -0.878   6.462
  460    HA   ILE  62           HA       ILE  62  -7.467  -0.411   3.759
  461    HB   ILE  62           HB       ILE  62  -6.800   1.643   5.771
  462   1HG1  ILE  62          2HG1      ILE  62  -9.631   1.342   4.721
  463   2HG1  ILE  62          1HG1      ILE  62  -9.135   1.331   6.402
  464   1HG2  ILE  62          1HG2      ILE  62  -6.705   1.301   3.009
  465   2HG2  ILE  62          2HG2      ILE  62  -6.405   2.806   3.873
  466   3HG2  ILE  62          3HG2      ILE  62  -8.013   2.462   3.239
  467   1HD1  ILE  62          1HD1      ILE  62  -8.163   3.686   5.874
  468   2HD1  ILE  62          2HD1      ILE  62  -9.898   3.506   6.136
  469   3HD1  ILE  62          3HD1      ILE  62  -9.262   3.634   4.496
  470    H    ARG  63           H        ARG  63  -5.143  -0.469   3.745
  471    HA   ARG  63           HA       ARG  63  -3.590  -0.866   6.182
  472   1HB   ARG  63          2HB       ARG  63  -5.045  -3.023   5.424
  473   2HB   ARG  63          1HB       ARG  63  -3.598  -3.288   4.450
  474   1HG   ARG  63          2HG       ARG  63  -2.199  -3.423   6.338
  475   2HG   ARG  63          1HG       ARG  63  -3.375  -2.619   7.378
  476   1HD   ARG  63          2HD       ARG  63  -4.516  -4.561   7.797
  477   2HD   ARG  63          1HD       ARG  63  -4.309  -5.151   6.136
  478    HE   ARG  63           HE       ARG  63  -1.781  -5.043   7.560
  479   1HH1  ARG  63          1HH1      ARG  63  -4.233  -6.633   8.903
  480   2HH1  ARG  63          2HH1      ARG  63  -3.726  -8.243   8.510
  481   1HH2  ARG  63          1HH2      ARG  63  -1.303  -7.214   6.253
  482   2HH2  ARG  63          2HH2      ARG  63  -2.068  -8.571   7.011
  483    H    HIS  64           H        HIS  64  -1.693   0.135   5.574
  484    HA   HIS  64           HA       HIS  64  -0.902   0.075   2.709
  485   1HB   HIS  64          2HB       HIS  64   0.518   1.598   4.882
  486   2HB   HIS  64          1HB       HIS  64   0.312   2.026   3.185
  487    HD1  HIS  64           1HD      HIS  64  -2.652   1.883   2.772
  488    HD2  HIS  64           2HD      HIS  64  -0.999   3.460   6.259
  489    HE1  HIS  64           1HE      HIS  64  -4.426   3.364   3.796
  490    H    TYR  65           H        TYR  65   0.235  -1.775   2.276
  491    HA   TYR  65           HA       TYR  65   2.104  -2.966   4.204
  492   1HB   TYR  65          2HB       TYR  65   1.867  -3.489   1.240
  493   2HB   TYR  65          1HB       TYR  65   2.365  -4.611   2.502
  494    HD1  TYR  65           1HD      TYR  65  -0.031  -4.608   0.317
  495    HD2  TYR  65           2HD      TYR  65   0.242  -3.988   4.560
  496    HE1  TYR  65           1HE      TYR  65  -2.371  -5.368   0.582
  497    HE2  TYR  65           2HE      TYR  65  -2.098  -4.748   4.824
  498    HH   TYR  65           HH       TYR  65  -3.779  -6.385   2.437
  499    H    VAL  66           H        VAL  66   4.159  -2.181   4.423
  500    HA   VAL  66           HA       VAL  66   5.257  -0.544   2.169
  501    HB   VAL  66           HB       VAL  66   5.949  -0.523   5.127
  502   1HG1  VAL  66          1HG1      VAL  66   6.827   1.789   4.446
  503   2HG1  VAL  66          2HG1      VAL  66   6.668   1.241   2.777
  504   3HG1  VAL  66          3HG1      VAL  66   7.759   0.403   3.881
  505   1HG2  VAL  66          1HG2      VAL  66   3.775   0.747   3.565
  506   2HG2  VAL  66          2HG2      VAL  66   4.668   1.843   4.617
  507   3HG2  VAL  66          3HG2      VAL  66   3.874   0.422   5.295
  508    H    VAL  67           H        VAL  67   7.733  -0.577   2.137
  509    HA   VAL  67           HA       VAL  67   8.682  -3.381   2.575
  510    HB   VAL  67           HB       VAL  67   9.455  -1.247   0.563
  511   1HG1  VAL  67          1HG1      VAL  67  10.367  -3.889  -0.098
  512   2HG1  VAL  67          2HG1      VAL  67  10.923  -3.490   1.527
  513   3HG1  VAL  67          3HG1      VAL  67  11.325  -2.434   0.173
  514   1HG2  VAL  67          1HG2      VAL  67   7.972  -2.211  -0.864
  515   2HG2  VAL  67          2HG2      VAL  67   7.248  -2.911   0.583
  516   3HG2  VAL  67          3HG2      VAL  67   8.412  -3.842  -0.358
  517    H    CYS  68           H        CYS  68  10.249  -3.573   4.091
  518    HA   CYS  68           HA       CYS  68  11.644  -1.148   5.072
  519   1HB   CYS  68          2HB       CYS  68  10.537  -2.739   6.628
  520   2HB   CYS  68          1HB       CYS  68  11.581  -4.028   6.033
  521    HG   CYS  68           HG       CYS  68  13.497  -2.043   6.902
  522    H    SER  69           H        SER  69  13.792  -0.797   4.610
  523    HA   SER  69           HA       SER  69  15.219  -2.921   3.061
  524   1HB   SER  69          2HB       SER  69  16.457  -0.872   2.165
  525   2HB   SER  69          1HB       SER  69  14.756  -1.002   1.716
  526    HG   SER  69           HG       SER  69  15.268   1.083   2.488
  527    H    THR  70           H        THR  70  17.173  -3.600   3.794
  528    HA   THR  70           HA       THR  70  18.216  -2.413   6.325
  529    HB   THR  70           HB       THR  70  17.660  -4.847   6.143
  530    HG1  THR  70           1HG      THR  70  19.605  -5.550   7.016
  531   1HG2  THR  70          1HG2      THR  70  18.680  -4.688   3.631
  532   2HG2  THR  70          2HG2      THR  70  18.478  -6.200   4.514
  533   3HG2  THR  70          3HG2      THR  70  20.044  -5.395   4.492
  534    HA   PRO  71           HA       PRO  71  21.597  -0.493   4.305
  535   1HB   PRO  71          2HB       PRO  71  23.620  -1.445   6.116
  536   2HB   PRO  71          1HB       PRO  71  22.831   0.135   6.089
  537   1HG   PRO  71          2HG       PRO  71  22.464  -1.964   7.997
  538   2HG   PRO  71          1HG       PRO  71  21.638  -0.404   7.935
  539   1HD   PRO  71          2HD       PRO  71  20.565  -3.019   7.323
  540   2HD   PRO  71          1HD       PRO  71  19.713  -1.458   7.321
  541    H    GLN  72           H        GLN  72  21.381  -3.844   4.345
  542    HA   GLN  72           HA       GLN  72  23.982  -4.276   2.983
  543   1HB   GLN  72          2HB       GLN  72  23.127  -5.850   4.692
  544   2HB   GLN  72          1HB       GLN  72  21.676  -6.105   3.734
  545   1HG   GLN  72          2HG       GLN  72  22.923  -7.917   3.031
  546   2HG   GLN  72          1HG       GLN  72  23.454  -6.724   1.850
  547   1HE2  GLN  72          1HE2      GLN  72  24.509  -8.766   4.441
  548   2HE2  GLN  72          2HE2      GLN  72  26.111  -8.211   4.509
  549    H    SER  73           H        SER  73  21.679  -2.613   1.861
  550    HA   SER  73           HA       SER  73  20.674  -2.270  -0.246
  551   1HB   SER  73          2HB       SER  73  23.151  -3.609  -0.588
  552   2HB   SER  73          1HB       SER  73  22.013  -4.411  -1.665
  553    HG   SER  73           HG       SER  73  22.886  -1.747  -1.610
  554    H    GLN  74           H        GLN  74  19.248  -3.857   1.546
  555    HA   GLN  74           HA       GLN  74  18.017  -5.890  -0.274
  556   1HB   GLN  74          2HB       GLN  74  18.063  -6.363   2.662
  557   2HB   GLN  74          1HB       GLN  74  18.232  -7.517   1.346
  558   1HG   GLN  74          2HG       GLN  74  20.505  -6.322   0.913
  559   2HG   GLN  74          1HG       GLN  74  20.324  -5.727   2.560
  560   1HE2  GLN  74          1HE2      GLN  74  20.265  -7.373   4.312
  561   2HE2  GLN  74          2HE2      GLN  74  20.875  -8.935   4.045
  562    H    TYR  75           H        TYR  75  15.745  -6.481   0.537
  563    HA   TYR  75           HA       TYR  75  14.399  -4.258   2.026
  564   1HB   TYR  75          2HB       TYR  75  13.536  -5.264  -0.695
  565   2HB   TYR  75          1HB       TYR  75  12.826  -3.929   0.206
  566    HD1  TYR  75           1HD      TYR  75  15.963  -5.078  -1.432
  567    HD2  TYR  75           2HD      TYR  75  13.715  -1.747   0.064
  568    HE1  TYR  75           1HE      TYR  75  17.601  -3.533  -2.440
  569    HE2  TYR  75           2HE      TYR  75  15.349  -0.194  -0.947
  570    HH   TYR  75           HH       TYR  75  17.485  -1.013  -3.272
  571    H    TYR  76           H        TYR  76  12.169  -4.807   2.659
  572    HA   TYR  76           HA       TYR  76  10.892  -7.322   2.209
  573   1HB   TYR  76          2HB       TYR  76  11.462  -8.438   4.370
  574   2HB   TYR  76          1HB       TYR  76  12.894  -8.203   3.377
  575    HD1  TYR  76           1HD      TYR  76  14.686  -6.733   4.097
  576    HD2  TYR  76           2HD      TYR  76  10.990  -6.894   6.269
  577    HE1  TYR  76           1HE      TYR  76  15.722  -5.486   5.965
  578    HE2  TYR  76           2HE      TYR  76  12.020  -5.647   8.134
  579    HH   TYR  76           HH       TYR  76  15.101  -4.117   7.831
  580    H    LEU  77           H        LEU  77   9.002  -7.604   3.646
  581    HA   LEU  77           HA       LEU  77   8.164  -5.050   4.973
  582   1HB   LEU  77          2HB       LEU  77   6.634  -5.940   3.289
  583   2HB   LEU  77          1HB       LEU  77   6.709  -7.547   4.009
  584    HG   LEU  77           HG       LEU  77   5.666  -6.636   6.082
  585   1HD1  LEU  77          1HD1      LEU  77   6.505  -4.226   5.402
  586   2HD1  LEU  77          2HD1      LEU  77   5.000  -4.413   6.302
  587   3HD1  LEU  77          3HD1      LEU  77   4.959  -4.148   4.559
  588   1HD2  LEU  77          1HD2      LEU  77   4.381  -7.531   3.996
  589   2HD2  LEU  77          2HD2      LEU  77   3.935  -5.844   3.744
  590   3HD2  LEU  77          3HD2      LEU  77   3.469  -6.667   5.233
  591    H    ALA  78           H        ALA  78   9.508  -8.039   5.485
  592    HA   ALA  78           HA       ALA  78   9.265  -7.894   8.411
  593   1HB   ALA  78          1HB       ALA  78   8.392 -10.271   6.712
  594   2HB   ALA  78          2HB       ALA  78   7.328  -9.266   7.697
  595   3HB   ALA  78          3HB       ALA  78   8.533 -10.296   8.469
  596    H    GLU  79           H        GLU  79  11.412  -8.116   8.998
  597    HA   GLU  79           HA       GLU  79  13.570  -8.626   7.326
  598   1HB   GLU  79          2HB       GLU  79  13.006  -8.890  10.249
  599   2HB   GLU  79          1HB       GLU  79  14.536  -9.543   9.658
  600   1HG   GLU  79          2HG       GLU  79  14.914  -7.321   8.501
  601   2HG   GLU  79          1HG       GLU  79  13.519  -6.707   9.388
  602    H    LYS  80           H        LYS  80  11.317 -10.943   8.530
  603    HA   LYS  80           HA       LYS  80  12.609 -13.382   8.689
  604   1HB   LYS  80          2HB       LYS  80  10.011 -12.364   7.706
  605   2HB   LYS  80          1HB       LYS  80  10.421 -13.991   7.164
  606   1HG   LYS  80          2HG       LYS  80  11.112 -14.200   9.770
  607   2HG   LYS  80          1HG       LYS  80   9.822 -13.004   9.902
  608   1HD   LYS  80          2HD       LYS  80   9.339 -15.405   8.187
  609   2HD   LYS  80          1HD       LYS  80   9.285 -15.612   9.937
  610   1HE   LYS  80          2HE       LYS  80   7.538 -13.970  10.166
  611   2HE   LYS  80          1HE       LYS  80   7.720 -13.459   8.476
  612   1HZ   LYS  80          1HZ       LYS  80   5.910 -15.014   8.622
  613   2HZ   LYS  80          2HZ       LYS  80   6.884 -16.146   9.433
  614   3HZ   LYS  80          3HZ       LYS  80   7.199 -15.758   7.809
  615    H    HIS  81           H        HIS  81  11.852 -11.595   5.697
  616    HA   HIS  81           HA       HIS  81  13.957 -13.113   4.265
  617   1HB   HIS  81          2HB       HIS  81  11.020 -13.070   3.488
  618   2HB   HIS  81          1HB       HIS  81  12.312 -13.705   2.468
  619    HD1  HIS  81           1HD      HIS  81  13.872 -15.593   3.868
  620    HD2  HIS  81           2HD      HIS  81   9.911 -15.050   5.051
  621    HE1  HIS  81           1HE      HIS  81  13.229 -17.656   5.189
  622    H    LEU  82           H        LEU  82  14.898 -11.760   2.687
  623    HA   LEU  82           HA       LEU  82  13.375  -9.367   1.832
  624   1HB   LEU  82          2HB       LEU  82  15.142  -7.890   2.649
  625   2HB   LEU  82          1HB       LEU  82  14.578  -8.898   3.978
  626    HG   LEU  82           HG       LEU  82  16.945  -9.653   2.280
  627   1HD1  LEU  82          1HD1      LEU  82  17.473  -8.558   4.964
  628   2HD1  LEU  82          2HD1      LEU  82  16.853  -7.371   3.818
  629   3HD1  LEU  82          3HD1      LEU  82  18.322  -8.271   3.447
  630   1HD2  LEU  82          1HD2      LEU  82  15.543 -10.737   4.626
  631   2HD2  LEU  82          2HD2      LEU  82  17.282 -10.581   4.877
  632   3HD2  LEU  82          3HD2      LEU  82  16.668 -11.537   3.528
  633    H    PHE  83           H        PHE  83  14.075  -8.535  -0.159
  634    HA   PHE  83           HA       PHE  83  16.241 -10.089  -1.533
  635   1HB   PHE  83          2HB       PHE  83  13.546  -9.031  -2.369
  636   2HB   PHE  83          1HB       PHE  83  14.789  -9.333  -3.586
  637    HD1  PHE  83           1HD      PHE  83  15.078 -11.495  -4.441
  638    HD2  PHE  83           2HD      PHE  83  13.119 -10.964  -0.655
  639    HE1  PHE  83           1HE      PHE  83  14.585 -13.923  -4.356
  640    HE2  PHE  83           2HE      PHE  83  12.624 -13.393  -0.571
  641    HZ   PHE  83           HZ       PHE  83  13.358 -14.873  -2.421
  642    H    SER  84           H        SER  84  16.232  -8.258  -3.828
  643    HA   SER  84           HA       SER  84  17.700  -6.010  -2.530
  644   1HB   SER  84          2HB       SER  84  17.693  -6.945  -5.413
  645   2HB   SER  84          1HB       SER  84  18.878  -5.895  -4.641
  646    HG   SER  84           HG       SER  84  18.370  -8.645  -4.195
  647    H    THR  85           H        THR  85  14.619  -6.465  -3.747
  648    HA   THR  85           HA       THR  85  14.125  -3.608  -3.971
  649    HB   THR  85           HB       THR  85  13.650  -5.054  -6.560
  650    HG1  THR  85           1HG      THR  85  15.704  -5.413  -6.717
  651   1HG2  THR  85          1HG2      THR  85  14.733  -2.356  -6.623
  652   2HG2  THR  85          2HG2      THR  85  13.300  -2.462  -5.600
  653   3HG2  THR  85          3HG2      THR  85  13.220  -2.973  -7.286
  654    H    ILE  86           H        ILE  86  11.776  -3.191  -4.545
  655    HA   ILE  86           HA       ILE  86   9.980  -4.959  -3.236
  656    HB   ILE  86           HB       ILE  86   9.890  -2.580  -4.999
  657   1HG1  ILE  86          2HG1      ILE  86   8.137  -2.042  -3.158
  658   2HG1  ILE  86          1HG1      ILE  86   8.737  -3.504  -2.377
  659   1HG2  ILE  86          1HG2      ILE  86   8.230  -3.916  -6.180
  660   2HG2  ILE  86          2HG2      ILE  86   7.387  -2.725  -5.190
  661   3HG2  ILE  86          3HG2      ILE  86   7.487  -4.402  -4.657
  662   1HD1  ILE  86          1HD1      ILE  86  10.738  -1.507  -3.355
  663   2HD1  ILE  86          2HD1      ILE  86  10.829  -2.602  -1.975
  664   3HD1  ILE  86          3HD1      ILE  86   9.848  -1.141  -1.878
  665    HA   PRO  87           HA       PRO  87   8.650  -6.468  -7.703
  666   1HB   PRO  87          2HB       PRO  87  11.050  -6.328  -9.291
  667   2HB   PRO  87          1HB       PRO  87   9.501  -5.530  -9.582
  668   1HG   PRO  87          2HG       PRO  87  11.974  -4.355  -8.658
  669   2HG   PRO  87          1HG       PRO  87  10.455  -3.546  -9.053
  670   1HD   PRO  87          2HD       PRO  87  11.578  -3.898  -6.463
  671   2HD   PRO  87          1HD       PRO  87   9.958  -3.269  -6.841
  672    H    GLU  88           H        GLU  88  11.965  -6.798  -6.484
  673    HA   GLU  88           HA       GLU  88  12.353  -9.550  -7.254
  674   1HB   GLU  88          2HB       GLU  88  13.947  -7.628  -6.344
  675   2HB   GLU  88          1HB       GLU  88  13.547  -8.336  -4.779
  676   1HG   GLU  88          2HG       GLU  88  15.450  -9.556  -5.413
  677   2HG   GLU  88          1HG       GLU  88  14.130 -10.605  -5.931
  678    H    LEU  89           H        LEU  89  11.195  -7.991  -4.257
  679    HA   LEU  89           HA       LEU  89  10.740 -10.377  -2.730
  680   1HB   LEU  89          2HB       LEU  89   9.956  -7.506  -2.727
  681   2HB   LEU  89          1HB       LEU  89   8.890  -8.583  -1.825
  682    HG   LEU  89           HG       LEU  89  11.893  -8.609  -1.476
  683   1HD1  LEU  89          1HD1      LEU  89  11.736  -7.060   0.278
  684   2HD1  LEU  89          2HD1      LEU  89   9.995  -7.270   0.440
  685   3HD1  LEU  89          3HD1      LEU  89  10.652  -6.370  -0.927
  686   1HD2  LEU  89          1HD2      LEU  89   9.513  -9.790  -0.056
  687   2HD2  LEU  89          2HD2      LEU  89  11.030  -9.532   0.807
  688   3HD2  LEU  89          3HD2      LEU  89  10.986 -10.595  -0.600
  689    H    ILE  90           H        ILE  90   8.412  -8.366  -4.587
  690    HA   ILE  90           HA       ILE  90   6.109  -9.942  -4.321
  691    HB   ILE  90           HB       ILE  90   7.139  -8.413  -6.737
  692   1HG1  ILE  90          2HG1      ILE  90   7.110  -7.018  -4.729
  693   2HG1  ILE  90          1HG1      ILE  90   5.766  -6.558  -5.771
  694   1HG2  ILE  90          1HG2      ILE  90   5.283  -9.562  -7.562
  695   2HG2  ILE  90          2HG2      ILE  90   4.538  -8.085  -6.952
  696   3HG2  ILE  90          3HG2      ILE  90   4.465  -9.568  -6.000
  697   1HD1  ILE  90          1HD1      ILE  90   4.459  -6.833  -3.947
  698   2HD1  ILE  90          2HD1      ILE  90   5.723  -7.701  -3.074
  699   3HD1  ILE  90          3HD1      ILE  90   4.676  -8.566  -4.200
  700    H    ASN  91           H        ASN  91   8.346 -10.097  -7.133
  701    HA   ASN  91           HA       ASN  91   7.287 -12.437  -8.320
  702   1HB   ASN  91          2HB       ASN  91   9.293 -10.644  -8.812
  703   2HB   ASN  91          1HB       ASN  91  10.229 -12.076  -8.381
  704   1HD2  ASN  91          1HD2      ASN  91  10.849 -13.012 -10.346
  705   2HD2  ASN  91          2HD2      ASN  91   9.798 -13.322 -11.642
  706    H    TYR  92           H        TYR  92   9.740 -12.071  -5.780
  707    HA   TYR  92           HA       TYR  92  10.623 -14.743  -5.535
  708   1HB   TYR  92          2HB       TYR  92  11.846 -13.401  -4.162
  709   2HB   TYR  92          1HB       TYR  92  10.532 -12.248  -3.988
  710    HD1  TYR  92           1HD      TYR  92  11.303 -15.777  -2.937
  711    HD2  TYR  92           2HD      TYR  92   9.699 -11.942  -1.861
  712    HE1  TYR  92           1HE      TYR  92  10.883 -16.595  -0.635
  713    HE2  TYR  92           2HE      TYR  92   9.275 -12.757   0.437
  714    HH   TYR  92           HH       TYR  92  10.663 -15.396   1.734
  715    H    HIS  93           H        HIS  93   8.025 -13.180  -3.592
  716    HA   HIS  93           HA       HIS  93   6.571 -15.785  -3.578
  717   1HB   HIS  93          2HB       HIS  93   8.214 -15.027  -1.531
  718   2HB   HIS  93          1HB       HIS  93   6.684 -14.332  -1.000
  719    HD1  HIS  93           1HD      HIS  93   7.886 -16.746   0.512
  720    HD2  HIS  93           2HD      HIS  93   5.132 -17.104  -2.597
  721    HE1  HIS  93           1HE      HIS  93   6.765 -18.999   0.803
  722    H    GLN  94           H        GLN  94   6.283 -12.618  -1.921
  723    HA   GLN  94           HA       GLN  94   4.107 -11.642  -3.524
  724   1HB   GLN  94          2HB       GLN  94   3.511 -13.730  -1.656
  725   2HB   GLN  94          1HB       GLN  94   2.765 -12.246  -1.062
  726   1HG   GLN  94          2HG       GLN  94   1.312 -12.110  -2.824
  727   2HG   GLN  94          1HG       GLN  94   2.483 -12.759  -3.971
  728   1HE2  GLN  94          1HE2      GLN  94   1.415 -14.262  -0.892
  729   2HE2  GLN  94          2HE2      GLN  94   0.753 -15.646  -1.618
  730    H    HIS  95           H        HIS  95   4.342 -11.716   0.038
  731    HA   HIS  95           HA       HIS  95   5.711  -9.171   0.256
  732   1HB   HIS  95          2HB       HIS  95   3.707  -7.879   1.000
  733   2HB   HIS  95          1HB       HIS  95   3.577  -8.401  -0.678
  734    HD1  HIS  95           1HD      HIS  95   1.957 -10.424  -1.175
  735    HD2  HIS  95           2HD      HIS  95   1.797  -9.003   2.741
  736    HE1  HIS  95           1HE      HIS  95  -0.134 -11.409  -0.139
  737    H    ASN  96           H        ASN  96   3.352 -11.369   1.799
  738    HA   ASN  96           HA       ASN  96   5.058 -11.846   4.085
  739   1HB   ASN  96          2HB       ASN  96   4.332  -9.474   4.452
  740   2HB   ASN  96          1HB       ASN  96   2.658 -10.028   4.483
  741   1HD2  ASN  96          1HD2      ASN  96   5.788 -10.358   6.195
  742   2HD2  ASN  96          2HD2      ASN  96   5.109 -10.848   7.671
  743    H    SER  97           H        SER  97   1.522 -11.439   3.631
  744    HA   SER  97           HA       SER  97   0.959 -14.004   4.916
  745   1HB   SER  97          2HB       SER  97  -0.847 -12.174   3.307
  746   2HB   SER  97          1HB       SER  97  -1.339 -13.337   4.535
  747    HG   SER  97           HG       SER  97  -0.235 -12.092   6.069
  748    H    ALA  98           H        ALA  98  -1.167 -14.896   3.241
  749    HA   ALA  98           HA       ALA  98   0.361 -15.893   0.858
  750   1HB   ALA  98          1HB       ALA  98  -1.870 -17.213   2.438
  751   2HB   ALA  98          2HB       ALA  98  -0.152 -17.507   2.712
  752   3HB   ALA  98          3HB       ALA  98  -0.891 -17.964   1.177
  753    H    GLY  99           H        GLY  99  -0.548 -13.968  -0.311
  754   1HA   GLY  99          2HA       GLY  99  -3.438 -13.773  -0.659
  755   2HA   GLY  99          1HA       GLY  99  -2.225 -12.857  -1.554
  756    H    LEU 100           H        LEU 100  -4.548 -14.195  -2.687
  757    HA   LEU 100           HA       LEU 100  -3.194 -16.297  -4.348
  758   1HB   LEU 100          2HB       LEU 100  -5.873 -15.998  -3.080
  759   2HB   LEU 100          1HB       LEU 100  -5.841 -16.758  -4.670
  760    HG   LEU 100           HG       LEU 100  -5.640 -18.437  -2.865
  761   1HD1  LEU 100          1HD1      LEU 100  -4.304 -19.656  -4.211
  762   2HD1  LEU 100          2HD1      LEU 100  -2.910 -18.637  -3.860
  763   3HD1  LEU 100          3HD1      LEU 100  -4.032 -18.184  -5.142
  764   1HD2  LEU 100          1HD2      LEU 100  -2.897 -17.450  -2.204
  765   2HD2  LEU 100          2HD2      LEU 100  -4.038 -18.344  -1.200
  766   3HD2  LEU 100          3HD2      LEU 100  -4.267 -16.616  -1.471
  767    H    ILE 101           H        ILE 101  -4.408 -16.457  -6.576
  768    HA   ILE 101           HA       ILE 101  -4.864 -15.435  -8.647
  769    HB   ILE 101           HB       ILE 101  -6.150 -13.436  -6.754
  770   1HG1  ILE 101          2HG1      ILE 101  -7.326 -15.821  -8.215
  771   2HG1  ILE 101          1HG1      ILE 101  -6.893 -15.813  -6.506
  772   1HG2  ILE 101          1HG2      ILE 101  -6.948 -14.005  -9.609
  773   2HG2  ILE 101          2HG2      ILE 101  -5.749 -12.768  -9.225
  774   3HG2  ILE 101          3HG2      ILE 101  -7.392 -12.629  -8.599
  775   1HD1  ILE 101          1HD1      ILE 101  -9.104 -14.342  -7.904
  776   2HD1  ILE 101          2HD1      ILE 101  -8.411 -13.660  -6.433
  777   3HD1  ILE 101          3HD1      ILE 101  -9.154 -15.260  -6.398
  778    H    SER 102           H        SER 102  -4.604 -12.355  -6.887
  779    HA   SER 102           HA       SER 102  -1.883 -11.895  -7.980
  780   1HB   SER 102          2HB       SER 102  -3.325 -11.253  -9.805
  781   2HB   SER 102          1HB       SER 102  -4.401 -10.379  -8.720
  782    HG   SER 102           HG       SER 102  -3.090  -8.735  -8.780
  783    H    ARG 103           H        ARG 103  -0.856 -10.030  -6.977
  784    HA   ARG 103           HA       ARG 103  -1.630  -9.577  -4.225
  785   1HB   ARG 103          2HB       ARG 103   0.556  -9.029  -6.052
  786   2HB   ARG 103          1HB       ARG 103   0.204  -7.602  -5.079
  787   1HG   ARG 103          2HG       ARG 103   0.190  -9.182  -3.055
  788   2HG   ARG 103          1HG       ARG 103   0.934 -10.372  -4.122
  789   1HD   ARG 103          2HD       ARG 103   2.684  -9.132  -2.906
  790   2HD   ARG 103          1HD       ARG 103   2.750  -8.715  -4.630
  791    HE   ARG 103           HE       ARG 103   1.658  -6.604  -4.123
  792   1HH1  ARG 103          1HH1      ARG 103   0.095  -7.679  -1.728
  793   2HH1  ARG 103          2HH1      ARG 103   0.861  -6.832  -0.425
  794   1HH2  ARG 103          1HH2      ARG 103   3.623  -5.901  -2.304
  795   2HH2  ARG 103          2HH2      ARG 103   2.859  -5.826  -0.751
  796    H    LEU 104           H        LEU 104  -1.979  -7.724  -7.231
  797    HA   LEU 104           HA       LEU 104  -3.150  -5.411  -5.818
  798   1HB   LEU 104          2HB       LEU 104  -1.609  -5.303  -7.818
  799   2HB   LEU 104          1HB       LEU 104  -2.906  -6.011  -8.781
  800    HG   LEU 104           HG       LEU 104  -3.684  -3.689  -7.128
  801   1HD1  LEU 104          1HD1      LEU 104  -1.306  -3.275  -8.170
  802   2HD1  LEU 104          2HD1      LEU 104  -2.550  -2.032  -8.304
  803   3HD1  LEU 104          3HD1      LEU 104  -2.214  -3.095  -9.671
  804   1HD2  LEU 104          1HD2      LEU 104  -4.872  -5.113  -9.081
  805   2HD2  LEU 104          2HD2      LEU 104  -4.120  -3.856 -10.064
  806   3HD2  LEU 104          3HD2      LEU 104  -5.249  -3.416  -8.784
  807    H    LYS 105           H        LYS 105  -5.333  -4.605  -6.551
  808    HA   LYS 105           HA       LYS 105  -7.154  -6.790  -7.467
  809   1HB   LYS 105          2HB       LYS 105  -6.902  -5.613  -4.838
  810   2HB   LYS 105          1HB       LYS 105  -8.506  -5.283  -5.492
  811   1HG   LYS 105          2HG       LYS 105  -8.806  -7.680  -5.983
  812   2HG   LYS 105          1HG       LYS 105  -7.198  -8.016  -5.340
  813   1HD   LYS 105          2HD       LYS 105  -8.139  -6.742  -3.216
  814   2HD   LYS 105          1HD       LYS 105  -9.696  -7.234  -3.884
  815   1HE   LYS 105          2HE       LYS 105  -8.461  -9.592  -4.104
  816   2HE   LYS 105          1HE       LYS 105  -7.498  -8.931  -2.767
  817   1HZ   LYS 105          1HZ       LYS 105  -9.692  -8.246  -1.763
  818   2HZ   LYS 105          2HZ       LYS 105  -9.375  -9.915  -1.767
  819   3HZ   LYS 105          3HZ       LYS 105 -10.443  -9.248  -2.907
  820    H    TYR 106           H        TYR 106  -7.310  -3.323  -6.432
  821    HA   TYR 106           HA       TYR 106  -8.621  -2.754  -9.068
  822   1HB   TYR 106          2HB       TYR 106 -10.202  -3.084  -7.101
  823   2HB   TYR 106          1HB       TYR 106  -9.492  -1.634  -6.396
  824    HD1  TYR 106           1HD      TYR 106 -12.069  -2.836  -8.458
  825    HD2  TYR 106           2HD      TYR 106  -9.320   0.438  -8.068
  826    HE1  TYR 106           1HE      TYR 106 -13.547  -1.429  -9.871
  827    HE2  TYR 106           2HE      TYR 106 -10.794   1.846  -9.478
  828    HH   TYR 106           HH       TYR 106 -13.428   0.537 -11.263
  829    HA   PRO 107           HA       PRO 107  -5.355   0.364  -8.826
  830   1HB   PRO 107          2HB       PRO 107  -6.303   1.408 -11.326
  831   2HB   PRO 107          1HB       PRO 107  -4.870   0.419 -11.033
  832   1HG   PRO 107          2HG       PRO 107  -7.276  -0.364 -12.359
  833   2HG   PRO 107          1HG       PRO 107  -5.873  -1.371 -11.990
  834   1HD   PRO 107          2HD       PRO 107  -8.498  -1.407 -10.737
  835   2HD   PRO 107          1HD       PRO 107  -7.123  -2.505 -10.458
  836    H    VAL 108           H        VAL 108  -6.853   1.261  -7.059
  837    HA   VAL 108           HA       VAL 108  -8.333   3.664  -8.054
  838    HB   VAL 108           HB       VAL 108  -9.733   1.961  -7.005
  839   1HG1  VAL 108          1HG1      VAL 108  -8.858   2.023  -4.300
  840   2HG1  VAL 108          2HG1      VAL 108  -7.456   1.638  -5.295
  841   3HG1  VAL 108          3HG1      VAL 108  -8.905   0.642  -5.392
  842   1HG2  VAL 108          1HG2      VAL 108  -9.210   4.285  -5.130
  843   2HG2  VAL 108          2HG2      VAL 108 -10.682   3.316  -5.168
  844   3HG2  VAL 108          3HG2      VAL 108 -10.257   4.329  -6.548
  845    H    SER 109           H        SER 109  -6.904   5.381  -7.768
  846    HA   SER 109           HA       SER 109  -5.268   5.439  -5.272
  847   1HB   SER 109          2HB       SER 109  -5.084   7.093  -7.804
  848   2HB   SER 109          1HB       SER 109  -3.866   6.967  -6.532
  849    HG   SER 109           HG       SER 109  -3.209   5.183  -7.405
  850    H    GLN 110           H        GLN 110  -4.934   8.381  -5.685
  851    HA   GLN 110           HA       GLN 110  -6.633   9.494  -3.847
  852   1HB   GLN 110          2HB       GLN 110  -6.275  11.632  -5.191
  853   2HB   GLN 110          1HB       GLN 110  -4.811  10.726  -4.816
  854   1HG   GLN 110          2HG       GLN 110  -5.406   9.551  -7.154
  855   2HG   GLN 110          1HG       GLN 110  -6.184  11.106  -7.437
  856   1HE2  GLN 110          1HE2      GLN 110  -3.077   9.991  -5.950
  857   2HE2  GLN 110          2HE2      GLN 110  -2.118  11.144  -6.746
  858    H    GLN 111           H        GLN 111  -7.341   9.174  -7.332
  859    HA   GLN 111           HA       GLN 111  -9.374   9.403  -8.515
  860   1HB   GLN 111          2HB       GLN 111 -10.182   8.143  -5.879
  861   2HB   GLN 111          1HB       GLN 111 -11.179   8.130  -7.338
  862   1HG   GLN 111          2HG       GLN 111  -8.457   7.255  -7.903
  863   2HG   GLN 111          1HG       GLN 111  -9.208   6.259  -6.657
  864   1HE2  GLN 111          1HE2      GLN 111  -9.180   6.964 -10.058
  865   2HE2  GLN 111          2HE2      GLN 111 -10.453   5.931 -10.496
  866    H    ASN 112           H        ASN 112 -11.878  10.033  -7.990
  867    HA   ASN 112           HA       ASN 112 -11.775  12.637  -6.555
  868   1HB   ASN 112          2HB       ASN 112 -12.311  12.039  -9.205
  869   2HB   ASN 112          1HB       ASN 112 -13.923  12.186  -8.506
  870   1HD2  ASN 112          1HD2      ASN 112 -10.975  13.961  -9.278
  871   2HD2  ASN 112          2HD2      ASN 112 -11.587  15.501  -8.909
  872    H    LYS 113           H        LYS 113 -12.475   9.841  -5.565
  873    HA   LYS 113           HA       LYS 113 -14.079   8.865  -4.136
  874   1HB   LYS 113          2HB       LYS 113 -15.239  11.656  -3.973
  875   2HB   LYS 113          1HB       LYS 113 -15.179  10.429  -2.711
  876   1HG   LYS 113          2HG       LYS 113 -12.812  11.937  -3.866
  877   2HG   LYS 113          1HG       LYS 113 -13.498  12.145  -2.256
  878   1HD   LYS 113          2HD       LYS 113 -12.269  10.438  -1.456
  879   2HD   LYS 113          1HD       LYS 113 -12.887   9.356  -2.703
  880   1HE   LYS 113          2HE       LYS 113 -10.618   9.362  -3.253
  881   2HE   LYS 113          1HE       LYS 113 -11.169  10.737  -4.231
  882   1HZ   LYS 113          1HZ       LYS 113  -9.229  11.183  -2.694
  883   2HZ   LYS 113          2HZ       LYS 113 -10.325  11.034  -1.405
  884   3HZ   LYS 113          3HZ       LYS 113 -10.538  12.254  -2.568
  885    H    ASN 114           H        ASN 114 -16.587   8.682  -3.868
  886    HA   ASN 114           HA       ASN 114 -17.959   9.196  -6.483
  887   1HB   ASN 114          2HB       ASN 114 -18.841   6.880  -6.321
  888   2HB   ASN 114          1HB       ASN 114 -17.079   6.893  -6.379
  889   1HD2  ASN 114          1HD2      ASN 114 -18.314   4.647  -5.260
  890   2HD2  ASN 114          2HD2      ASN 114 -18.086   4.638  -3.578
  891    H    ALA 115           H        ALA 115 -20.399   8.030  -5.831
  892    HA   ALA 115           HA       ALA 115 -22.428   8.563  -4.743
  893   1HB   ALA 115          1HB       ALA 115 -22.321   8.127  -2.439
  894   2HB   ALA 115          2HB       ALA 115 -20.762   8.932  -2.264
  895   3HB   ALA 115          3HB       ALA 115 -20.854   7.346  -3.029
  896    HA   PRO 116           HA       PRO 116 -21.248  13.099  -4.911
  897   1HB   PRO 116          2HB       PRO 116 -23.561  13.423  -6.593
  898   2HB   PRO 116          1HB       PRO 116 -21.861  13.600  -7.036
  899   1HG   PRO 116          2HG       PRO 116 -23.658  11.496  -7.783
  900   2HG   PRO 116          1HG       PRO 116 -21.955  11.670  -8.212
  901   1HD   PRO 116          2HD       PRO 116 -23.135   9.779  -6.375
  902   2HD   PRO 116          1HD       PRO 116 -21.418   9.953  -6.813
  903    H    SER 117           H        SER 117 -21.951  13.417  -2.735
  904    HA   SER 117           HA       SER 117 -24.838  13.257  -2.098
  905   1HB   SER 117          2HB       SER 117 -23.207  12.389  -0.518
  906   2HB   SER 117          1HB       SER 117 -22.323  13.911  -0.530
  907    HG   SER 117           HG       SER 117 -24.812  13.273   0.609
  908    H    THR 118           H        THR 118 -25.982  15.025  -2.852
  909    HA   THR 118           HA       THR 118 -24.810  17.745  -2.366
  910    HB   THR 118           HB       THR 118 -26.409  18.332  -4.293
  911    HG1  THR 118           1HG      THR 118 -26.937  16.476  -5.569
  912   1HG2  THR 118          1HG2      THR 118 -23.942  18.048  -4.535
  913   2HG2  THR 118          2HG2      THR 118 -24.828  17.563  -5.980
  914   3HG2  THR 118          3HG2      THR 118 -24.203  16.338  -4.876
  Start of MODEL    6
    1    H    THR   1           1H       THR   1  22.348  -6.964  -9.390
    2    HA   THR   1           HA       THR   1  20.836  -7.545 -11.059
    3    HB   THR   1           HB       THR   1  20.614  -9.807  -9.070
    4    HG1  THR   1           1HG      THR   1  22.921  -8.965 -10.490
    5   1HG2  THR   1          1HG2      THR   1  21.349 -11.041 -11.212
    6   2HG2  THR   1          2HG2      THR   1  20.984  -9.533 -12.050
    7   3HG2  THR   1          3HG2      THR   1  19.712 -10.387 -11.178
    8    H    GLU   2           H        GLU   2  18.667  -8.603 -11.555
    9    HA   GLU   2           HA       GLU   2  16.310  -8.513 -11.412
   10   1HB   GLU   2          2HB       GLU   2  17.454  -9.396  -8.860
   11   2HB   GLU   2          1HB       GLU   2  15.843  -8.700  -8.676
   12   1HG   GLU   2          2HG       GLU   2  14.836 -10.384  -9.853
   13   2HG   GLU   2          1HG       GLU   2  16.195 -10.561 -10.962
   14    H    ALA   3           H        ALA   3  15.917  -6.343 -12.030
   15    HA   ALA   3           HA       ALA   3  15.581  -4.390  -9.769
   16   1HB   ALA   3          1HB       ALA   3  16.110  -3.574 -12.610
   17   2HB   ALA   3          2HB       ALA   3  17.451  -4.183 -11.640
   18   3HB   ALA   3          3HB       ALA   3  16.559  -2.754 -11.116
   19    H    GLU   4           H        GLU   4  14.354  -2.442 -11.528
   20    HA   GLU   4           HA       GLU   4  12.034  -3.618 -12.836
   21   1HB   GLU   4          2HB       GLU   4  10.441  -2.737 -11.065
   22   2HB   GLU   4          1HB       GLU   4  11.424  -4.107 -10.548
   23   1HG   GLU   4          2HG       GLU   4  12.106  -2.851  -8.804
   24   2HG   GLU   4          1HG       GLU   4  12.984  -1.845  -9.955
   25    H    ASP   5           H        ASP   5  10.262  -1.632 -12.883
   26    HA   ASP   5           HA       ASP   5  11.462   1.031 -12.932
   27   1HB   ASP   5          2HB       ASP   5  11.346   1.240 -15.407
   28   2HB   ASP   5          1HB       ASP   5  12.467  -0.028 -14.917
   29    H    SER   6           H        SER   6   9.713   2.165 -14.860
   30    HA   SER   6           HA       SER   6   7.017   1.560 -13.683
   31   1HB   SER   6          2HB       SER   6   7.682   4.277 -14.708
   32   2HB   SER   6          1HB       SER   6   6.738   3.816 -13.296
   33    HG   SER   6           HG       SER   6   8.622   4.610 -12.508
   34    H    ILE   7           H        ILE   7   5.980   0.482 -15.364
   35    HA   ILE   7           HA       ILE   7   6.111   1.739 -18.085
   36    HB   ILE   7           HB       ILE   7   7.229  -0.485 -17.748
   37   1HG1  ILE   7          2HG1      ILE   7   5.863  -1.628 -19.639
   38   2HG1  ILE   7          1HG1      ILE   7   4.864  -0.174 -19.596
   39   1HG2  ILE   7          1HG2      ILE   7   5.804  -2.461 -17.412
   40   2HG2  ILE   7          2HG2      ILE   7   4.387  -1.423 -17.260
   41   3HG2  ILE   7          3HG2      ILE   7   5.663  -1.357 -16.044
   42   1HD1  ILE   7          1HD1      ILE   7   6.602   0.133 -21.268
   43   2HD1  ILE   7          2HD1      ILE   7   7.850  -0.300 -20.100
   44   3HD1  ILE   7          3HD1      ILE   7   6.939   1.197 -19.903
   45    H    GLU   8           H        GLU   8   4.030   0.201 -15.654
   46    HA   GLU   8           HA       GLU   8   1.638   0.603 -17.328
   47   1HB   GLU   8          2HB       GLU   8   2.149  -0.633 -14.608
   48   2HB   GLU   8          1HB       GLU   8   0.571  -0.610 -15.397
   49   1HG   GLU   8          2HG       GLU   8   2.037  -1.616 -17.417
   50   2HG   GLU   8          1HG       GLU   8   2.997  -2.200 -16.058
   51    H    MET   9           H        MET   9   2.022   1.128 -13.836
   52    HA   MET   9           HA       MET   9   1.366   2.927 -12.465
   53   1HB   MET   9          2HB       MET   9   2.350   4.203 -15.020
   54   2HB   MET   9          1HB       MET   9   1.813   5.187 -13.660
   55   1HG   MET   9          2HG       MET   9   4.139   4.946 -13.310
   56   2HG   MET   9          1HG       MET   9   3.417   3.749 -12.234
   57   1HE   MET   9          1HE       MET   9   3.862   0.519 -13.389
   58   2HE   MET   9          2HE       MET   9   3.432   1.740 -12.194
   59   3HE   MET   9          3HE       MET   9   5.107   1.216 -12.343
   60    H    TYR  10           H        TYR  10  -0.773   1.599 -13.763
   61    HA   TYR  10           HA       TYR  10  -2.585   3.227 -15.216
   62   1HB   TYR  10          2HB       TYR  10  -2.876   0.951 -13.247
   63   2HB   TYR  10          1HB       TYR  10  -4.275   1.642 -14.071
   64    HD1  TYR  10           1HD      TYR  10  -1.908  -0.908 -14.249
   65    HD2  TYR  10           2HD      TYR  10  -3.818   2.040 -16.721
   66    HE1  TYR  10           1HE      TYR  10  -1.394  -2.262 -16.263
   67    HE2  TYR  10           2HE      TYR  10  -3.303   0.687 -18.734
   68    HH   TYR  10           HH       TYR  10  -2.766  -2.227 -18.899
   69    H    GLU  11           H        GLU  11  -2.946   2.445 -11.744
   70    HA   GLU  11           HA       GLU  11  -3.594   5.303 -11.178
   71   1HB   GLU  11          2HB       GLU  11  -5.597   3.592 -11.712
   72   2HB   GLU  11          1HB       GLU  11  -5.332   3.160 -10.023
   73   1HG   GLU  11          2HG       GLU  11  -6.965   4.890 -10.003
   74   2HG   GLU  11          1HG       GLU  11  -5.451   5.640  -9.495
   75    H    TRP  12           H        TRP  12  -3.294   2.031  -9.803
   76    HA   TRP  12           HA       TRP  12  -2.968   2.510  -7.115
   77   1HB   TRP  12          2HB       TRP  12  -1.514   0.487  -7.155
   78   2HB   TRP  12          1HB       TRP  12  -2.971   0.306  -8.130
   79    HD1  TRP  12           HD       TRP  12  -2.705   0.232 -10.761
   80    HE1  TRP  12           1HE      TRP  12  -0.668  -0.146 -12.292
   81    HE3  TRP  12           3HE      TRP  12   1.066   0.920  -7.392
   82    HZ2  TRP  12           2HZ      TRP  12   2.188  -0.154 -12.111
   83    HZ3  TRP  12           3HZ      TRP  12   3.433   0.723  -8.095
   84    HH2  TRP  12           HH       TRP  12   3.999   0.186 -10.449
   85    H    TYR  13           H        TYR  13  -0.662   3.316  -9.645
   86    HA   TYR  13           HA       TYR  13   1.530   3.764  -7.732
   87   1HB   TYR  13          2HB       TYR  13   1.780   3.000 -10.126
   88   2HB   TYR  13          1HB       TYR  13   1.277   4.615 -10.631
   89    HD1  TYR  13           1HD      TYR  13   3.824   2.764  -8.636
   90    HD2  TYR  13           2HD      TYR  13   2.794   6.446 -10.593
   91    HE1  TYR  13           1HE      TYR  13   6.126   3.604  -8.263
   92    HE2  TYR  13           2HE      TYR  13   5.098   7.286 -10.222
   93    HH   TYR  13           HH       TYR  13   7.615   5.565  -9.673
   94    H    SER  14           H        SER  14   1.808   5.619  -6.595
   95    HA   SER  14           HA       SER  14   0.719   8.178  -7.693
   96   1HB   SER  14          2HB       SER  14   0.411   7.226  -4.834
   97   2HB   SER  14          1HB       SER  14  -0.332   8.644  -5.570
   98    HG   SER  14           HG       SER  14  -0.909   5.916  -5.908
   99    H    LYS  15           H        LYS  15   2.167   9.835  -7.438
  100    HA   LYS  15           HA       LYS  15   4.804   9.321  -6.428
  101   1HB   LYS  15          2HB       LYS  15   5.290  11.444  -7.309
  102   2HB   LYS  15          1HB       LYS  15   3.945  10.887  -8.295
  103   1HG   LYS  15          2HG       LYS  15   3.863  12.876  -6.013
  104   2HG   LYS  15          1HG       LYS  15   3.477  13.162  -7.706
  105   1HD   LYS  15          2HD       LYS  15   1.474  11.904  -7.582
  106   2HD   LYS  15          1HD       LYS  15   1.938  11.162  -6.056
  107   1HE   LYS  15          2HE       LYS  15   1.831  14.116  -5.981
  108   2HE   LYS  15          1HE       LYS  15   0.265  13.305  -6.197
  109   1HZ   LYS  15          1HZ       LYS  15   0.900  11.781  -4.382
  110   2HZ   LYS  15          2HZ       LYS  15   0.772  13.393  -3.858
  111   3HZ   LYS  15          3HZ       LYS  15   2.301  12.699  -4.116
  112    H    HIS  16           H        HIS  16   4.755   8.823  -4.226
  113    HA   HIS  16           HA       HIS  16   4.821   9.248  -1.921
  114   1HB   HIS  16          2HB       HIS  16   4.839  12.079  -3.011
  115   2HB   HIS  16          1HB       HIS  16   5.275  11.627  -1.366
  116    HD1  HIS  16           1HD      HIS  16   7.343   9.853  -1.198
  117    HD2  HIS  16           2HD      HIS  16   6.944  11.899  -4.808
  118    HE1  HIS  16           1HE      HIS  16   9.558   9.618  -2.403
  119    H    MET  17           H        MET  17   2.356   8.524  -2.611
  120    HA   MET  17           HA       MET  17   0.336  10.560  -1.984
  121   1HB   MET  17          2HB       MET  17  -0.029   8.697  -3.566
  122   2HB   MET  17          1HB       MET  17   0.218   7.536  -2.263
  123   1HG   MET  17          2HG       MET  17  -1.992   7.667  -1.835
  124   2HG   MET  17          1HG       MET  17  -1.722   9.319  -1.283
  125   1HE   MET  17          1HE       MET  17  -1.385  11.201  -2.764
  126   2HE   MET  17          2HE       MET  17  -2.319  11.544  -4.218
  127   3HE   MET  17          3HE       MET  17  -0.802  10.655  -4.342
  128    H    THR  18           H        THR  18  -0.231  11.104   0.077
  129    HA   THR  18           HA       THR  18   0.951  10.064   2.424
  130    HB   THR  18           HB       THR  18  -1.810  11.274   2.285
  131    HG1  THR  18           1HG      THR  18  -0.855  13.234   1.920
  132   1HG2  THR  18          1HG2      THR  18  -0.513  12.597   4.213
  133   2HG2  THR  18          2HG2      THR  18   0.437  11.112   4.237
  134   3HG2  THR  18          3HG2      THR  18  -1.303  11.050   4.517
  135    H    ARG  19           H        ARG  19   0.488   8.342   3.726
  136    HA   ARG  19           HA       ARG  19  -1.010   6.094   2.980
  137   1HB   ARG  19          2HB       ARG  19  -0.739   5.463   5.317
  138   2HB   ARG  19          1HB       ARG  19   0.689   6.378   4.837
  139   1HG   ARG  19          2HG       ARG  19  -0.431   8.454   5.777
  140   2HG   ARG  19          1HG       ARG  19  -1.692   7.403   6.426
  141   1HD   ARG  19          2HD       ARG  19   1.042   6.482   7.060
  142   2HD   ARG  19          1HD       ARG  19   0.620   8.050   7.776
  143    HE   ARG  19           HE       ARG  19  -1.607   6.291   8.081
  144   1HH1  ARG  19          1HH1      ARG  19   0.644   7.863   9.872
  145   2HH1  ARG  19          2HH1      ARG  19   0.816   6.658  11.106
  146   1HH2  ARG  19          1HH2      ARG  19  -0.974   4.248   9.371
  147   2HH2  ARG  19          2HH2      ARG  19  -0.100   4.611  10.822
  148    H    SER  20           H        SER  20  -2.008   8.907   4.853
  149    HA   SER  20           HA       SER  20  -4.641   7.979   5.531
  150   1HB   SER  20          2HB       SER  20  -4.201   9.739   6.873
  151   2HB   SER  20          1HB       SER  20  -2.881  10.259   5.836
  152    HG   SER  20           HG       SER  20  -4.188  11.625   4.849
  153    H    GLN  21           H        GLN  21  -3.343   9.977   2.869
  154    HA   GLN  21           HA       GLN  21  -5.811  10.691   1.649
  155   1HB   GLN  21          2HB       GLN  21  -2.993  10.192   0.676
  156   2HB   GLN  21          1HB       GLN  21  -4.265  10.698  -0.438
  157   1HG   GLN  21          2HG       GLN  21  -4.077  12.267   2.068
  158   2HG   GLN  21          1HG       GLN  21  -2.717  12.443   0.960
  159   1HE2  GLN  21          1HE2      GLN  21  -6.217  11.948   0.261
  160   2HE2  GLN  21          2HE2      GLN  21  -6.377  13.352  -0.678
  161    H    ALA  22           H        ALA  22  -3.751   7.806   1.265
  162    HA   ALA  22           HA       ALA  22  -5.305   6.512  -0.754
  163   1HB   ALA  22          1HB       ALA  22  -3.265   5.801   1.299
  164   2HB   ALA  22          2HB       ALA  22  -3.257   5.486  -0.436
  165   3HB   ALA  22          3HB       ALA  22  -4.211   4.466   0.642
  166    H    GLU  23           H        GLU  23  -5.362   6.240   2.794
  167    HA   GLU  23           HA       GLU  23  -7.459   4.365   3.049
  168   1HB   GLU  23          2HB       GLU  23  -6.378   6.641   4.696
  169   2HB   GLU  23          1HB       GLU  23  -7.775   5.731   5.269
  170   1HG   GLU  23          2HG       GLU  23  -6.543   3.672   5.255
  171   2HG   GLU  23          1HG       GLU  23  -5.193   4.416   4.402
  172    H    GLN  24           H        GLN  24  -7.699   7.954   3.033
  173    HA   GLN  24           HA       GLN  24 -10.559   7.937   3.182
  174   1HB   GLN  24          2HB       GLN  24 -10.325  10.329   2.608
  175   2HB   GLN  24          1HB       GLN  24  -9.152   9.848   3.832
  176   1HG   GLN  24          2HG       GLN  24  -7.435   9.607   2.061
  177   2HG   GLN  24          1HG       GLN  24  -8.611  10.150   0.865
  178   1HE2  GLN  24          1HE2      GLN  24  -8.704  12.378   0.523
  179   2HE2  GLN  24          2HE2      GLN  24  -8.073  13.547   1.579
  180    H    LEU  25           H        LEU  25  -8.355   8.331   0.332
  181    HA   LEU  25           HA       LEU  25 -10.597   8.510  -1.480
  182   1HB   LEU  25          2HB       LEU  25  -8.877   8.187  -3.219
  183   2HB   LEU  25          1HB       LEU  25  -8.328   9.341  -2.010
  184    HG   LEU  25           HG       LEU  25  -7.323   7.158  -0.885
  185   1HD1  LEU  25          1HD1      LEU  25  -7.493   5.310  -2.150
  186   2HD1  LEU  25          2HD1      LEU  25  -6.557   6.108  -3.410
  187   3HD1  LEU  25          3HD1      LEU  25  -8.316   6.223  -3.413
  188   1HD2  LEU  25          1HD2      LEU  25  -5.690   7.864  -3.224
  189   2HD2  LEU  25          2HD2      LEU  25  -5.350   8.108  -1.513
  190   3HD2  LEU  25          3HD2      LEU  25  -6.335   9.275  -2.387
  191    H    LEU  26           H        LEU  26  -8.995   5.852   0.103
  192    HA   LEU  26           HA       LEU  26  -9.936   3.797  -1.756
  193   1HB   LEU  26          2HB       LEU  26  -8.541   4.000   0.869
  194   2HB   LEU  26          1HB       LEU  26  -9.445   2.520   0.594
  195    HG   LEU  26           HG       LEU  26  -7.463   3.616  -1.411
  196   1HD1  LEU  26          1HD1      LEU  26  -5.737   2.708  -0.270
  197   2HD1  LEU  26          2HD1      LEU  26  -6.633   1.222   0.040
  198   3HD1  LEU  26          3HD1      LEU  26  -6.825   2.606   1.114
  199   1HD2  LEU  26          1HD2      LEU  26  -8.224   1.928  -2.699
  200   2HD2  LEU  26          2HD2      LEU  26  -9.402   1.517  -1.453
  201   3HD2  LEU  26          3HD2      LEU  26  -7.806   0.767  -1.438
  202    H    LYS  27           H        LYS  27 -10.808   4.568   1.654
  203    HA   LYS  27           HA       LYS  27 -13.236   3.090   1.727
  204   1HB   LYS  27          2HB       LYS  27 -11.726   4.800   3.354
  205   2HB   LYS  27          1HB       LYS  27 -13.297   5.589   3.226
  206   1HG   LYS  27          2HG       LYS  27 -14.025   2.967   3.602
  207   2HG   LYS  27          1HG       LYS  27 -12.564   3.076   4.583
  208   1HD   LYS  27          2HD       LYS  27 -13.487   5.077   5.716
  209   2HD   LYS  27          1HD       LYS  27 -14.961   4.926   4.759
  210   1HE   LYS  27          2HE       LYS  27 -13.970   2.605   6.421
  211   2HE   LYS  27          1HE       LYS  27 -14.983   3.876   7.134
  212   1HZ   LYS  27          1HZ       LYS  27 -16.306   2.053   6.165
  213   2HZ   LYS  27          2HZ       LYS  27 -15.636   2.396   4.642
  214   3HZ   LYS  27          3HZ       LYS  27 -16.615   3.545   5.420
  215    H    GLN  28           H        GLN  28 -12.622   6.444   0.712
  216    HA   GLN  28           HA       GLN  28 -15.368   7.202   0.354
  217   1HB   GLN  28          2HB       GLN  28 -13.303   8.655   0.555
  218   2HB   GLN  28          1HB       GLN  28 -12.935   8.239  -1.120
  219   1HG   GLN  28          2HG       GLN  28 -15.024   9.206  -1.878
  220   2HG   GLN  28          1HG       GLN  28 -15.554   9.471  -0.218
  221   1HE2  GLN  28          1HE2      GLN  28 -15.331  11.647  -2.072
  222   2HE2  GLN  28          2HE2      GLN  28 -14.070  12.660  -1.556
  223    H    GLU  29           H        GLU  29 -12.987   5.806  -1.953
  224    HA   GLU  29           HA       GLU  29 -14.785   6.014  -4.221
  225   1HB   GLU  29          2HB       GLU  29 -12.242   5.844  -4.208
  226   2HB   GLU  29          1HB       GLU  29 -12.434   4.136  -3.829
  227   1HG   GLU  29          2HG       GLU  29 -12.126   4.697  -6.295
  228   2HG   GLU  29          1HG       GLU  29 -13.528   3.704  -5.917
  229    H    GLY  30           H        GLY  30 -14.047   3.498  -1.835
  230   1HA   GLY  30          2HA       GLY  30 -15.535   1.812  -1.099
  231   2HA   GLY  30          1HA       GLY  30 -16.610   2.245  -2.422
  232    H    LYS  31           H        LYS  31 -13.188   1.413  -2.807
  233    HA   LYS  31           HA       LYS  31 -14.028  -0.878  -4.535
  234   1HB   LYS  31          2HB       LYS  31 -11.286   0.360  -4.188
  235   2HB   LYS  31          1HB       LYS  31 -11.871  -0.597  -5.548
  236   1HG   LYS  31          2HG       LYS  31 -12.810   2.180  -4.757
  237   2HG   LYS  31          1HG       LYS  31 -11.865   1.758  -6.185
  238   1HD   LYS  31          2HD       LYS  31 -14.662   0.738  -5.606
  239   2HD   LYS  31          1HD       LYS  31 -14.284   2.064  -6.704
  240   1HE   LYS  31          2HE       LYS  31 -13.817   0.600  -8.364
  241   2HE   LYS  31          1HE       LYS  31 -12.633  -0.232  -7.338
  242   1HZ   LYS  31          1HZ       LYS  31 -15.548  -0.579  -6.957
  243   2HZ   LYS  31          2HZ       LYS  31 -14.285  -1.559  -6.383
  244   3HZ   LYS  31          3HZ       LYS  31 -14.675  -1.554  -8.035
  245    H    GLU  32           H        GLU  32 -14.230  -2.688  -3.109
  246    HA   GLU  32           HA       GLU  32 -12.512  -3.049  -0.837
  247   1HB   GLU  32          2HB       GLU  32 -13.333  -5.463  -1.019
  248   2HB   GLU  32          1HB       GLU  32 -14.577  -4.226  -0.843
  249   1HG   GLU  32          2HG       GLU  32 -13.912  -4.642  -3.647
  250   2HG   GLU  32          1HG       GLU  32 -14.408  -6.152  -2.883
  251    H    GLY  33           H        GLY  33 -10.482  -3.821  -0.737
  252   1HA   GLY  33          2HA       GLY  33  -8.560  -5.019  -1.356
  253   2HA   GLY  33          1HA       GLY  33  -9.423  -5.585  -2.788
  254    H    GLY  34           H        GLY  34  -9.672  -2.181  -2.378
  255   1HA   GLY  34          2HA       GLY  34  -8.446  -1.529  -4.818
  256   2HA   GLY  34          1HA       GLY  34  -8.622  -0.389  -3.479
  257    H    PHE  35           H        PHE  35  -6.326  -0.854  -5.363
  258    HA   PHE  35           HA       PHE  35  -4.247  -1.438  -3.271
  259   1HB   PHE  35          2HB       PHE  35  -4.712  -3.246  -4.937
  260   2HB   PHE  35          1HB       PHE  35  -4.240  -2.133  -6.218
  261    HD1  PHE  35           1HD      PHE  35  -1.895  -1.191  -6.228
  262    HD2  PHE  35           2HD      PHE  35  -3.096  -4.408  -3.652
  263    HE1  PHE  35           1HE      PHE  35   0.483  -1.826  -5.913
  264    HE2  PHE  35           2HE      PHE  35  -0.718  -5.040  -3.330
  265    HZ   PHE  35           HZ       PHE  35   1.072  -3.748  -4.461
  266    H    ILE  36           H        ILE  36  -2.859   0.253  -2.983
  267    HA   ILE  36           HA       ILE  36  -2.295   2.072  -5.304
  268    HB   ILE  36           HB       ILE  36  -2.754   2.795  -2.381
  269   1HG1  ILE  36          2HG1      ILE  36  -4.415   3.364  -4.858
  270   2HG1  ILE  36          1HG1      ILE  36  -4.841   2.231  -3.576
  271   1HG2  ILE  36          1HG2      ILE  36  -1.822   4.337  -4.784
  272   2HG2  ILE  36          2HG2      ILE  36  -1.230   4.397  -3.126
  273   3HG2  ILE  36          3HG2      ILE  36  -2.762   5.160  -3.542
  274   1HD1  ILE  36          1HD1      ILE  36  -6.027   4.263  -3.101
  275   2HD1  ILE  36          2HD1      ILE  36  -4.587   5.246  -3.364
  276   3HD1  ILE  36          3HD1      ILE  36  -4.692   4.194  -1.953
  277    H    VAL  37           H        VAL  37  -0.172   3.246  -4.963
  278    HA   VAL  37           HA       VAL  37   1.670   2.055  -2.980
  279    HB   VAL  37           HB       VAL  37   2.073   1.862  -5.983
  280   1HG1  VAL  37          1HG1      VAL  37   4.207   2.210  -4.930
  281   2HG1  VAL  37          2HG1      VAL  37   4.078   0.480  -5.247
  282   3HG1  VAL  37          3HG1      VAL  37   3.807   1.101  -3.618
  283   1HG2  VAL  37          1HG2      VAL  37   1.410  -0.170  -3.840
  284   2HG2  VAL  37          2HG2      VAL  37   2.088  -0.631  -5.401
  285   3HG2  VAL  37          3HG2      VAL  37   0.518   0.169  -5.324
  286    H    ARG  38           H        ARG  38   3.697   3.285  -2.844
  287    HA   ARG  38           HA       ARG  38   3.968   5.727  -4.476
  288   1HB   ARG  38          2HB       ARG  38   3.791   7.200  -2.472
  289   2HB   ARG  38          1HB       ARG  38   2.283   6.345  -2.796
  290   1HG   ARG  38          2HG       ARG  38   2.488   5.949  -0.523
  291   2HG   ARG  38          1HG       ARG  38   3.349   4.545  -1.154
  292   1HD   ARG  38          2HD       ARG  38   5.272   5.230  -0.170
  293   2HD   ARG  38          1HD       ARG  38   5.146   6.821  -0.949
  294    HE   ARG  38           HE       ARG  38   3.269   6.448   1.267
  295   1HH1  ARG  38          1HH1      ARG  38   6.309   6.124   1.997
  296   2HH1  ARG  38          2HH1      ARG  38   6.627   7.716   2.601
  297   1HH2  ARG  38          1HH2      ARG  38   3.714   9.077   1.300
  298   2HH2  ARG  38          2HH2      ARG  38   5.158   9.388   2.205
  299    H    ASP  39           H        ASP  39   6.041   6.754  -4.147
  300    HA   ASP  39           HA       ASP  39   8.148   4.914  -3.289
  301   1HB   ASP  39          2HB       ASP  39   7.935   6.796  -5.183
  302   2HB   ASP  39          1HB       ASP  39   8.630   7.798  -3.909
  303    H    SER  40           H        SER  40   9.777   5.481  -1.656
  304    HA   SER  40           HA       SER  40   8.612   7.046   0.612
  305   1HB   SER  40          2HB       SER  40   9.272   4.550   0.711
  306   2HB   SER  40          1HB       SER  40  10.939   5.115   0.665
  307    HG   SER  40           HG       SER  40  10.706   5.434   2.723
  308    H    SER  41           H        SER  41  11.319   7.144   1.882
  309    HA   SER  41           HA       SER  41  12.867   8.914   0.068
  310   1HB   SER  41          2HB       SER  41  11.138  10.326   1.113
  311   2HB   SER  41          1HB       SER  41  11.637   9.771   2.709
  312    HG   SER  41           HG       SER  41  12.942  11.420   2.590
  313    H    LYS  42           H        LYS  42  12.610   7.982   3.530
  314    HA   LYS  42           HA       LYS  42  15.352   8.175   4.193
  315   1HB   LYS  42          2HB       LYS  42  13.155   6.311   5.149
  316   2HB   LYS  42          1HB       LYS  42  14.691   6.531   5.988
  317   1HG   LYS  42          2HG       LYS  42  14.230   8.839   6.421
  318   2HG   LYS  42          1HG       LYS  42  12.857   8.840   5.314
  319   1HD   LYS  42          2HD       LYS  42  11.591   7.388   6.770
  320   2HD   LYS  42          1HD       LYS  42  12.991   7.134   7.813
  321   1HE   LYS  42          2HE       LYS  42  12.860   9.844   7.890
  322   2HE   LYS  42          1HE       LYS  42  11.142   9.455   7.679
  323   1HZ   LYS  42          1HZ       LYS  42  11.737   9.385  10.019
  324   2HZ   LYS  42          2HZ       LYS  42  12.964   8.254   9.698
  325   3HZ   LYS  42          3HZ       LYS  42  11.334   7.832   9.471
  326    H    ALA  43           H        ALA  43  13.682   5.055   3.655
  327    HA   ALA  43           HA       ALA  43  16.231   3.766   2.913
  328   1HB   ALA  43          1HB       ALA  43  13.519   3.054   3.778
  329   2HB   ALA  43          2HB       ALA  43  15.029   2.172   4.007
  330   3HB   ALA  43          3HB       ALA  43  14.122   1.993   2.505
  331    H    GLY  44           H        GLY  44  13.581   5.293   1.318
  332   1HA   GLY  44          2HA       GLY  44  13.199   5.618  -0.988
  333   2HA   GLY  44          1HA       GLY  44  14.705   4.740  -1.310
  334    H    LYS  45           H        LYS  45  12.219   3.426   0.754
  335    HA   LYS  45           HA       LYS  45  11.963   1.091  -1.017
  336   1HB   LYS  45          2HB       LYS  45  10.817   0.147   0.932
  337   2HB   LYS  45          1HB       LYS  45  12.308   0.936   1.443
  338   1HG   LYS  45          2HG       LYS  45  10.549   3.018   1.610
  339   2HG   LYS  45          1HG       LYS  45   9.498   1.662   2.017
  340   1HD   LYS  45          2HD       LYS  45  10.591   1.225   3.976
  341   2HD   LYS  45          1HD       LYS  45  12.167   1.654   3.311
  342   1HE   LYS  45          2HE       LYS  45  11.770   3.994   3.609
  343   2HE   LYS  45          1HE       LYS  45  10.041   3.731   3.914
  344   1HZ   LYS  45          1HZ       LYS  45  11.111   3.948   6.019
  345   2HZ   LYS  45          2HZ       LYS  45  12.320   2.832   5.594
  346   3HZ   LYS  45          3HZ       LYS  45  10.719   2.310   5.823
  347    H    TYR  46           H        TYR  46   9.514   0.212  -1.028
  348    HA   TYR  46           HA       TYR  46   7.805   2.495  -1.964
  349   1HB   TYR  46          2HB       TYR  46   7.712  -0.453  -2.690
  350   2HB   TYR  46          1HB       TYR  46   6.802   0.839  -3.463
  351    HD1  TYR  46           1HD      TYR  46   9.380   2.773  -3.153
  352    HD2  TYR  46           2HD      TYR  46   8.647  -1.069  -4.927
  353    HE1  TYR  46           1HE      TYR  46  11.252   3.145  -4.729
  354    HE2  TYR  46           2HE      TYR  46  10.521  -0.695  -6.502
  355    HH   TYR  46           HH       TYR  46  12.860   1.158  -6.172
  356    H    THR  47           H        THR  47   5.502   2.356  -1.457
  357    HA   THR  47           HA       THR  47   4.853   0.538   0.843
  358    HB   THR  47           HB       THR  47   4.171   3.469   0.415
  359    HG1  THR  47           1HG      THR  47   6.236   3.193   1.186
  360   1HG2  THR  47          1HG2      THR  47   2.887   1.408   2.027
  361   2HG2  THR  47          2HG2      THR  47   2.377   3.070   1.731
  362   3HG2  THR  47          3HG2      THR  47   3.511   2.715   3.033
  363    H    VAL  48           H        VAL  48   2.989  -0.626   0.512
  364    HA   VAL  48           HA       VAL  48   1.311   0.097  -1.864
  365    HB   VAL  48           HB       VAL  48   1.712  -2.435  -0.247
  366   1HG1  VAL  48          1HG1      VAL  48  -0.004  -1.921  -2.690
  367   2HG1  VAL  48          2HG1      VAL  48  -0.580  -2.364  -1.084
  368   3HG1  VAL  48          3HG1      VAL  48   0.356  -3.518  -2.033
  369   1HG2  VAL  48          1HG2      VAL  48   2.586  -1.528  -3.000
  370   2HG2  VAL  48          2HG2      VAL  48   2.666  -3.209  -2.470
  371   3HG2  VAL  48          3HG2      VAL  48   3.616  -1.976  -1.640
  372    H    SER  49           H        SER  49  -0.624   1.077  -1.419
  373    HA   SER  49           HA       SER  49  -1.834   0.737   1.299
  374   1HB   SER  49          2HB       SER  49  -1.620   2.857  -0.755
  375   2HB   SER  49          1HB       SER  49  -3.187   2.755   0.042
  376    HG   SER  49           HG       SER  49  -0.651   3.322   1.096
  377    H    VAL  50           H        VAL  50  -3.420  -0.861   1.289
  378    HA   VAL  50           HA       VAL  50  -5.253  -0.918  -1.093
  379    HB   VAL  50           HB       VAL  50  -5.357  -3.388  -0.685
  380   1HG1  VAL  50          1HG1      VAL  50  -2.670  -3.577  -1.117
  381   2HG1  VAL  50          2HG1      VAL  50  -2.948  -1.876  -1.492
  382   3HG1  VAL  50          3HG1      VAL  50  -3.839  -3.126  -2.358
  383   1HG2  VAL  50          1HG2      VAL  50  -4.025  -4.440   0.939
  384   2HG2  VAL  50          2HG2      VAL  50  -4.592  -3.004   1.785
  385   3HG2  VAL  50          3HG2      VAL  50  -2.965  -3.044   1.111
  386    H    PHE  51           H        PHE  51  -7.520  -1.193  -0.603
  387    HA   PHE  51           HA       PHE  51  -8.179  -1.447   2.316
  388   1HB   PHE  51          2HB       PHE  51  -8.674   0.755   2.265
  389   2HB   PHE  51          1HB       PHE  51  -8.487   0.817   0.523
  390    HD1  PHE  51           1HD      PHE  51 -10.805   0.912   3.248
  391    HD2  PHE  51           2HD      PHE  51 -10.465  -0.052  -0.922
  392    HE1  PHE  51           1HE      PHE  51 -13.257   1.118   3.002
  393    HE2  PHE  51           2HE      PHE  51 -12.923   0.150  -1.161
  394    HZ   PHE  51           HZ       PHE  51 -14.320   0.733   0.799
  395    H    ALA  52           H        ALA  52 -10.359  -2.249   2.739
  396    HA   ALA  52           HA       ALA  52 -11.942  -3.177   0.426
  397   1HB   ALA  52          1HB       ALA  52 -11.033  -5.161   2.494
  398   2HB   ALA  52          2HB       ALA  52 -10.106  -4.862   1.023
  399   3HB   ALA  52          3HB       ALA  52 -11.754  -5.481   0.917
  400    H    LYS  53           H        LYS  53 -14.046  -4.047   1.062
  401    HA   LYS  53           HA       LYS  53 -14.967  -2.973   3.712
  402   1HB   LYS  53          2HB       LYS  53 -16.142  -3.282   0.958
  403   2HB   LYS  53          1HB       LYS  53 -17.211  -3.156   2.356
  404   1HG   LYS  53          2HG       LYS  53 -15.527  -1.118   2.905
  405   2HG   LYS  53          1HG       LYS  53 -15.431  -1.106   1.143
  406   1HD   LYS  53          2HD       LYS  53 -17.910  -1.030   1.029
  407   2HD   LYS  53          1HD       LYS  53 -17.973  -0.968   2.791
  408   1HE   LYS  53          2HE       LYS  53 -17.730   1.281   2.691
  409   2HE   LYS  53          1HE       LYS  53 -16.144   1.057   1.925
  410   1HZ   LYS  53          1HZ       LYS  53 -17.768   2.274   0.513
  411   2HZ   LYS  53          2HZ       LYS  53 -18.729   0.874   0.473
  412   3HZ   LYS  53          3HZ       LYS  53 -17.171   0.859  -0.204
  413    H    SER  54           H        SER  54 -13.782  -5.503   3.820
  414    HA   SER  54           HA       SER  54 -16.055  -7.184   4.638
  415   1HB   SER  54          2HB       SER  54 -15.781  -7.480   2.150
  416   2HB   SER  54          1HB       SER  54 -14.155  -8.087   2.451
  417    HG   SER  54           HG       SER  54 -15.724  -9.764   2.305
  418    H    THR  55           H        THR  55 -14.456  -6.436   6.512
  419    HA   THR  55           HA       THR  55 -12.890  -8.778   7.292
  420    HB   THR  55           HB       THR  55 -11.160  -6.424   7.349
  421    HG1  THR  55           1HG      THR  55 -10.908  -6.149   5.217
  422   1HG2  THR  55          1HG2      THR  55  -9.754  -8.219   6.009
  423   2HG2  THR  55          2HG2      THR  55 -11.020  -9.304   6.584
  424   3HG2  THR  55          3HG2      THR  55 -10.039  -8.403   7.740
  425    H    GLY  56           H        GLY  56 -11.245  -7.002   9.136
  426   1HA   GLY  56          2HA       GLY  56 -12.878  -6.937  11.415
  427   2HA   GLY  56          1HA       GLY  56 -11.505  -5.846  11.183
  428    H    ASP  57           H        ASP  57 -12.635  -4.689   8.749
  429    HA   ASP  57           HA       ASP  57 -14.834  -3.027   9.921
  430   1HB   ASP  57          2HB       ASP  57 -12.301  -2.279   9.245
  431   2HB   ASP  57          1HB       ASP  57 -13.127  -2.037   7.708
  432    HA   PRO  58           HA       PRO  58 -16.455  -5.609   6.385
  433   1HB   PRO  58          2HB       PRO  58 -19.039  -4.863   7.412
  434   2HB   PRO  58          1HB       PRO  58 -18.272  -6.453   7.412
  435   1HG   PRO  58          2HG       PRO  58 -18.645  -4.637   9.629
  436   2HG   PRO  58          1HG       PRO  58 -17.997  -6.280   9.653
  437   1HD   PRO  58          2HD       PRO  58 -16.542  -3.888  10.084
  438   2HD   PRO  58          1HD       PRO  58 -15.854  -5.512   9.830
  439    H    GLN  59           H        GLN  59 -17.012  -2.330   7.413
  440    HA   GLN  59           HA       GLN  59 -18.257  -1.709   4.767
  441   1HB   GLN  59          2HB       GLN  59 -18.892   0.433   6.035
  442   2HB   GLN  59          1HB       GLN  59 -19.646  -1.060   6.593
  443   1HG   GLN  59          2HG       GLN  59 -18.392  -1.138   8.530
  444   2HG   GLN  59          1HG       GLN  59 -17.036  -0.268   7.813
  445   1HE2  GLN  59          1HE2      GLN  59 -17.242   1.075   9.900
  446   2HE2  GLN  59          2HE2      GLN  59 -18.352   2.360   9.903
  447    H    GLY  60           H        GLY  60 -15.196  -1.666   6.044
  448   1HA   GLY  60          2HA       GLY  60 -14.075  -0.107   4.031
  449   2HA   GLY  60          1HA       GLY  60 -14.395   1.015   5.345
  450    H    VAL  61           H        VAL  61 -12.234  -1.329   4.133
  451    HA   VAL  61           HA       VAL  61 -10.657  -1.234   6.688
  452    HB   VAL  61           HB       VAL  61 -10.811  -3.394   4.555
  453   1HG1  VAL  61          1HG1      VAL  61  -9.620  -4.626   6.589
  454   2HG1  VAL  61          2HG1      VAL  61  -9.096  -2.983   6.964
  455   3HG1  VAL  61          3HG1      VAL  61  -8.691  -3.704   5.405
  456   1HG2  VAL  61          1HG2      VAL  61 -12.056  -4.692   6.124
  457   2HG2  VAL  61          2HG2      VAL  61 -12.817  -3.104   6.068
  458   3HG2  VAL  61          3HG2      VAL  61 -11.763  -3.526   7.415
  459    H    ILE  62           H        ILE  62  -8.488  -0.778   6.475
  460    HA   ILE  62           HA       ILE  62  -7.338  -0.453   3.753
  461    HB   ILE  62           HB       ILE  62  -6.791   1.775   5.605
  462   1HG1  ILE  62          2HG1      ILE  62  -9.598   1.285   4.565
  463   2HG1  ILE  62          1HG1      ILE  62  -9.118   1.346   6.248
  464   1HG2  ILE  62          1HG2      ILE  62  -6.325   2.697   3.603
  465   2HG2  ILE  62          2HG2      ILE  62  -8.001   2.499   3.099
  466   3HG2  ILE  62          3HG2      ILE  62  -6.837   1.207   2.817
  467   1HD1  ILE  62          1HD1      ILE  62  -9.008   3.609   6.287
  468   2HD1  ILE  62          2HD1      ILE  62 -10.134   3.461   4.937
  469   3HD1  ILE  62          3HD1      ILE  62  -8.417   3.715   4.630
  470    H    ARG  63           H        ARG  63  -4.990  -0.258   3.794
  471    HA   ARG  63           HA       ARG  63  -3.467  -0.430   6.261
  472   1HB   ARG  63          2HB       ARG  63  -4.762  -2.742   5.535
  473   2HB   ARG  63          1HB       ARG  63  -3.198  -2.958   4.751
  474   1HG   ARG  63          2HG       ARG  63  -2.181  -3.364   6.722
  475   2HG   ARG  63          1HG       ARG  63  -2.867  -1.908   7.440
  476   1HD   ARG  63          2HD       ARG  63  -4.053  -3.367   8.742
  477   2HD   ARG  63          1HD       ARG  63  -5.066  -3.582   7.301
  478    HE   ARG  63           HE       ARG  63  -3.114  -5.333   6.730
  479   1HH1  ARG  63          1HH2      ARG  63  -5.701  -6.172   8.143
  480   2HH1  ARG  63          2HH2      ARG  63  -5.066  -7.098   9.462
  481   1HH2  ARG  63          1HH1      ARG  63  -1.839  -5.875   9.115
  482   2HH2  ARG  63          2HH1      ARG  63  -2.880  -6.930  10.012
  483    H    HIS  64           H        HIS  64  -1.394   0.261   5.750
  484    HA   HIS  64           HA       HIS  64  -0.673   0.343   2.853
  485   1HB   HIS  64          2HB       HIS  64   1.007   1.730   4.868
  486   2HB   HIS  64          1HB       HIS  64   0.408   2.311   3.318
  487    HD1  HIS  64           1HD      HIS  64  -1.893   3.481   3.284
  488    HD2  HIS  64           2HD      HIS  64  -0.759   2.173   7.076
  489    HE1  HIS  64           1HE      HIS  64  -3.463   4.593   4.925
  490    H    TYR  65           H        TYR  65   0.360  -1.607   2.411
  491    HA   TYR  65           HA       TYR  65   2.252  -2.823   4.303
  492   1HB   TYR  65          2HB       TYR  65   1.854  -3.370   1.357
  493   2HB   TYR  65          1HB       TYR  65   2.465  -4.478   2.580
  494    HD1  TYR  65           1HD      TYR  65  -0.048  -4.618   0.591
  495    HD2  TYR  65           2HD      TYR  65   0.452  -3.797   4.779
  496    HE1  TYR  65           1HE      TYR  65  -2.344  -5.434   1.028
  497    HE2  TYR  65           2HE      TYR  65  -1.846  -4.612   5.213
  498    HH   TYR  65           HH       TYR  65  -3.525  -6.483   3.296
  499    H    VAL  66           H        VAL  66   4.330  -2.088   4.451
  500    HA   VAL  66           HA       VAL  66   5.443  -0.607   2.096
  501    HB   VAL  66           HB       VAL  66   6.223  -0.391   5.018
  502   1HG1  VAL  66          1HG1      VAL  66   6.863   1.144   2.497
  503   2HG1  VAL  66          2HG1      VAL  66   7.979   0.459   3.678
  504   3HG1  VAL  66          3HG1      VAL  66   7.033   1.890   4.086
  505   1HG2  VAL  66          1HG2      VAL  66   4.893   1.951   4.234
  506   2HG2  VAL  66          2HG2      VAL  66   4.261   0.705   5.309
  507   3HG2  VAL  66          3HG2      VAL  66   3.901   0.646   3.585
  508    H    VAL  67           H        VAL  67   7.886  -0.744   1.985
  509    HA   VAL  67           HA       VAL  67   8.760  -3.522   2.675
  510    HB   VAL  67           HB       VAL  67   9.563  -1.611   0.464
  511   1HG1  VAL  67          1HG1      VAL  67  10.374  -4.321   0.018
  512   2HG1  VAL  67          2HG1      VAL  67  10.952  -3.826   1.610
  513   3HG1  VAL  67          3HG1      VAL  67  11.388  -2.888   0.183
  514   1HG2  VAL  67          1HG2      VAL  67   7.649  -2.426  -0.452
  515   2HG2  VAL  67          2HG2      VAL  67   7.520  -3.710   0.749
  516   3HG2  VAL  67          3HG2      VAL  67   8.553  -3.925  -0.664
  517    H    CYS  68           H        CYS  68  10.346  -3.630   4.177
  518    HA   CYS  68           HA       CYS  68  11.832  -1.193   4.943
  519   1HB   CYS  68          2HB       CYS  68  10.759  -2.820   6.564
  520   2HB   CYS  68          1HB       CYS  68  11.941  -4.021   6.043
  521    HG   CYS  68           HG       CYS  68  13.575  -1.725   6.816
  522    H    SER  69           H        SER  69  14.086  -1.001   4.627
  523    HA   SER  69           HA       SER  69  15.336  -3.119   2.924
  524   1HB   SER  69          2HB       SER  69  15.912  -0.152   2.940
  525   2HB   SER  69          1HB       SER  69  16.353  -1.331   1.709
  526    HG   SER  69           HG       SER  69  14.547  -0.387   0.936
  527    H    THR  70           H        THR  70  17.369  -3.799   3.490
  528    HA   THR  70           HA       THR  70  18.576  -2.642   5.974
  529    HB   THR  70           HB       THR  70  17.859  -5.038   5.945
  530    HG1  THR  70           1HG      THR  70  20.675  -4.955   5.913
  531   1HG2  THR  70          1HG2      THR  70  18.465  -6.507   4.323
  532   2HG2  THR  70          2HG2      THR  70  20.081  -5.823   4.169
  533   3HG2  THR  70          3HG2      THR  70  18.721  -5.051   3.362
  534    HA   PRO  71           HA       PRO  71  21.925  -1.048   3.632
  535   1HB   PRO  71          2HB       PRO  71  23.984  -1.942   5.430
  536   2HB   PRO  71          1HB       PRO  71  23.265  -0.334   5.304
  537   1HG   PRO  71          2HG       PRO  71  22.901  -2.239   7.400
  538   2HG   PRO  71          1HG       PRO  71  22.125  -0.662   7.231
  539   1HD   PRO  71          2HD       PRO  71  20.948  -3.288   6.884
  540   2HD   PRO  71          1HD       PRO  71  20.142  -1.704   6.810
  541    H    GLN  72           H        GLN  72  21.505  -4.348   3.892
  542    HA   GLN  72           HA       GLN  72  24.050  -5.036   2.520
  543   1HB   GLN  72          2HB       GLN  72  23.190  -6.445   4.348
  544   2HB   GLN  72          1HB       GLN  72  21.668  -6.651   3.493
  545   1HG   GLN  72          2HG       GLN  72  23.183  -8.608   3.221
  546   2HG   GLN  72          1HG       GLN  72  22.799  -7.842   1.683
  547   1HE2  GLN  72          1HE2      GLN  72  24.558  -7.120   0.430
  548   2HE2  GLN  72          2HE2      GLN  72  26.161  -7.053   0.982
  549    H    SER  73           H        SER  73  21.767  -3.345   1.355
  550    HA   SER  73           HA       SER  73  20.740  -3.094  -0.756
  551   1HB   SER  73          2HB       SER  73  23.157  -4.326  -1.131
  552   2HB   SER  73          1HB       SER  73  22.067  -5.520  -1.832
  553    HG   SER  73           HG       SER  73  21.162  -3.764  -3.061
  554    H    GLN  74           H        GLN  74  19.263  -4.433   1.167
  555    HA   GLN  74           HA       GLN  74  17.856  -6.521  -0.451
  556   1HB   GLN  74          2HB       GLN  74  18.013  -6.833   2.500
  557   2HB   GLN  74          1HB       GLN  74  18.090  -8.063   1.244
  558   1HG   GLN  74          2HG       GLN  74  20.393  -7.009   0.666
  559   2HG   GLN  74          1HG       GLN  74  20.294  -6.279   2.266
  560   1HE2  GLN  74          1HE2      GLN  74  20.180  -7.802   4.145
  561   2HE2  GLN  74          2HE2      GLN  74  20.748  -9.393   3.980
  562    H    TYR  75           H        TYR  75  15.595  -6.923   0.476
  563    HA   TYR  75           HA       TYR  75  14.460  -4.578   1.945
  564   1HB   TYR  75          2HB       TYR  75  13.383  -5.599  -0.690
  565   2HB   TYR  75          1HB       TYR  75  12.850  -4.174   0.188
  566    HD1  TYR  75           1HD      TYR  75  13.983  -2.092  -0.009
  567    HD2  TYR  75           2HD      TYR  75  15.692  -5.655  -1.674
  568    HE1  TYR  75           1HE      TYR  75  15.678  -0.731  -1.188
  569    HE2  TYR  75           2HE      TYR  75  17.392  -4.300  -2.849
  570    HH   TYR  75           HH       TYR  75  17.148  -0.906  -3.143
  571    H    TYR  76           H        TYR  76  12.270  -4.987   2.749
  572    HA   TYR  76           HA       TYR  76  10.829  -7.444   2.393
  573   1HB   TYR  76          2HB       TYR  76  11.433  -8.521   4.570
  574   2HB   TYR  76          1HB       TYR  76  12.818  -8.406   3.493
  575    HD1  TYR  76           1HD      TYR  76  14.734  -7.042   4.069
  576    HD2  TYR  76           2HD      TYR  76  11.158  -6.879   6.431
  577    HE1  TYR  76           1HE      TYR  76  15.948  -5.801   5.829
  578    HE2  TYR  76           2HE      TYR  76  12.366  -5.638   8.191
  579    HH   TYR  76           HH       TYR  76  14.320  -4.278   8.464
  580    H    LEU  77           H        LEU  77   8.995  -7.608   3.903
  581    HA   LEU  77           HA       LEU  77   8.304  -4.990   5.191
  582   1HB   LEU  77          2HB       LEU  77   6.868  -6.410   3.460
  583   2HB   LEU  77          1HB       LEU  77   6.466  -7.366   4.887
  584    HG   LEU  77           HG       LEU  77   6.277  -4.432   5.243
  585   1HD1  LEU  77          1HD1      LEU  77   5.364  -5.076   2.866
  586   2HD1  LEU  77          2HD1      LEU  77   4.381  -4.061   3.922
  587   3HD1  LEU  77          3HD1      LEU  77   4.027  -5.782   3.773
  588   1HD2  LEU  77          1HD2      LEU  77   4.559  -5.019   6.712
  589   2HD2  LEU  77          2HD2      LEU  77   5.585  -6.451   6.789
  590   3HD2  LEU  77          3HD2      LEU  77   4.131  -6.462   5.792
  591    H    ALA  78           H        ALA  78   9.641  -7.943   5.758
  592    HA   ALA  78           HA       ALA  78   9.511  -7.732   8.673
  593   1HB   ALA  78          1HB       ALA  78   8.872 -10.379   8.384
  594   2HB   ALA  78          2HB       ALA  78   7.987  -9.691   7.023
  595   3HB   ALA  78          3HB       ALA  78   7.663  -9.126   8.662
  596    H    GLU  79           H        GLU  79  11.671  -8.064   9.160
  597    HA   GLU  79           HA       GLU  79  13.704  -8.756   7.400
  598   1HB   GLU  79          2HB       GLU  79  13.279  -8.889  10.355
  599   2HB   GLU  79          1HB       GLU  79  14.734  -9.653   9.712
  600   1HG   GLU  79          2HG       GLU  79  15.171  -7.496   8.448
  601   2HG   GLU  79          1HG       GLU  79  13.877  -6.770   9.403
  602    H    LYS  80           H        LYS  80  11.388 -10.896   8.799
  603    HA   LYS  80           HA       LYS  80  12.539 -13.403   8.977
  604   1HB   LYS  80          2HB       LYS  80   9.962 -12.260   8.074
  605   2HB   LYS  80          1HB       LYS  80  10.249 -13.932   7.586
  606   1HG   LYS  80          2HG       LYS  80  10.827 -13.151  10.421
  607   2HG   LYS  80          1HG       LYS  80   9.148 -13.387   9.938
  608   1HD   LYS  80          2HD       LYS  80  11.064 -15.476   9.050
  609   2HD   LYS  80          1HD       LYS  80  10.729 -15.414  10.781
  610   1HE   LYS  80          2HE       LYS  80   8.306 -15.560  10.335
  611   2HE   LYS  80          1HE       LYS  80   8.629 -15.603   8.590
  612   1HZ   LYS  80          1HZ       LYS  80  10.110 -17.530   9.026
  613   2HZ   LYS  80          2HZ       LYS  80   8.474 -17.846   9.359
  614   3HZ   LYS  80          3HZ       LYS  80   9.561 -17.550  10.630
  615    H    HIS  81           H        HIS  81  11.754 -11.657   5.976
  616    HA   HIS  81           HA       HIS  81  13.697 -13.321   4.487
  617   1HB   HIS  81          2HB       HIS  81  10.706 -13.254   4.012
  618   2HB   HIS  81          1HB       HIS  81  11.844 -13.763   2.764
  619    HD1  HIS  81           1HD      HIS  81  13.743 -15.584   3.986
  620    HD2  HIS  81           2HD      HIS  81   9.799 -15.492   5.332
  621    HE1  HIS  81           1HE      HIS  81  13.334 -17.792   5.157
  622    H    LEU  82           H        LEU  82  14.562 -12.092   2.754
  623    HA   LEU  82           HA       LEU  82  13.121  -9.635   1.951
  624   1HB   LEU  82          2HB       LEU  82  15.024  -8.241   2.605
  625   2HB   LEU  82          1HB       LEU  82  14.471  -9.166   3.997
  626    HG   LEU  82           HG       LEU  82  16.696 -10.117   2.208
  627   1HD1  LEU  82          1HD1      LEU  82  17.417  -8.989   4.835
  628   2HD1  LEU  82          2HD1      LEU  82  16.825  -7.797   3.678
  629   3HD1  LEU  82          3HD1      LEU  82  18.214  -8.803   3.275
  630   1HD2  LEU  82          1HD2      LEU  82  17.114 -11.007   4.800
  631   2HD2  LEU  82          2HD2      LEU  82  16.356 -11.950   3.517
  632   3HD2  LEU  82          3HD2      LEU  82  15.356 -11.049   4.656
  633    H    PHE  83           H        PHE  83  13.650  -8.959  -0.122
  634    HA   PHE  83           HA       PHE  83  15.627 -10.645  -1.612
  635   1HB   PHE  83          2HB       PHE  83  12.967  -9.389  -2.205
  636   2HB   PHE  83          1HB       PHE  83  14.096  -9.628  -3.542
  637    HD1  PHE  83           1HD      PHE  83  14.060 -11.673  -4.653
  638    HD2  PHE  83           2HD      PHE  83  12.766 -11.489  -0.562
  639    HE1  PHE  83           1HE      PHE  83  13.468 -14.081  -4.733
  640    HE2  PHE  83           2HE      PHE  83  12.174 -13.896  -0.640
  641    HZ   PHE  83           HZ       PHE  83  12.525 -15.192  -2.725
  642    H    SER  84           H        SER  84  15.799  -8.912  -3.879
  643    HA   SER  84           HA       SER  84  17.405  -6.702  -2.674
  644   1HB   SER  84          2HB       SER  84  18.464  -6.724  -4.944
  645   2HB   SER  84          1HB       SER  84  18.542  -8.288  -4.139
  646    HG   SER  84           HG       SER  84  17.391  -7.637  -6.468
  647    H    THR  85           H        THR  85  14.301  -6.928  -3.630
  648    HA   THR  85           HA       THR  85  14.109  -4.092  -4.314
  649    HB   THR  85           HB       THR  85  13.175  -6.022  -6.444
  650    HG1  THR  85           1HG      THR  85  15.113  -6.166  -7.244
  651   1HG2  THR  85          1HG2      THR  85  14.174  -3.500  -7.365
  652   2HG2  THR  85          2HG2      THR  85  13.064  -3.217  -6.023
  653   3HG2  THR  85          3HG2      THR  85  12.528  -4.124  -7.437
  654    H    ILE  86           H        ILE  86  11.787  -3.419  -4.515
  655    HA   ILE  86           HA       ILE  86  10.060  -4.872  -2.723
  656    HB   ILE  86           HB       ILE  86   9.870  -2.502  -4.551
  657   1HG1  ILE  86          2HG1      ILE  86   8.995  -1.779  -2.071
  658   2HG1  ILE  86          1HG1      ILE  86  10.075  -3.110  -1.668
  659   1HG2  ILE  86          1HG2      ILE  86   7.671  -3.282  -4.883
  660   2HG2  ILE  86          2HG2      ILE  86   7.504  -2.230  -3.478
  661   3HG2  ILE  86          3HG2      ILE  86   7.577  -3.978  -3.265
  662   1HD1  ILE  86          1HD1      ILE  86  11.674  -1.482  -1.758
  663   2HD1  ILE  86          2HD1      ILE  86  10.704  -0.448  -2.808
  664   3HD1  ILE  86          3HD1      ILE  86  11.600  -1.805  -3.490
  665    HA   PRO  87           HA       PRO  87   7.502  -5.932  -6.766
  666   1HB   PRO  87          2HB       PRO  87   9.455  -6.100  -8.878
  667   2HB   PRO  87          1HB       PRO  87   8.038  -5.050  -8.785
  668   1HG   PRO  87          2HG       PRO  87  10.825  -4.344  -8.444
  669   2HG   PRO  87          1HG       PRO  87   9.418  -3.278  -8.500
  670   1HD   PRO  87          2HD       PRO  87  10.991  -3.871  -6.220
  671   2HD   PRO  87          1HD       PRO  87   9.428  -3.022  -6.233
  672    H    GLU  88           H        GLU  88  10.902  -6.828  -6.341
  673    HA   GLU  88           HA       GLU  88  10.636  -9.578  -7.204
  674   1HB   GLU  88          2HB       GLU  88  12.730  -8.115  -6.923
  675   2HB   GLU  88          1HB       GLU  88  12.590  -8.429  -5.193
  676   1HG   GLU  88          2HG       GLU  88  14.107 -10.069  -6.127
  677   2HG   GLU  88          1HG       GLU  88  12.603 -10.892  -5.712
  678    H    LEU  89           H        LEU  89  10.495  -7.931  -4.049
  679    HA   LEU  89           HA       LEU  89  10.168 -10.211  -2.373
  680   1HB   LEU  89          2HB       LEU  89   9.849  -7.307  -2.303
  681   2HB   LEU  89          1HB       LEU  89   8.648  -8.113  -1.295
  682    HG   LEU  89           HG       LEU  89  11.380  -9.207  -1.051
  683   1HD1  LEU  89          1HD1      LEU  89  12.490  -7.337  -0.444
  684   2HD1  LEU  89          2HD1      LEU  89  11.166  -6.815   0.596
  685   3HD1  LEU  89          3HD1      LEU  89  11.151  -6.410  -1.119
  686   1HD2  LEU  89          1HD2      LEU  89  10.736  -9.446   1.216
  687   2HD2  LEU  89          2HD2      LEU  89   9.236  -9.692   0.322
  688   3HD2  LEU  89          3HD2      LEU  89   9.552  -8.144   1.105
  689    H    ILE  90           H        ILE  90   7.632  -8.046  -3.706
  690    HA   ILE  90           HA       ILE  90   5.391  -9.581  -2.844
  691    HB   ILE  90           HB       ILE  90   5.771  -7.777  -5.259
  692   1HG1  ILE  90          2HG1      ILE  90   4.454  -6.886  -2.735
  693   2HG1  ILE  90          1HG1      ILE  90   6.209  -7.063  -2.704
  694   1HG2  ILE  90          1HG2      ILE  90   3.319  -7.411  -5.035
  695   2HG2  ILE  90          2HG2      ILE  90   3.271  -8.647  -3.778
  696   3HG2  ILE  90          3HG2      ILE  90   3.708  -9.085  -5.429
  697   1HD1  ILE  90          1HD1      ILE  90   6.315  -5.651  -4.786
  698   2HD1  ILE  90          2HD1      ILE  90   5.704  -4.792  -3.373
  699   3HD1  ILE  90          3HD1      ILE  90   4.584  -5.358  -4.610
  700    H    ASN  91           H        ASN  91   7.429  -9.837  -5.731
  701    HA   ASN  91           HA       ASN  91   5.772 -11.620  -7.244
  702   1HB   ASN  91          2HB       ASN  91   7.777 -10.271  -7.991
  703   2HB   ASN  91          1HB       ASN  91   8.798 -11.448  -7.165
  704   1HD2  ASN  91          1HD2      ASN  91   9.671 -11.920  -9.410
  705   2HD2  ASN  91          2HD2      ASN  91   8.801 -12.976 -10.415
  706    H    TYR  92           H        TYR  92   8.762 -12.461  -5.442
  707    HA   TYR  92           HA       TYR  92   8.327 -15.277  -5.495
  708   1HB   TYR  92          2HB       TYR  92  10.316 -15.287  -4.345
  709   2HB   TYR  92          1HB       TYR  92  10.328 -13.584  -4.794
  710    HD1  TYR  92           1HD      TYR  92   9.929 -11.843  -3.148
  711    HD2  TYR  92           2HD      TYR  92   9.650 -15.987  -2.076
  712    HE1  TYR  92           1HE      TYR  92   9.908 -11.223  -0.746
  713    HE2  TYR  92           2HE      TYR  92   9.629 -15.370   0.324
  714    HH   TYR  92           HH       TYR  92  10.659 -12.721   1.544
  715    H    HIS  93           H        HIS  93   6.963 -12.794  -3.454
  716    HA   HIS  93           HA       HIS  93   6.244 -14.319  -1.159
  717   1HB   HIS  93          2HB       HIS  93   6.130 -11.837  -1.462
  718   2HB   HIS  93          1HB       HIS  93   4.744 -12.062  -2.528
  719    HD1  HIS  93           1HD      HIS  93   3.882 -10.468  -0.295
  720    HD2  HIS  93           2HD      HIS  93   4.218 -14.598   0.160
  721    HE1  HIS  93           1HE      HIS  93   2.450 -11.088   1.699
  722    H    GLN  94           H        GLN  94   4.380 -13.688  -4.156
  723    HA   GLN  94           HA       GLN  94   2.753 -16.130  -3.529
  724   1HB   GLN  94          2HB       GLN  94   1.925 -13.491  -3.427
  725   2HB   GLN  94          1HB       GLN  94   1.428 -13.984  -5.047
  726   1HG   GLN  94          2HG       GLN  94   0.837 -15.675  -2.613
  727   2HG   GLN  94          1HG       GLN  94  -0.257 -14.401  -3.154
  728   1HE2  GLN  94          1HE2      GLN  94   0.663 -17.679  -3.672
  729   2HE2  GLN  94          2HE2      GLN  94  -0.232 -17.939  -5.090
  730    H    HIS  95           H        HIS  95   3.760 -13.849  -6.097
  731    HA   HIS  95           HA       HIS  95   3.089 -15.735  -8.238
  732   1HB   HIS  95          2HB       HIS  95   4.569 -13.088  -8.106
  733   2HB   HIS  95          1HB       HIS  95   4.167 -13.914  -9.612
  734    HD1  HIS  95           1HD      HIS  95   2.476 -12.372  -6.579
  735    HD2  HIS  95           2HD      HIS  95   1.540 -13.531 -10.473
  736    HE1  HIS  95           1HE      HIS  95   0.120 -11.553  -7.023
  737    H    ASN  96           H        ASN  96   4.490 -17.542  -7.425
  738    HA   ASN  96           HA       ASN  96   7.329 -17.173  -8.312
  739   1HB   ASN  96          2HB       ASN  96   7.078 -17.104  -5.836
  740   2HB   ASN  96          1HB       ASN  96   6.308 -18.691  -5.889
  741   1HD2  ASN  96          1HD2      ASN  96   9.226 -17.369  -7.561
  742   2HD2  ASN  96          2HD2      ASN  96  10.260 -18.612  -7.044
  743    H    SER  97           H        SER  97   5.053 -19.742  -7.252
  744    HA   SER  97           HA       SER  97   6.213 -21.599  -9.249
  745   1HB   SER  97          2HB       SER  97   5.334 -21.877  -6.695
  746   2HB   SER  97          1HB       SER  97   3.870 -22.322  -7.568
  747    HG   SER  97           HG       SER  97   6.455 -23.389  -8.074
  748    H    ALA  98           H        ALA  98   3.257 -19.762  -8.651
  749    HA   ALA  98           HA       ALA  98   1.626 -21.077 -10.650
  750   1HB   ALA  98          1HB       ALA  98   0.660 -19.821  -8.816
  751   2HB   ALA  98          2HB       ALA  98   0.248 -18.981 -10.310
  752   3HB   ALA  98          3HB       ALA  98   1.545 -18.369  -9.285
  753    H    GLY  99           H        GLY  99   3.002 -17.761 -10.685
  754   1HA   GLY  99          2HA       GLY  99   4.488 -17.612 -12.920
  755   2HA   GLY  99          1HA       GLY  99   2.885 -17.778 -13.639
  756    H    LEU 100           H        LEU 100   2.361 -15.763 -14.373
  757    HA   LEU 100           HA       LEU 100   2.190 -13.567 -12.382
  758   1HB   LEU 100          2HB       LEU 100   4.427 -13.829 -13.914
  759   2HB   LEU 100          1HB       LEU 100   3.428 -12.839 -14.980
  760    HG   LEU 100           HG       LEU 100   2.990 -11.530 -12.676
  761   1HD1  LEU 100          1HD1      LEU 100   5.888 -12.260 -12.365
  762   2HD1  LEU 100          2HD1      LEU 100   4.651 -13.288 -11.641
  763   3HD1  LEU 100          3HD1      LEU 100   4.774 -11.593 -11.171
  764   1HD2  LEU 100          1HD2      LEU 100   5.593 -11.045 -14.115
  765   2HD2  LEU 100          2HD2      LEU 100   4.425  -9.866 -13.519
  766   3HD2  LEU 100          3HD2      LEU 100   4.057 -10.822 -14.954
  767    H    ILE 101           H        ILE 101  -0.128 -13.887 -12.765
  768    HA   ILE 101           HA       ILE 101  -1.050 -12.942 -15.460
  769    HB   ILE 101           HB       ILE 101  -2.361 -14.732 -13.385
  770   1HG1  ILE 101          2HG1      ILE 101  -1.733 -15.648 -16.147
  771   2HG1  ILE 101          1HG1      ILE 101  -0.358 -15.428 -15.064
  772   1HG2  ILE 101          1HG2      ILE 101  -3.332 -13.437 -15.892
  773   2HG2  ILE 101          2HG2      ILE 101  -4.218 -13.844 -14.422
  774   3HG2  ILE 101          3HG2      ILE 101  -3.832 -15.103 -15.596
  775   1HD1  ILE 101          1HD1      ILE 101  -2.775 -16.901 -14.069
  776   2HD1  ILE 101          2HD1      ILE 101  -1.087 -17.070 -13.583
  777   3HD1  ILE 101          3HD1      ILE 101  -1.633 -17.738 -15.121
  778    H    SER 102           H        SER 102  -2.166 -13.036 -12.047
  779    HA   SER 102           HA       SER 102  -3.027 -10.181 -12.349
  780   1HB   SER 102          2HB       SER 102  -4.705 -12.342 -12.374
  781   2HB   SER 102          1HB       SER 102  -4.670 -11.968 -10.654
  782    HG   SER 102           HG       SER 102  -5.963 -10.389 -11.119
  783    H    ARG 103           H        ARG 103  -1.747  -9.097 -10.893
  784    HA   ARG 103           HA       ARG 103  -1.195 -10.395  -8.245
  785   1HB   ARG 103          2HB       ARG 103   0.734  -9.926  -9.750
  786   2HB   ARG 103          1HB       ARG 103   0.292  -8.218  -9.749
  787   1HG   ARG 103          2HG       ARG 103   0.986  -7.895  -7.573
  788   2HG   ARG 103          1HG       ARG 103   0.628  -9.557  -7.102
  789   1HD   ARG 103          2HD       ARG 103   2.925  -9.754  -7.189
  790   2HD   ARG 103          1HD       ARG 103   2.615  -9.988  -8.921
  791    HE   ARG 103           HE       ARG 103   3.105  -7.259  -7.789
  792   1HH1  ARG 103          1HH2      ARG 103   2.386  -7.808 -10.713
  793   2HH1  ARG 103          2HH2      ARG 103   3.948  -7.729 -11.456
  794   1HH2  ARG 103          1HH1      ARG 103   5.677  -8.004  -8.463
  795   2HH2  ARG 103          2HH1      ARG 103   5.812  -7.839 -10.183
  796    H    LEU 104           H        LEU 104  -1.584  -7.130  -9.686
  797    HA   LEU 104           HA       LEU 104  -2.239  -5.860  -7.173
  798   1HB   LEU 104          2HB       LEU 104  -1.282  -4.795  -9.239
  799   2HB   LEU 104          1HB       LEU 104  -2.848  -5.011 -10.022
  800    HG   LEU 104           HG       LEU 104  -2.741  -3.640  -7.359
  801   1HD1  LEU 104          1HD1      LEU 104  -1.898  -1.669  -8.161
  802   2HD1  LEU 104          2HD1      LEU 104  -2.557  -1.926  -9.776
  803   3HD1  LEU 104          3HD1      LEU 104  -1.070  -2.740  -9.291
  804   1HD2  LEU 104          1HD2      LEU 104  -4.691  -4.214  -9.344
  805   2HD2  LEU 104          2HD2      LEU 104  -4.441  -2.469  -9.373
  806   3HD2  LEU 104          3HD2      LEU 104  -4.904  -3.269  -7.871
  807    H    LYS 105           H        LYS 105  -4.361  -5.017  -6.561
  808    HA   LYS 105           HA       LYS 105  -6.569  -6.830  -7.358
  809   1HB   LYS 105          2HB       LYS 105  -5.946  -4.929  -5.120
  810   2HB   LYS 105          1HB       LYS 105  -7.624  -5.392  -5.408
  811   1HG   LYS 105          2HG       LYS 105  -6.767  -6.976  -3.833
  812   2HG   LYS 105          1HG       LYS 105  -6.831  -7.813  -5.384
  813   1HD   LYS 105          2HD       LYS 105  -4.478  -7.556  -5.728
  814   2HD   LYS 105          1HD       LYS 105  -4.342  -6.406  -4.397
  815   1HE   LYS 105          2HE       LYS 105  -4.267  -8.060  -2.817
  816   2HE   LYS 105          1HE       LYS 105  -5.480  -9.046  -3.659
  817   1HZ   LYS 105          1HZ       LYS 105  -2.621  -8.711  -4.387
  818   2HZ   LYS 105          2HZ       LYS 105  -3.768  -9.458  -5.395
  819   3HZ   LYS 105          3HZ       LYS 105  -3.387 -10.138  -3.885
  820    H    TYR 106           H        TYR 106  -6.961  -3.414  -6.400
  821    HA   TYR 106           HA       TYR 106  -8.213  -2.926  -9.084
  822   1HB   TYR 106          2HB       TYR 106  -9.717  -3.305  -7.029
  823   2HB   TYR 106          1HB       TYR 106  -9.127  -1.745  -6.460
  824    HD1  TYR 106           1HD      TYR 106  -9.104   0.144  -8.387
  825    HD2  TYR 106           2HD      TYR 106 -11.679  -3.287  -8.261
  826    HE1  TYR 106           1HE      TYR 106 -10.710   1.301  -9.878
  827    HE2  TYR 106           2HE      TYR 106 -13.291  -2.132  -9.754
  828    HH   TYR 106           HH       TYR 106 -13.068   1.217 -10.456
  829    HA   PRO 107           HA       PRO 107  -5.122   0.369  -8.909
  830   1HB   PRO 107          2HB       PRO 107  -6.105   1.297 -11.439
  831   2HB   PRO 107          1HB       PRO 107  -4.626   0.392 -11.113
  832   1HG   PRO 107          2HG       PRO 107  -6.967  -0.551 -12.440
  833   2HG   PRO 107          1HG       PRO 107  -5.526  -1.480 -12.016
  834   1HD   PRO 107          2HD       PRO 107  -8.171  -1.580 -10.793
  835   2HD   PRO 107          1HD       PRO 107  -6.764  -2.629 -10.484
  836    H    VAL 108           H        VAL 108  -6.798   1.146  -7.187
  837    HA   VAL 108           HA       VAL 108  -8.246   3.542  -8.247
  838    HB   VAL 108           HB       VAL 108  -9.669   1.703  -7.412
  839   1HG1  VAL 108          1HG1      VAL 108  -9.076   1.949  -4.594
  840   2HG1  VAL 108          2HG1      VAL 108  -7.639   1.433  -5.476
  841   3HG1  VAL 108          3HG1      VAL 108  -9.128   0.498  -5.594
  842   1HG2  VAL 108          1HG2      VAL 108  -9.505   4.321  -5.982
  843   2HG2  VAL 108          2HG2      VAL 108 -10.648   3.117  -5.385
  844   3HG2  VAL 108          3HG2      VAL 108 -10.768   3.700  -7.045
  845    H    SER 109           H        SER 109  -6.327   4.882  -7.881
  846    HA   SER 109           HA       SER 109  -5.353   5.033  -5.088
  847   1HB   SER 109          2HB       SER 109  -4.408   6.273  -7.682
  848   2HB   SER 109          1HB       SER 109  -3.566   6.402  -6.136
  849    HG   SER 109           HG       SER 109  -3.208   4.236  -6.151
  850    H    GLN 110           H        GLN 110  -4.574   7.943  -5.930
  851    HA   GLN 110           HA       GLN 110  -6.294   9.385  -4.351
  852   1HB   GLN 110          2HB       GLN 110  -5.593  11.332  -5.790
  853   2HB   GLN 110          1HB       GLN 110  -4.257  10.285  -5.317
  854   1HG   GLN 110          2HG       GLN 110  -4.712   9.051  -7.555
  855   2HG   GLN 110          1HG       GLN 110  -5.618  10.499  -7.996
  856   1HE2  GLN 110          1HE2      GLN 110  -2.465   9.884  -6.328
  857   2HE2  GLN 110          2HE2      GLN 110  -1.592  10.999  -7.264
  858    H    GLN 111           H        GLN 111  -6.743   8.850  -7.871
  859    HA   GLN 111           HA       GLN 111  -8.650   9.238  -9.233
  860   1HB   GLN 111          2HB       GLN 111  -9.512   7.826  -6.710
  861   2HB   GLN 111          1HB       GLN 111 -10.640   8.078  -8.045
  862   1HG   GLN 111          2HG       GLN 111  -8.422   7.122  -9.359
  863   2HG   GLN 111          1HG       GLN 111  -8.357   6.226  -7.841
  864   1HE2  GLN 111          1HE2      GLN 111 -11.232   6.111  -7.376
  865   2HE2  GLN 111          2HE2      GLN 111 -11.894   5.084  -8.553
  866    H    ASN 112           H        ASN 112 -11.322   9.745  -8.496
  867    HA   ASN 112           HA       ASN 112 -11.177  12.373  -7.113
  868   1HB   ASN 112          2HB       ASN 112 -12.762  13.181  -8.852
  869   2HB   ASN 112          1HB       ASN 112 -11.243  12.629  -9.556
  870   1HD2  ASN 112          1HD2      ASN 112 -13.350  12.631 -11.304
  871   2HD2  ASN 112          2HD2      ASN 112 -13.928  11.058 -11.575
  872    H    LYS 113           H        LYS 113 -12.420   9.330  -6.917
  873    HA   LYS 113           HA       LYS 113 -14.286   8.377  -5.825
  874   1HB   LYS 113          2HB       LYS 113 -14.592  11.081  -4.514
  875   2HB   LYS 113          1HB       LYS 113 -14.823   9.486  -3.805
  876   1HG   LYS 113          2HG       LYS 113 -12.171  10.699  -4.644
  877   2HG   LYS 113          1HG       LYS 113 -12.731  10.471  -2.990
  878   1HD   LYS 113          2HD       LYS 113 -12.103   8.303  -2.977
  879   2HD   LYS 113          1HD       LYS 113 -12.869   7.996  -4.536
  880   1HE   LYS 113          2HE       LYS 113 -10.911   9.032  -5.681
  881   2HE   LYS 113          1HE       LYS 113 -10.131   9.239  -4.102
  882   1HZ   LYS 113          1HZ       LYS 113  -9.383   7.167  -4.866
  883   2HZ   LYS 113          2HZ       LYS 113 -10.916   6.717  -5.442
  884   3HZ   LYS 113          3HZ       LYS 113 -10.619   6.786  -3.772
  885    H    ASN 114           H        ASN 114 -15.479   8.484  -7.954
  886    HA   ASN 114           HA       ASN 114 -17.984   9.998  -7.642
  887   1HB   ASN 114          2HB       ASN 114 -15.770  11.026  -9.093
  888   2HB   ASN 114          1HB       ASN 114 -16.993  10.560 -10.272
  889   1HD2  ASN 114          1HD2      ASN 114 -18.752  11.970 -10.530
  890   2HD2  ASN 114          2HD2      ASN 114 -19.102  13.266  -9.491
  891    H    ALA 115           H        ALA 115 -16.004   8.124  -9.968
  892    HA   ALA 115           HA       ALA 115 -16.616   6.367 -11.427
  893   1HB   ALA 115          1HB       ALA 115 -16.964   5.064  -9.515
  894   2HB   ALA 115          2HB       ALA 115 -18.545   4.968 -10.291
  895   3HB   ALA 115          3HB       ALA 115 -18.290   6.079  -8.946
  896    HA   PRO 116           HA       PRO 116 -20.126   9.082 -12.984
  897   1HB   PRO 116          2HB       PRO 116 -18.763   9.023 -15.518
  898   2HB   PRO 116          1HB       PRO 116 -19.007  10.404 -14.444
  899   1HG   PRO 116          2HG       PRO 116 -16.567   8.977 -14.957
  900   2HG   PRO 116          1HG       PRO 116 -16.812  10.368 -13.897
  901   1HD   PRO 116          2HD       PRO 116 -16.301   7.641 -13.129
  902   2HD   PRO 116          1HD       PRO 116 -16.592   9.036 -12.061
  903    H    SER 117           H        SER 117 -21.750   7.545 -13.197
  904    HA   SER 117           HA       SER 117 -21.347   5.304 -15.137
  905   1HB   SER 117          2HB       SER 117 -21.910   4.603 -12.902
  906   2HB   SER 117          1HB       SER 117 -23.202   5.795 -12.790
  907    HG   SER 117           HG       SER 117 -23.073   3.410 -14.289
  908    H    THR 118           H        THR 118 -23.493   4.699 -16.289
  909    HA   THR 118           HA       THR 118 -24.381   6.886 -17.908
  910    HB   THR 118           HB       THR 118 -24.390   4.542 -18.618
  911    HG1  THR 118           1HG      THR 118 -26.007   5.080 -19.811
  912   1HG2  THR 118          1HG2      THR 118 -26.344   3.129 -17.610
  913   2HG2  THR 118          2HG2      THR 118 -26.237   4.258 -16.261
  914   3HG2  THR 118          3HG2      THR 118 -24.842   3.275 -16.700
  Start of MODEL    7
    1    H    THR   1           1H       THR   1  22.770  -5.884  -7.419
    2    HA   THR   1           HA       THR   1  21.682  -3.926  -6.531
    3    HB   THR   1           HB       THR   1  22.625  -2.568  -9.063
    4    HG1  THR   1           1HG      THR   1  23.809  -2.593  -6.487
    5   1HG2  THR   1          1HG2      THR   1  21.702  -1.481  -6.392
    6   2HG2  THR   1          2HG2      THR   1  20.669  -1.644  -7.812
    7   3HG2  THR   1          3HG2      THR   1  22.048  -0.544  -7.846
    8    H    GLU   2           H        GLU   2  19.547  -4.364  -6.894
    9    HA   GLU   2           HA       GLU   2  18.700  -5.186  -9.642
   10   1HB   GLU   2          2HB       GLU   2  17.860  -5.758  -6.822
   11   2HB   GLU   2          1HB       GLU   2  16.656  -5.910  -8.101
   12   1HG   GLU   2          2HG       GLU   2  17.497  -8.011  -8.334
   13   2HG   GLU   2          1HG       GLU   2  18.783  -7.204  -9.231
   14    H    ALA   3           H        ALA   3  16.708  -4.280 -10.491
   15    HA   ALA   3           HA       ALA   3  15.652  -1.856  -9.100
   16   1HB   ALA   3          1HB       ALA   3  16.209  -0.455 -10.880
   17   2HB   ALA   3          2HB       ALA   3  16.253  -1.783 -12.040
   18   3HB   ALA   3          3HB       ALA   3  17.580  -1.564 -10.900
   19    H    GLU   4           H        GLU   4  13.983  -1.010 -11.176
   20    HA   GLU   4           HA       GLU   4  12.451  -3.147 -12.379
   21   1HB   GLU   4          2HB       GLU   4  10.507  -2.949 -10.787
   22   2HB   GLU   4          1HB       GLU   4  11.948  -3.646 -10.048
   23   1HG   GLU   4          2HG       GLU   4  11.654  -2.064  -8.443
   24   2HG   GLU   4          1HG       GLU   4  12.348  -0.956  -9.624
   25    H    ASP   5           H        ASP   5  10.131  -2.200 -12.935
   26    HA   ASP   5           HA       ASP   5   9.807   0.677 -12.991
   27   1HB   ASP   5          2HB       ASP   5  10.247   0.925 -15.438
   28   2HB   ASP   5          1HB       ASP   5  11.693   0.453 -14.548
   29    H    SER   6           H        SER   6   7.785   1.265 -14.026
   30    HA   SER   6           HA       SER   6   6.144  -0.953 -15.146
   31   1HB   SER   6          2HB       SER   6   5.342   0.797 -12.800
   32   2HB   SER   6          1HB       SER   6   4.368  -0.483 -13.518
   33    HG   SER   6           HG       SER   6   6.684  -0.635 -11.943
   34    H    ILE   7           H        ILE   7   5.085  -0.167 -16.923
   35    HA   ILE   7           HA       ILE   7   4.686   2.797 -17.129
   36    HB   ILE   7           HB       ILE   7   6.254   1.644 -18.720
   37   1HG1  ILE   7          2HG1      ILE   7   4.784   2.433 -20.824
   38   2HG1  ILE   7          1HG1      ILE   7   3.812   3.146 -19.537
   39   1HG2  ILE   7          1HG2      ILE   7   5.345   0.149 -20.414
   40   2HG2  ILE   7          2HG2      ILE   7   3.722   0.329 -19.748
   41   3HG2  ILE   7          3HG2      ILE   7   4.970  -0.502 -18.820
   42   1HD1  ILE   7          1HD1      ILE   7   5.921   4.178 -18.620
   43   2HD1  ILE   7          2HD1      ILE   7   5.458   4.785 -20.210
   44   3HD1  ILE   7          3HD1      ILE   7   6.761   3.606 -20.061
   45    H    GLU   8           H        GLU   8   3.164  -0.371 -17.702
   46    HA   GLU   8           HA       GLU   8   0.685   0.570 -18.757
   47   1HB   GLU   8          2HB       GLU   8   1.362  -1.875 -17.088
   48   2HB   GLU   8          1HB       GLU   8  -0.084  -1.693 -18.082
   49   1HG   GLU   8          2HG       GLU   8   1.041  -2.133 -20.002
   50   2HG   GLU   8          1HG       GLU   8   2.416  -1.135 -19.529
   51    H    MET   9           H        MET   9  -1.308  -0.405 -17.108
   52    HA   MET   9           HA       MET   9  -2.697   0.266 -15.321
   53   1HB   MET   9          2HB       MET   9   0.019   0.454 -13.982
   54   2HB   MET   9          1HB       MET   9  -1.529   0.239 -13.168
   55   1HG   MET   9          2HG       MET   9  -0.514  -1.707 -15.248
   56   2HG   MET   9          1HG       MET   9  -0.154  -1.887 -13.531
   57   1HE   MET   9          1HE       MET   9  -3.523  -3.124 -15.958
   58   2HE   MET   9          2HE       MET   9  -2.190  -2.044 -16.357
   59   3HE   MET   9          3HE       MET   9  -3.731  -1.372 -15.832
   60    H    TYR  10           H        TYR  10  -2.862   2.145 -13.556
   61    HA   TYR  10           HA       TYR  10  -1.423   4.587 -13.939
   62   1HB   TYR  10          2HB       TYR  10  -3.203   5.800 -15.236
   63   2HB   TYR  10          1HB       TYR  10  -2.424   4.518 -16.161
   64    HD1  TYR  10           1HD      TYR  10  -3.628   2.542 -16.836
   65    HD2  TYR  10           2HD      TYR  10  -5.474   5.455 -14.274
   66    HE1  TYR  10           1HE      TYR  10  -5.829   1.456 -17.186
   67    HE2  TYR  10           2HE      TYR  10  -7.675   4.368 -14.624
   68    HH   TYR  10           HH       TYR  10  -8.181   1.984 -17.046
   69    H    GLU  11           H        GLU  11  -2.898   2.904 -11.845
   70    HA   GLU  11           HA       GLU  11  -4.365   5.203 -10.631
   71   1HB   GLU  11          2HB       GLU  11  -5.587   2.955 -11.712
   72   2HB   GLU  11          1HB       GLU  11  -5.497   2.579  -9.994
   73   1HG   GLU  11          2HG       GLU  11  -7.418   3.790  -9.896
   74   2HG   GLU  11          1HG       GLU  11  -6.308   5.158  -9.871
   75    H    TRP  12           H        TRP  12  -3.723   1.826  -9.669
   76    HA   TRP  12           HA       TRP  12  -3.306   2.339  -6.953
   77   1HB   TRP  12          2HB       TRP  12  -2.260   0.133  -6.935
   78   2HB   TRP  12          1HB       TRP  12  -3.620   0.131  -8.051
   79    HD1  TRP  12           HD       TRP  12  -3.152  -0.503 -10.491
   80    HE1  TRP  12           1HE      TRP  12  -1.029  -1.061 -11.841
   81    HE3  TRP  12           3HE      TRP  12   0.428   0.809  -7.099
   82    HZ2  TRP  12           2HZ      TRP  12   1.811  -0.960 -11.530
   83    HZ3  TRP  12           3HZ      TRP  12   2.833   0.568  -7.650
   84    HH2  TRP  12           HH       TRP  12   3.528  -0.314  -9.859
   85    H    TYR  13           H        TYR  13  -1.127   2.986  -9.601
   86    HA   TYR  13           HA       TYR  13   1.259   3.123  -7.882
   87   1HB   TYR  13          2HB       TYR  13   1.176   2.480 -10.337
   88   2HB   TYR  13          1HB       TYR  13   0.811   4.170 -10.696
   89    HD1  TYR  13           1HD      TYR  13   3.139   2.529  -8.251
   90    HD2  TYR  13           2HD      TYR  13   2.708   5.218 -11.573
   91    HE1  TYR  13           1HE      TYR  13   5.549   3.086  -8.110
   92    HE2  TYR  13           2HE      TYR  13   5.121   5.773 -11.433
   93    HH   TYR  13           HH       TYR  13   7.332   3.962  -9.835
   94    H    SER  14           H        SER  14   1.924   4.953  -6.789
   95    HA   SER  14           HA       SER  14   0.826   7.604  -7.624
   96   1HB   SER  14          2HB       SER  14   0.864   6.627  -4.764
   97   2HB   SER  14          1HB       SER  14   0.028   8.034  -5.413
   98    HG   SER  14           HG       SER  14  -1.105   5.843  -5.039
   99    H    LYS  15           H        LYS  15   2.376   9.183  -7.507
  100    HA   LYS  15           HA       LYS  15   5.070   8.483  -6.571
  101   1HB   LYS  15          2HB       LYS  15   3.754  10.350  -8.364
  102   2HB   LYS  15          1HB       LYS  15   4.923  11.186  -7.343
  103   1HG   LYS  15          2HG       LYS  15   5.883  10.274  -9.497
  104   2HG   LYS  15          1HG       LYS  15   6.701   9.716  -8.038
  105   1HD   LYS  15          2HD       LYS  15   4.455   7.992  -8.766
  106   2HD   LYS  15          1HD       LYS  15   5.660   8.091 -10.049
  107   1HE   LYS  15          2HE       LYS  15   7.109   6.804  -8.873
  108   2HE   LYS  15          1HE       LYS  15   6.929   7.826  -7.436
  109   1HZ   LYS  15          1HZ       LYS  15   5.219   6.585  -6.639
  110   2HZ   LYS  15          2HZ       LYS  15   6.006   5.359  -7.509
  111   3HZ   LYS  15          3HZ       LYS  15   4.655   6.141  -8.176
  112    H    HIS  16           H        HIS  16   5.452   8.644  -4.422
  113    HA   HIS  16           HA       HIS  16   5.610   9.551  -2.263
  114   1HB   HIS  16          2HB       HIS  16   5.052  12.042  -3.899
  115   2HB   HIS  16          1HB       HIS  16   5.636  12.047  -2.237
  116    HD1  HIS  16           1HD      HIS  16   7.059  12.728  -5.245
  117    HD2  HIS  16           2HD      HIS  16   7.999   9.803  -2.428
  118    HE1  HIS  16           1HE      HIS  16   9.463  12.061  -5.680
  119    H    MET  17           H        MET  17   3.120   8.389  -2.815
  120    HA   MET  17           HA       MET  17   0.957  10.235  -2.093
  121   1HB   MET  17          2HB       MET  17   0.657   8.278  -3.566
  122   2HB   MET  17          1HB       MET  17   1.151   7.207  -2.256
  123   1HG   MET  17          2HG       MET  17  -1.027   9.068  -1.547
  124   2HG   MET  17          1HG       MET  17  -1.450   7.896  -2.795
  125   1HE   MET  17          1HE       MET  17  -0.199   5.771  -2.735
  126   2HE   MET  17          2HE       MET  17  -1.409   4.796  -1.905
  127   3HE   MET  17          3HE       MET  17   0.248   4.828  -1.306
  128    H    THR  18           H        THR  18  -0.113  10.252  -0.033
  129    HA   THR  18           HA       THR  18   1.621   9.488   2.237
  130    HB   THR  18           HB       THR  18  -1.079  10.831   2.336
  131    HG1  THR  18           1HG      THR  18   1.431  11.986   1.697
  132   1HG2  THR  18          1HG2      THR  18   0.482  10.121   4.354
  133   2HG2  THR  18          2HG2      THR  18  -0.361  11.670   4.372
  134   3HG2  THR  18          3HG2      THR  18   1.342  11.597   3.919
  135    H    ARG  19           H        ARG  19   1.154   7.860   3.676
  136    HA   ARG  19           HA       ARG  19  -0.482   5.654   3.097
  137   1HB   ARG  19          2HB       ARG  19  -0.106   5.095   5.446
  138   2HB   ARG  19          1HB       ARG  19   1.341   5.887   4.823
  139   1HG   ARG  19          2HG       ARG  19   0.403   8.077   5.728
  140   2HG   ARG  19          1HG       ARG  19  -0.833   7.120   6.548
  141   1HD   ARG  19          2HD       ARG  19   0.640   6.358   8.127
  142   2HD   ARG  19          1HD       ARG  19   1.953   6.169   6.947
  143    HE   ARG  19           HE       ARG  19   2.572   8.436   7.321
  144   1HH1  ARG  19          1HH1      ARG  19   0.675   7.441   9.815
  145   2HH1  ARG  19          2HH1      ARG  19   0.041   8.998  10.230
  146   1HH2  ARG  19          1HH2      ARG  19   1.265  10.551   7.382
  147   2HH2  ARG  19          2HH2      ARG  19   0.375  10.759   8.852
  148    H    SER  20           H        SER  20  -1.235   8.574   4.923
  149    HA   SER  20           HA       SER  20  -3.873   7.763   5.768
  150   1HB   SER  20          2HB       SER  20  -3.248   9.482   7.098
  151   2HB   SER  20          1HB       SER  20  -1.985   9.962   5.975
  152    HG   SER  20           HG       SER  20  -3.249  11.500   5.304
  153    H    GLN  21           H        GLN  21  -2.601   9.685   3.044
  154    HA   GLN  21           HA       GLN  21  -5.107  10.524   1.963
  155   1HB   GLN  21          2HB       GLN  21  -2.347   9.971   0.857
  156   2HB   GLN  21          1HB       GLN  21  -3.652  10.542  -0.187
  157   1HG   GLN  21          2HG       GLN  21  -3.277  12.031   2.355
  158   2HG   GLN  21          1HG       GLN  21  -1.999  12.216   1.155
  159   1HE2  GLN  21          1HE2      GLN  21  -5.450  11.661   0.411
  160   2HE2  GLN  21          2HE2      GLN  21  -5.693  13.160  -0.346
  161    H    ALA  22           H        ALA  22  -3.159   7.580   1.481
  162    HA   ALA  22           HA       ALA  22  -4.842   6.384  -0.504
  163   1HB   ALA  22          1HB       ALA  22  -2.990   5.067  -0.380
  164   2HB   ALA  22          2HB       ALA  22  -3.710   4.341   1.057
  165   3HB   ALA  22          3HB       ALA  22  -2.589   5.693   1.219
  166    H    GLU  23           H        GLU  23  -4.786   6.201   3.048
  167    HA   GLU  23           HA       GLU  23  -6.894   4.345   3.444
  168   1HB   GLU  23          2HB       GLU  23  -5.710   6.669   4.936
  169   2HB   GLU  23          1HB       GLU  23  -7.159   5.896   5.578
  170   1HG   GLU  23          2HG       GLU  23  -5.567   3.736   4.934
  171   2HG   GLU  23          1HG       GLU  23  -4.393   4.920   5.509
  172    H    GLN  24           H        GLN  24  -7.124   7.930   3.473
  173    HA   GLN  24           HA       GLN  24  -9.967   7.980   3.593
  174   1HB   GLN  24          2HB       GLN  24  -9.665  10.357   2.948
  175   2HB   GLN  24          1HB       GLN  24  -8.518   9.867   4.192
  176   1HG   GLN  24          2HG       GLN  24  -6.815   9.484   2.402
  177   2HG   GLN  24          1HG       GLN  24  -7.963  10.120   1.225
  178   1HE2  GLN  24          1HE2      GLN  24  -6.105  11.021   4.147
  179   2HE2  GLN  24          2HE2      GLN  24  -6.147  12.692   3.853
  180    H    LEU  25           H        LEU  25  -7.793   8.263   0.705
  181    HA   LEU  25           HA       LEU  25 -10.081   8.452  -1.052
  182   1HB   LEU  25          2HB       LEU  25  -8.439   8.177  -2.838
  183   2HB   LEU  25          1HB       LEU  25  -7.799   9.266  -1.615
  184    HG   LEU  25           HG       LEU  25  -6.793   7.024  -0.618
  185   1HD1  LEU  25          1HD1      LEU  25  -6.802   5.211  -1.972
  186   2HD1  LEU  25          2HD1      LEU  25  -6.352   6.168  -3.380
  187   3HD1  LEU  25          3HD1      LEU  25  -8.045   6.041  -2.904
  188   1HD2  LEU  25          1HD2      LEU  25  -5.175   7.641  -2.937
  189   2HD2  LEU  25          2HD2      LEU  25  -4.888   8.071  -1.253
  190   3HD2  LEU  25          3HD2      LEU  25  -5.858   9.125  -2.277
  191    H    LEU  26           H        LEU  26  -8.340   5.783   0.414
  192    HA   LEU  26           HA       LEU  26  -9.370   3.721  -1.361
  193   1HB   LEU  26          2HB       LEU  26  -7.989   3.933   1.279
  194   2HB   LEU  26          1HB       LEU  26  -8.870   2.450   0.971
  195    HG   LEU  26           HG       LEU  26  -6.821   3.612  -0.931
  196   1HD1  LEU  26          1HD1      LEU  26  -6.263   2.479   1.514
  197   2HD1  LEU  26          2HD1      LEU  26  -5.172   2.472   0.132
  198   3HD1  LEU  26          3HD1      LEU  26  -6.207   1.080   0.441
  199   1HD2  LEU  26          1HD2      LEU  26  -8.803   1.918  -1.570
  200   2HD2  LEU  26          2HD2      LEU  26  -7.659   0.745  -0.918
  201   3HD2  LEU  26          3HD2      LEU  26  -7.195   1.770  -2.275
  202    H    LYS  27           H        LYS  27 -10.221   4.651   2.007
  203    HA   LYS  27           HA       LYS  27 -12.619   3.197   2.299
  204   1HB   LYS  27          2HB       LYS  27 -11.440   4.493   4.044
  205   2HB   LYS  27          1HB       LYS  27 -11.888   5.992   3.233
  206   1HG   LYS  27          2HG       LYS  27 -13.469   5.666   5.016
  207   2HG   LYS  27          1HG       LYS  27 -14.311   5.301   3.510
  208   1HD   LYS  27          2HD       LYS  27 -14.216   2.975   3.879
  209   2HD   LYS  27          1HD       LYS  27 -12.935   3.129   5.081
  210   1HE   LYS  27          2HE       LYS  27 -14.761   2.833   6.499
  211   2HE   LYS  27          1HE       LYS  27 -14.820   4.597   6.321
  212   1HZ   LYS  27          1HZ       LYS  27 -16.238   2.650   4.582
  213   2HZ   LYS  27          2HZ       LYS  27 -16.301   4.342   4.442
  214   3HZ   LYS  27          3HZ       LYS  27 -16.966   3.574   5.803
  215    H    GLN  28           H        GLN  28 -12.239   6.551   1.140
  216    HA   GLN  28           HA       GLN  28 -14.975   7.023   0.504
  217   1HB   GLN  28          2HB       GLN  28 -12.840   8.539   0.699
  218   2HB   GLN  28          1HB       GLN  28 -12.696   8.237  -1.031
  219   1HG   GLN  28          2HG       GLN  28 -14.508   9.526  -1.530
  220   2HG   GLN  28          1HG       GLN  28 -15.420   8.948  -0.136
  221   1HE2  GLN  28          1HE2      GLN  28 -13.860  11.676  -1.369
  222   2HE2  GLN  28          2HE2      GLN  28 -13.639  12.523   0.084
  223    H    GLU  29           H        GLU  29 -12.364   5.631  -1.526
  224    HA   GLU  29           HA       GLU  29 -13.748   5.638  -4.020
  225   1HB   GLU  29          2HB       GLU  29 -11.296   5.011  -3.359
  226   2HB   GLU  29          1HB       GLU  29 -11.940   3.391  -3.102
  227   1HG   GLU  29          2HG       GLU  29 -11.407   3.185  -5.325
  228   2HG   GLU  29          1HG       GLU  29 -13.002   3.908  -5.529
  229    H    GLY  30           H        GLY  30 -13.863   3.433  -1.260
  230   1HA   GLY  30          2HA       GLY  30 -15.518   1.906  -0.628
  231   2HA   GLY  30          1HA       GLY  30 -16.517   2.587  -1.908
  232    H    LYS  31           H        LYS  31 -13.354   1.204  -2.478
  233    HA   LYS  31           HA       LYS  31 -14.624  -0.918  -4.161
  234   1HB   LYS  31          2HB       LYS  31 -11.741   0.005  -4.134
  235   2HB   LYS  31          1HB       LYS  31 -12.609  -0.797  -5.443
  236   1HG   LYS  31          2HG       LYS  31 -13.171   2.000  -4.404
  237   2HG   LYS  31          1HG       LYS  31 -12.355   1.612  -5.911
  238   1HD   LYS  31          2HD       LYS  31 -14.860   0.187  -5.777
  239   2HD   LYS  31          1HD       LYS  31 -15.137   1.905  -5.495
  240   1HE   LYS  31          2HE       LYS  31 -15.189   1.875  -7.823
  241   2HE   LYS  31          1HE       LYS  31 -13.448   2.122  -7.575
  242   1HZ   LYS  31          1HZ       LYS  31 -14.802  -0.511  -7.848
  243   2HZ   LYS  31          2HZ       LYS  31 -13.140  -0.276  -7.588
  244   3HZ   LYS  31          3HZ       LYS  31 -13.856   0.234  -9.042
  245    H    GLU  32           H        GLU  32 -14.776  -2.826  -2.928
  246    HA   GLU  32           HA       GLU  32 -13.140  -3.467  -0.699
  247   1HB   GLU  32          2HB       GLU  32 -13.914  -5.832  -1.204
  248   2HB   GLU  32          1HB       GLU  32 -15.186  -4.628  -1.012
  249   1HG   GLU  32          2HG       GLU  32 -14.271  -4.752  -3.774
  250   2HG   GLU  32          1HG       GLU  32 -14.817  -6.332  -3.214
  251    H    GLY  33           H        GLY  33 -10.937  -3.098  -1.221
  252   1HA   GLY  33          2HA       GLY  33  -8.973  -4.568  -1.580
  253   2HA   GLY  33          1HA       GLY  33  -9.770  -5.111  -3.054
  254    H    GLY  34           H        GLY  34  -9.851  -1.702  -2.202
  255   1HA   GLY  34          2HA       GLY  34  -8.739  -0.923  -4.718
  256   2HA   GLY  34          1HA       GLY  34  -8.901   0.144  -3.316
  257    H    PHE  35           H        PHE  35  -6.765  -1.803  -5.157
  258    HA   PHE  35           HA       PHE  35  -4.606  -1.823  -3.154
  259   1HB   PHE  35          2HB       PHE  35  -5.123  -3.707  -4.678
  260   2HB   PHE  35          1HB       PHE  35  -4.784  -2.671  -6.063
  261    HD1  PHE  35           1HD      PHE  35  -2.460  -1.710  -6.348
  262    HD2  PHE  35           2HD      PHE  35  -3.365  -4.774  -3.478
  263    HE1  PHE  35           1HE      PHE  35  -0.049  -2.270  -6.186
  264    HE2  PHE  35           2HE      PHE  35  -0.956  -5.334  -3.315
  265    HZ   PHE  35           HZ       PHE  35   0.703  -4.082  -4.670
  266    H    ILE  36           H        ILE  36  -3.109  -0.190  -2.989
  267    HA   ILE  36           HA       ILE  36  -2.491   1.438  -5.419
  268    HB   ILE  36           HB       ILE  36  -3.127   2.421  -2.617
  269   1HG1  ILE  36          2HG1      ILE  36  -4.553   2.776  -5.274
  270   2HG1  ILE  36          1HG1      ILE  36  -5.105   1.765  -3.939
  271   1HG2  ILE  36          1HG2      ILE  36  -1.346   3.758  -3.664
  272   2HG2  ILE  36          2HG2      ILE  36  -2.848   4.680  -3.607
  273   3HG2  ILE  36          3HG2      ILE  36  -2.325   3.940  -5.120
  274   1HD1  ILE  36          1HD1      ILE  36  -4.797   4.076  -2.603
  275   2HD1  ILE  36          2HD1      ILE  36  -6.298   3.661  -3.430
  276   3HD1  ILE  36          3HD1      ILE  36  -5.130   4.730  -4.206
  277    H    VAL  37           H        VAL  37  -0.350   2.558  -5.181
  278    HA   VAL  37           HA       VAL  37   1.410   1.530  -3.025
  279    HB   VAL  37           HB       VAL  37   1.948   1.113  -5.981
  280   1HG1  VAL  37          1HG1      VAL  37   3.435   0.420  -3.443
  281   2HG1  VAL  37          2HG1      VAL  37   4.027   1.305  -4.848
  282   3HG1  VAL  37          3HG1      VAL  37   3.739  -0.431  -4.957
  283   1HG2  VAL  37          1HG2      VAL  37   1.691  -1.339  -5.335
  284   2HG2  VAL  37          2HG2      VAL  37   0.193  -0.410  -5.348
  285   3HG2  VAL  37          3HG2      VAL  37   0.986  -0.783  -3.818
  286    H    ARG  38           H        ARG  38   3.555   2.618  -3.075
  287    HA   ARG  38           HA       ARG  38   4.070   4.828  -4.887
  288   1HB   ARG  38          2HB       ARG  38   3.715   6.614  -3.199
  289   2HB   ARG  38          1HB       ARG  38   2.215   5.764  -3.565
  290   1HG   ARG  38          2HG       ARG  38   2.076   5.662  -1.276
  291   2HG   ARG  38          1HG       ARG  38   3.093   4.240  -1.515
  292   1HD   ARG  38          2HD       ARG  38   5.020   5.327  -0.787
  293   2HD   ARG  38          1HD       ARG  38   4.413   6.928  -1.253
  294    HE   ARG  38           HE       ARG  38   2.620   6.070   0.686
  295   1HH1  ARG  38          1HH2      ARG  38   5.044   4.580   1.753
  296   2HH1  ARG  38          2HH2      ARG  38   5.696   5.741   2.861
  297   1HH2  ARG  38          1HH1      ARG  38   3.880   8.394   1.559
  298   2HH2  ARG  38          2HH1      ARG  38   5.037   7.901   2.751
  299    H    ASP  39           H        ASP  39   6.020   6.108  -4.078
  300    HA   ASP  39           HA       ASP  39   7.894   4.245  -2.712
  301   1HB   ASP  39          2HB       ASP  39   8.409   5.243  -4.929
  302   2HB   ASP  39          1HB       ASP  39   8.317   6.851  -4.210
  303    H    SER  40           H        SER  40   9.219   4.978  -0.933
  304    HA   SER  40           HA       SER  40   7.899   7.039   0.753
  305   1HB   SER  40          2HB       SER  40   8.519   4.675   1.483
  306   2HB   SER  40          1HB       SER  40  10.204   5.178   1.390
  307    HG   SER  40           HG       SER  40   8.284   5.745   3.260
  308    H    SER  41           H        SER  41  10.343   7.563   2.280
  309    HA   SER  41           HA       SER  41  12.042   9.036   0.309
  310   1HB   SER  41          2HB       SER  41  10.836  10.208   2.833
  311   2HB   SER  41          1HB       SER  41  11.770  11.069   1.614
  312    HG   SER  41           HG       SER  41  10.117  10.773   0.165
  313    H    LYS  42           H        LYS  42  11.596   8.067   3.724
  314    HA   LYS  42           HA       LYS  42  14.287   8.541   4.582
  315   1HB   LYS  42          2HB       LYS  42  12.079   6.662   5.470
  316   2HB   LYS  42          1HB       LYS  42  13.579   6.870   6.375
  317   1HG   LYS  42          2HG       LYS  42  13.102   9.353   6.419
  318   2HG   LYS  42          1HG       LYS  42  11.514   8.993   5.744
  319   1HD   LYS  42          2HD       LYS  42  11.922   7.221   7.940
  320   2HD   LYS  42          1HD       LYS  42  12.358   8.843   8.481
  321   1HE   LYS  42          2HE       LYS  42  10.038   8.809   8.878
  322   2HE   LYS  42          1HE       LYS  42  10.109   9.526   7.256
  323   1HZ   LYS  42          1HZ       LYS  42   8.571   7.596   7.428
  324   2HZ   LYS  42          2HZ       LYS  42   9.909   6.608   7.771
  325   3HZ   LYS  42          3HZ       LYS  42   9.793   7.394   6.269
  326    H    ALA  43           H        ALA  43  12.750   5.379   3.862
  327    HA   ALA  43           HA       ALA  43  15.402   4.132   3.482
  328   1HB   ALA  43          1HB       ALA  43  13.425   2.309   2.796
  329   2HB   ALA  43          2HB       ALA  43  12.602   3.361   3.948
  330   3HB   ALA  43          3HB       ALA  43  14.083   2.525   4.418
  331    H    GLY  44           H        GLY  44  12.906   5.562   1.542
  332   1HA   GLY  44          2HA       GLY  44  12.820   5.864  -0.799
  333   2HA   GLY  44          1HA       GLY  44  14.404   5.075  -0.909
  334    H    LYS  45           H        LYS  45  11.798   3.621   0.853
  335    HA   LYS  45           HA       LYS  45  11.807   1.342  -1.031
  336   1HB   LYS  45          2HB       LYS  45  10.392   0.363   0.947
  337   2HB   LYS  45          1HB       LYS  45  12.127   0.570   1.147
  338   1HG   LYS  45          2HG       LYS  45  11.159   1.441   3.130
  339   2HG   LYS  45          1HG       LYS  45  11.570   2.859   2.177
  340   1HD   LYS  45          2HD       LYS  45   9.274   3.048   1.394
  341   2HD   LYS  45          1HD       LYS  45   8.838   1.559   2.230
  342   1HE   LYS  45          2HE       LYS  45   9.801   4.126   3.550
  343   2HE   LYS  45          1HE       LYS  45   8.155   3.465   3.614
  344   1HZ   LYS  45          1HZ       LYS  45   9.326   1.341   4.427
  345   2HZ   LYS  45          2HZ       LYS  45   9.133   2.618   5.530
  346   3HZ   LYS  45          3HZ       LYS  45  10.635   2.360   4.781
  347    H    TYR  46           H        TYR  46   9.391   0.251  -0.976
  348    HA   TYR  46           HA       TYR  46   7.550   2.447  -1.865
  349   1HB   TYR  46          2HB       TYR  46   7.612  -0.481  -2.659
  350   2HB   TYR  46          1HB       TYR  46   6.655   0.787  -3.413
  351    HD1  TYR  46           1HD      TYR  46   8.614  -1.022  -4.879
  352    HD2  TYR  46           2HD      TYR  46   9.124   2.831  -3.055
  353    HE1  TYR  46           1HE      TYR  46  10.484  -0.532  -6.426
  354    HE2  TYR  46           2HE      TYR  46  10.994   3.319  -4.600
  355    HH   TYR  46           HH       TYR  46  12.724   1.589  -5.990
  356    H    THR  47           H        THR  47   5.211   2.004  -1.495
  357    HA   THR  47           HA       THR  47   4.685   0.157   0.801
  358    HB   THR  47           HB       THR  47   3.865   3.057   0.435
  359    HG1  THR  47           1HG      THR  47   5.921   2.750   1.297
  360   1HG2  THR  47          1HG2      THR  47   2.696   0.878   2.063
  361   2HG2  THR  47          2HG2      THR  47   1.973   2.393   1.527
  362   3HG2  THR  47          3HG2      THR  47   3.023   2.371   2.943
  363    H    VAL  48           H        VAL  48   2.844  -1.063   0.512
  364    HA   VAL  48           HA       VAL  48   1.191  -0.464  -1.915
  365    HB   VAL  48           HB       VAL  48   1.553  -2.955  -0.224
  366   1HG1  VAL  48          1HG1      VAL  48   0.487  -4.007  -2.320
  367   2HG1  VAL  48          2HG1      VAL  48  -0.040  -2.372  -2.720
  368   3HG1  VAL  48          3HG1      VAL  48  -0.586  -3.135  -1.227
  369   1HG2  VAL  48          1HG2      VAL  48   2.815  -1.919  -2.747
  370   2HG2  VAL  48          2HG2      VAL  48   2.632  -3.659  -2.521
  371   3HG2  VAL  48          3HG2      VAL  48   3.576  -2.714  -1.369
  372    H    SER  49           H        SER  49  -0.538   0.804  -1.307
  373    HA   SER  49           HA       SER  49  -1.882   0.394   1.303
  374   1HB   SER  49          2HB       SER  49  -1.870   2.401  -0.929
  375   2HB   SER  49          1HB       SER  49  -3.227   2.381   0.194
  376    HG   SER  49           HG       SER  49  -0.888   3.492   0.552
  377    H    VAL  50           H        VAL  50  -3.396  -1.282   1.298
  378    HA   VAL  50           HA       VAL  50  -5.248  -1.389  -1.065
  379    HB   VAL  50           HB       VAL  50  -5.242  -3.809  -0.843
  380   1HG1  VAL  50          1HG1      VAL  50  -2.429  -2.691  -0.640
  381   2HG1  VAL  50          2HG1      VAL  50  -3.375  -2.854  -2.118
  382   3HG1  VAL  50          3HG1      VAL  50  -2.842  -4.292  -1.251
  383   1HG2  VAL  50          1HG2      VAL  50  -3.889  -4.930   0.888
  384   2HG2  VAL  50          2HG2      VAL  50  -5.121  -3.911   1.624
  385   3HG2  VAL  50          3HG2      VAL  50  -3.445  -3.365   1.565
  386    H    PHE  51           H        PHE  51  -7.432  -1.197  -0.517
  387    HA   PHE  51           HA       PHE  51  -8.140  -1.723   2.355
  388   1HB   PHE  51          2HB       PHE  51  -8.689   0.467   2.543
  389   2HB   PHE  51          1HB       PHE  51  -8.024   0.721   0.938
  390    HD1  PHE  51           1HD      PHE  51  -9.559   0.165  -1.077
  391    HD2  PHE  51           2HD      PHE  51 -10.998   0.795   2.917
  392    HE1  PHE  51           1HE      PHE  51 -11.812   0.627  -1.966
  393    HE2  PHE  51           2HE      PHE  51 -13.266   1.253   2.025
  394    HZ   PHE  51           HZ       PHE  51 -13.673   1.170  -0.419
  395    H    ALA  52           H        ALA  52 -10.657  -1.863   2.550
  396    HA   ALA  52           HA       ALA  52 -12.188  -2.583   0.207
  397   1HB   ALA  52          1HB       ALA  52 -12.276  -4.962   0.489
  398   2HB   ALA  52          2HB       ALA  52 -11.417  -4.870   2.027
  399   3HB   ALA  52          3HB       ALA  52 -10.570  -4.518   0.521
  400    H    LYS  53           H        LYS  53 -14.376  -3.403   0.805
  401    HA   LYS  53           HA       LYS  53 -15.163  -2.503   3.565
  402   1HB   LYS  53          2HB       LYS  53 -16.382  -2.364   0.812
  403   2HB   LYS  53          1HB       LYS  53 -17.400  -2.218   2.245
  404   1HG   LYS  53          2HG       LYS  53 -15.481  -0.489   2.949
  405   2HG   LYS  53          1HG       LYS  53 -15.319  -0.357   1.198
  406   1HD   LYS  53          2HD       LYS  53 -17.823  -0.001   1.090
  407   2HD   LYS  53          1HD       LYS  53 -17.811   0.119   2.850
  408   1HE   LYS  53          2HE       LYS  53 -17.150   2.280   2.722
  409   2HE   LYS  53          1HE       LYS  53 -15.735   1.812   1.759
  410   1HZ   LYS  53          1HZ       LYS  53 -18.470   2.445   0.822
  411   2HZ   LYS  53          2HZ       LYS  53 -17.402   1.533  -0.134
  412   3HZ   LYS  53          3HZ       LYS  53 -17.000   3.122   0.314
  413    H    SER  54           H        SER  54 -14.383  -5.147   3.588
  414    HA   SER  54           HA       SER  54 -16.910  -6.556   4.058
  415   1HB   SER  54          2HB       SER  54 -15.308  -6.865   1.577
  416   2HB   SER  54          1HB       SER  54 -15.912  -8.353   2.302
  417    HG   SER  54           HG       SER  54 -17.440  -6.047   1.644
  418    H    THR  55           H        THR  55 -15.376  -6.383   6.105
  419    HA   THR  55           HA       THR  55 -14.434  -9.021   6.733
  420    HB   THR  55           HB       THR  55 -12.632  -8.351   5.159
  421    HG1  THR  55           1HG      THR  55 -11.062  -9.040   6.457
  422   1HG2  THR  55          1HG2      THR  55 -12.894  -5.861   6.565
  423   2HG2  THR  55          2HG2      THR  55 -11.953  -6.213   5.117
  424   3HG2  THR  55          3HG2      THR  55 -11.234  -6.436   6.711
  425    H    GLY  56           H        GLY  56 -12.194  -7.451   8.418
  426   1HA   GLY  56          2HA       GLY  56 -13.575  -7.270  10.854
  427   2HA   GLY  56          1HA       GLY  56 -12.127  -6.323  10.491
  428    H    ASP  57           H        ASP  57 -13.303  -4.955   8.232
  429    HA   ASP  57           HA       ASP  57 -15.293  -3.181   9.597
  430   1HB   ASP  57          2HB       ASP  57 -12.701  -2.623   8.947
  431   2HB   ASP  57          1HB       ASP  57 -13.524  -2.148   7.464
  432    HA   PRO  58           HA       PRO  58 -17.260  -5.176   5.904
  433   1HB   PRO  58          2HB       PRO  58 -19.715  -4.107   6.954
  434   2HB   PRO  58          1HB       PRO  58 -19.196  -5.791   6.874
  435   1HG   PRO  58          2HG       PRO  58 -19.351  -4.077   9.186
  436   2HG   PRO  58          1HG       PRO  58 -18.913  -5.787   9.119
  437   1HD   PRO  58          2HD       PRO  58 -17.178  -3.598   9.670
  438   2HD   PRO  58          1HD       PRO  58 -16.705  -5.294   9.405
  439    H    GLN  59           H        GLN  59 -17.309  -1.902   7.104
  440    HA   GLN  59           HA       GLN  59 -18.387  -0.984   4.463
  441   1HB   GLN  59          2HB       GLN  59 -18.927   1.107   5.819
  442   2HB   GLN  59          1HB       GLN  59 -19.809  -0.350   6.276
  443   1HG   GLN  59          2HG       GLN  59 -18.694  -0.569   8.273
  444   2HG   GLN  59          1HG       GLN  59 -17.206   0.134   7.639
  445   1HE2  GLN  59          1HE2      GLN  59 -16.784   2.204   8.412
  446   2HE2  GLN  59          2HE2      GLN  59 -17.957   3.304   8.954
  447    H    GLY  60           H        GLY  60 -15.406  -1.292   5.882
  448   1HA   GLY  60          2HA       GLY  60 -14.076   0.349   4.041
  449   2HA   GLY  60          1HA       GLY  60 -14.318   1.323   5.480
  450    H    VAL  61           H        VAL  61 -12.342  -1.002   4.011
  451    HA   VAL  61           HA       VAL  61 -10.838  -1.394   6.581
  452    HB   VAL  61           HB       VAL  61 -11.049  -3.307   4.234
  453   1HG1  VAL  61          1HG1      VAL  61 -10.275  -4.052   7.031
  454   2HG1  VAL  61          2HG1      VAL  61  -9.088  -3.267   5.991
  455   3HG1  VAL  61          3HG1      VAL  61  -9.808  -4.801   5.504
  456   1HG2  VAL  61          1HG2      VAL  61 -12.815  -4.398   5.219
  457   2HG2  VAL  61          2HG2      VAL  61 -13.170  -2.761   5.750
  458   3HG2  VAL  61          3HG2      VAL  61 -12.367  -3.885   6.845
  459    H    ILE  62           H        ILE  62  -8.614  -1.209   6.410
  460    HA   ILE  62           HA       ILE  62  -7.421  -0.718   3.731
  461    HB   ILE  62           HB       ILE  62  -6.640   1.212   5.823
  462   1HG1  ILE  62          2HG1      ILE  62  -9.462   1.146   4.713
  463   2HG1  ILE  62          1HG1      ILE  62  -9.004   1.020   6.401
  464   1HG2  ILE  62          1HG2      ILE  62  -7.615   2.462   3.487
  465   2HG2  ILE  62          2HG2      ILE  62  -6.837   0.977   2.942
  466   3HG2  ILE  62          3HG2      ILE  62  -5.931   2.145   3.900
  467   1HD1  ILE  62          1HD1      ILE  62  -8.617   3.426   4.619
  468   2HD1  ILE  62          2HD1      ILE  62  -8.031   3.296   6.279
  469   3HD1  ILE  62          3HD1      ILE  62  -9.764   3.273   5.950
  470    H    ARG  63           H        ARG  63  -5.078  -0.795   3.752
  471    HA   ARG  63           HA       ARG  63  -3.565  -1.441   6.147
  472   1HB   ARG  63          2HB       ARG  63  -5.108  -3.486   5.110
  473   2HB   ARG  63          1HB       ARG  63  -3.550  -3.765   4.331
  474   1HG   ARG  63          2HG       ARG  63  -2.427  -3.765   6.507
  475   2HG   ARG  63          1HG       ARG  63  -3.953  -3.402   7.315
  476   1HD   ARG  63          2HD       ARG  63  -4.012  -5.774   5.530
  477   2HD   ARG  63          1HD       ARG  63  -3.024  -5.940   6.995
  478    HE   ARG  63           HE       ARG  63  -5.473  -4.676   7.720
  479   1HH1  ARG  63          1HH2      ARG  63  -3.842  -7.552   7.962
  480   2HH1  ARG  63          2HH2      ARG  63  -5.242  -8.562   8.099
  481   1HH2  ARG  63          1HH1      ARG  63  -7.473  -6.030   7.299
  482   2HH2  ARG  63          2HH1      ARG  63  -7.298  -7.700   7.724
  483    H    HIS  64           H        HIS  64  -1.746  -0.279   5.526
  484    HA   HIS  64           HA       HIS  64  -0.894  -0.349   2.682
  485   1HB   HIS  64          2HB       HIS  64   0.482   1.217   4.843
  486   2HB   HIS  64          1HB       HIS  64   0.227   1.644   3.154
  487    HD1  HIS  64           1HD      HIS  64  -2.090   2.624   2.497
  488    HD2  HIS  64           2HD      HIS  64  -1.697   1.822   6.568
  489    HE1  HIS  64           1HE      HIS  64  -4.047   3.751   3.642
  490    H    TYR  65           H        TYR  65   0.294  -2.188   2.291
  491    HA   TYR  65           HA       TYR  65   2.193  -3.273   4.257
  492   1HB   TYR  65          2HB       TYR  65   1.999  -3.889   1.313
  493   2HB   TYR  65          1HB       TYR  65   2.504  -4.956   2.617
  494    HD1  TYR  65           1HD      TYR  65   0.336  -4.330   4.621
  495    HD2  TYR  65           2HD      TYR  65   0.144  -5.079   0.396
  496    HE1  TYR  65           1HE      TYR  65  -1.987  -5.142   4.873
  497    HE2  TYR  65           2HE      TYR  65  -2.178  -5.891   0.648
  498    HH   TYR  65           HH       TYR  65  -3.628  -6.814   2.381
  499    H    VAL  66           H        VAL  66   4.210  -2.371   4.466
  500    HA   VAL  66           HA       VAL  66   5.292  -0.867   2.114
  501    HB   VAL  66           HB       VAL  66   5.958  -0.568   5.059
  502   1HG1  VAL  66          1HG1      VAL  66   6.681   0.931   2.537
  503   2HG1  VAL  66          2HG1      VAL  66   7.755   0.296   3.783
  504   3HG1  VAL  66          3HG1      VAL  66   6.758   1.711   4.118
  505   1HG2  VAL  66          1HG2      VAL  66   3.605   0.217   3.659
  506   2HG2  VAL  66          2HG2      VAL  66   4.556   1.679   3.920
  507   3HG2  VAL  66          3HG2      VAL  66   4.087   0.675   5.291
  508    H    VAL  67           H        VAL  67   7.718  -0.877   2.002
  509    HA   VAL  67           HA       VAL  67   8.764  -3.565   2.798
  510    HB   VAL  67           HB       VAL  67   9.432  -1.704   0.500
  511   1HG1  VAL  67          1HG1      VAL  67  10.822  -4.008   1.693
  512   2HG1  VAL  67          2HG1      VAL  67  11.433  -2.767   0.600
  513   3HG1  VAL  67          3HG1      VAL  67  10.558  -4.157  -0.044
  514   1HG2  VAL  67          1HG2      VAL  67   7.669  -4.075   0.868
  515   2HG2  VAL  67          2HG2      VAL  67   8.621  -4.031  -0.616
  516   3HG2  VAL  67          3HG2      VAL  67   7.506  -2.717  -0.244
  517    H    CYS  68           H        CYS  68  10.325  -3.491   4.323
  518    HA   CYS  68           HA       CYS  68  11.626  -0.942   5.015
  519   1HB   CYS  68          2HB       CYS  68  10.750  -2.578   6.695
  520   2HB   CYS  68          1HB       CYS  68  11.929  -3.756   6.119
  521    HG   CYS  68           HG       CYS  68  12.527  -1.535   8.059
  522    H    SER  69           H        SER  69  13.926  -0.638   4.835
  523    HA   SER  69           HA       SER  69  15.309  -2.638   3.080
  524   1HB   SER  69          2HB       SER  69  16.422  -0.421   2.219
  525   2HB   SER  69          1HB       SER  69  14.812  -0.860   1.651
  526    HG   SER  69           HG       SER  69  15.610   1.086   3.512
  527    H    THR  70           H        THR  70  17.288  -3.259   3.783
  528    HA   THR  70           HA       THR  70  18.455  -1.902   6.169
  529    HB   THR  70           HB       THR  70  17.947  -4.358   6.157
  530    HG1  THR  70           1HG      THR  70  19.869  -4.913   7.065
  531   1HG2  THR  70          1HG2      THR  70  20.257  -4.932   4.406
  532   2HG2  THR  70          2HG2      THR  70  18.819  -4.326   3.587
  533   3HG2  THR  70          3HG2      THR  70  18.726  -5.788   4.570
  534    HA   PRO  71           HA       PRO  71  21.644  -0.053   3.793
  535   1HB   PRO  71          2HB       PRO  71  23.783  -0.743   5.588
  536   2HB   PRO  71          1HB       PRO  71  22.922   0.792   5.454
  537   1HG   PRO  71          2HG       PRO  71  22.743  -1.114   7.570
  538   2HG   PRO  71          1HG       PRO  71  21.814   0.377   7.385
  539   1HD   PRO  71          2HD       PRO  71  20.908  -2.362   7.057
  540   2HD   PRO  71          1HD       PRO  71  19.945  -0.867   6.997
  541    H    GLN  72           H        GLN  72  21.534  -3.375   4.079
  542    HA   GLN  72           HA       GLN  72  24.125  -3.831   2.696
  543   1HB   GLN  72          2HB       GLN  72  23.433  -5.305   4.535
  544   2HB   GLN  72          1HB       GLN  72  21.917  -5.652   3.716
  545   1HG   GLN  72          2HG       GLN  72  23.638  -7.456   3.444
  546   2HG   GLN  72          1HG       GLN  72  23.085  -6.786   1.913
  547   1HE2  GLN  72          1HE2      GLN  72  25.093  -7.262   0.788
  548   2HE2  GLN  72          2HE2      GLN  72  26.533  -6.432   1.137
  549    H    SER  73           H        SER  73  21.693  -2.375   1.526
  550    HA   SER  73           HA       SER  73  20.640  -2.246  -0.583
  551   1HB   SER  73          2HB       SER  73  23.159  -3.321  -0.934
  552   2HB   SER  73          1HB       SER  73  22.134  -4.537  -1.689
  553    HG   SER  73           HG       SER  73  22.439  -1.801  -2.299
  554    H    GLN  74           H        GLN  74  19.334  -3.719   1.390
  555    HA   GLN  74           HA       GLN  74  18.097  -5.933  -0.202
  556   1HB   GLN  74          2HB       GLN  74  18.276  -6.179   2.753
  557   2HB   GLN  74          1HB       GLN  74  18.459  -7.419   1.518
  558   1HG   GLN  74          2HG       GLN  74  20.661  -6.185   0.919
  559   2HG   GLN  74          1HG       GLN  74  20.498  -5.429   2.501
  560   1HE2  GLN  74          1HE2      GLN  74  20.499  -6.915   4.417
  561   2HE2  GLN  74          2HE2      GLN  74  21.205  -8.453   4.292
  562    H    TYR  75           H        TYR  75  15.878  -6.520   0.776
  563    HA   TYR  75           HA       TYR  75  14.561  -4.231   2.175
  564   1HB   TYR  75          2HB       TYR  75  13.586  -5.395  -0.443
  565   2HB   TYR  75          1HB       TYR  75  12.924  -4.003   0.405
  566    HD1  TYR  75           1HD      TYR  75  15.893  -5.273  -1.412
  567    HD2  TYR  75           2HD      TYR  75  13.890  -1.834   0.189
  568    HE1  TYR  75           1HE      TYR  75  17.496  -3.804  -2.585
  569    HE2  TYR  75           2HE      TYR  75  15.489  -0.359  -0.986
  570    HH   TYR  75           HH       TYR  75  18.346  -1.244  -2.087
  571    H    TYR  76           H        TYR  76  12.373  -4.779   2.940
  572    HA   TYR  76           HA       TYR  76  11.136  -7.349   2.665
  573   1HB   TYR  76          2HB       TYR  76  11.789  -8.301   4.887
  574   2HB   TYR  76          1HB       TYR  76  13.178  -8.120   3.824
  575    HD1  TYR  76           1HD      TYR  76  11.355  -6.586   6.667
  576    HD2  TYR  76           2HD      TYR  76  14.989  -6.636   4.391
  577    HE1  TYR  76           1HE      TYR  76  12.443  -5.194   8.393
  578    HE2  TYR  76           2HE      TYR  76  16.082  -5.238   6.115
  579    HH   TYR  76           HH       TYR  76  15.138  -3.484   7.929
  580    H    LEU  77           H        LEU  77   9.297  -7.592   4.175
  581    HA   LEU  77           HA       LEU  77   8.399  -4.974   5.327
  582   1HB   LEU  77          2HB       LEU  77   7.095  -6.591   3.660
  583   2HB   LEU  77          1HB       LEU  77   6.742  -7.490   5.135
  584    HG   LEU  77           HG       LEU  77   6.337  -4.571   5.353
  585   1HD1  LEU  77          1HD1      LEU  77   5.561  -5.293   2.973
  586   2HD1  LEU  77          2HD1      LEU  77   4.430  -4.393   3.982
  587   3HD1  LEU  77          3HD1      LEU  77   4.269  -6.141   3.821
  588   1HD2  LEU  77          1HD2      LEU  77   4.662  -5.216   6.817
  589   2HD2  LEU  77          2HD2      LEU  77   5.704  -6.637   6.907
  590   3HD2  LEU  77          3HD2      LEU  77   4.263  -6.663   5.890
  591    H    ALA  78           H        ALA  78   9.931  -7.797   6.046
  592    HA   ALA  78           HA       ALA  78   9.778  -7.444   8.945
  593   1HB   ALA  78          1HB       ALA  78   9.197 -10.202   7.919
  594   2HB   ALA  78          2HB       ALA  78   7.874  -9.035   7.880
  595   3HB   ALA  78          3HB       ALA  78   8.652  -9.435   9.410
  596    H    GLU  79           H        GLU  79  11.943  -7.655   9.480
  597    HA   GLU  79           HA       GLU  79  14.023  -8.283   7.743
  598   1HB   GLU  79          2HB       GLU  79  13.597  -8.300  10.697
  599   2HB   GLU  79          1HB       GLU  79  15.092  -9.024  10.098
  600   1HG   GLU  79          2HG       GLU  79  15.415  -6.911   8.717
  601   2HG   GLU  79          1HG       GLU  79  14.096  -6.205   9.653
  602    H    LYS  80           H        LYS  80  11.810 -10.498   9.172
  603    HA   LYS  80           HA       LYS  80  13.103 -12.925   9.478
  604   1HB   LYS  80          2HB       LYS  80  10.486 -11.931   8.769
  605   2HB   LYS  80          1HB       LYS  80  10.814 -13.408   7.867
  606   1HG   LYS  80          2HG       LYS  80  11.683 -13.644  10.638
  607   2HG   LYS  80          1HG       LYS  80   9.968 -13.244  10.532
  608   1HD   LYS  80          2HD       LYS  80   9.502 -15.155   9.185
  609   2HD   LYS  80          1HD       LYS  80  11.214 -15.446   8.876
  610   1HE   LYS  80          2HE       LYS  80  10.458 -15.411  11.743
  611   2HE   LYS  80          1HE       LYS  80   9.812 -16.769  10.801
  612   1HZ   LYS  80          1HZ       LYS  80  12.015 -17.324  11.551
  613   2HZ   LYS  80          2HZ       LYS  80  12.646 -15.881  10.912
  614   3HZ   LYS  80          3HZ       LYS  80  12.055 -17.087   9.872
  615    H    HIS  81           H        HIS  81  12.286 -11.336   6.397
  616    HA   HIS  81           HA       HIS  81  14.375 -12.912   5.014
  617   1HB   HIS  81          2HB       HIS  81  11.401 -13.074   4.449
  618   2HB   HIS  81          1HB       HIS  81  12.619 -13.580   3.278
  619    HD1  HIS  81           1HD      HIS  81  14.552 -15.241   4.611
  620    HD2  HIS  81           2HD      HIS  81  10.601 -15.248   5.936
  621    HE1  HIS  81           1HE      HIS  81  14.240 -17.387   5.918
  622    H    LEU  82           H        LEU  82  15.205 -11.686   3.277
  623    HA   LEU  82           HA       LEU  82  13.609  -9.379   2.320
  624   1HB   LEU  82          2HB       LEU  82  15.401  -7.831   2.922
  625   2HB   LEU  82          1HB       LEU  82  14.926  -8.739   4.355
  626    HG   LEU  82           HG       LEU  82  17.200  -9.604   2.585
  627   1HD1  LEU  82          1HD1      LEU  82  17.173  -7.211   3.944
  628   2HD1  LEU  82          2HD1      LEU  82  18.627  -8.128   3.559
  629   3HD1  LEU  82          3HD1      LEU  82  17.871  -8.302   5.141
  630   1HD2  LEU  82          1HD2      LEU  82  15.949 -10.516   5.082
  631   2HD2  LEU  82          2HD2      LEU  82  17.697 -10.325   5.221
  632   3HD2  LEU  82          3HD2      LEU  82  17.021 -11.388   3.987
  633    H    PHE  83           H        PHE  83  14.213  -8.698   0.229
  634    HA   PHE  83           HA       PHE  83  16.267 -10.406  -1.128
  635   1HB   PHE  83          2HB       PHE  83  13.597  -9.248  -1.949
  636   2HB   PHE  83          1HB       PHE  83  14.757  -9.810  -3.159
  637    HD1  PHE  83           1HD      PHE  83  15.907 -12.170  -2.476
  638    HD2  PHE  83           2HD      PHE  83  12.021 -10.823  -1.245
  639    HE1  PHE  83           1HE      PHE  83  15.224 -14.517  -2.062
  640    HE2  PHE  83           2HE      PHE  83  11.336 -13.168  -0.832
  641    HZ   PHE  83           HZ       PHE  83  12.938 -15.017  -1.240
  642    H    SER  84           H        SER  84  15.829  -8.445  -3.521
  643    HA   SER  84           HA       SER  84  17.599  -6.288  -2.408
  644   1HB   SER  84          2HB       SER  84  18.516  -6.323  -4.790
  645   2HB   SER  84          1HB       SER  84  18.826  -7.768  -3.833
  646    HG   SER  84           HG       SER  84  16.696  -7.399  -5.679
  647    H    THR  85           H        THR  85  14.478  -6.653  -3.406
  648    HA   THR  85           HA       THR  85  14.190  -3.819  -4.051
  649    HB   THR  85           HB       THR  85  13.348  -5.694  -6.253
  650    HG1  THR  85           1HG      THR  85  15.360  -6.121  -6.599
  651   1HG2  THR  85          1HG2      THR  85  13.197  -2.928  -5.765
  652   2HG2  THR  85          2HG2      THR  85  12.816  -3.766  -7.269
  653   3HG2  THR  85          3HG2      THR  85  14.437  -3.124  -7.003
  654    H    ILE  86           H        ILE  86  11.866  -3.227  -4.325
  655    HA   ILE  86           HA       ILE  86  10.124  -4.773  -2.623
  656    HB   ILE  86           HB       ILE  86   9.898  -2.380  -4.428
  657   1HG1  ILE  86          2HG1      ILE  86   8.979  -1.677  -1.975
  658   2HG1  ILE  86          1HG1      ILE  86  10.052  -3.003  -1.537
  659   1HG2  ILE  86          1HG2      ILE  86   7.752  -3.511  -4.724
  660   2HG2  ILE  86          2HG2      ILE  86   7.527  -2.130  -3.652
  661   3HG2  ILE  86          3HG2      ILE  86   7.613  -3.760  -2.984
  662   1HD1  ILE  86          1HD1      ILE  86  11.034  -0.938  -3.472
  663   2HD1  ILE  86          2HD1      ILE  86  11.948  -1.918  -2.325
  664   3HD1  ILE  86          3HD1      ILE  86  11.000  -0.546  -1.753
  665    HA   PRO  87           HA       PRO  87   7.813  -5.866  -6.800
  666   1HB   PRO  87          2HB       PRO  87   9.858  -5.890  -8.827
  667   2HB   PRO  87          1HB       PRO  87   8.391  -4.908  -8.774
  668   1HG   PRO  87          2HG       PRO  87  11.121  -4.079  -8.309
  669   2HG   PRO  87          1HG       PRO  87   9.667  -3.080  -8.386
  670   1HD   PRO  87          2HD       PRO  87  11.194  -3.681  -6.069
  671   2HD   PRO  87          1HD       PRO  87   9.611  -2.875  -6.116
  672    H    GLU  88           H        GLU  88  11.266  -6.570  -6.349
  673    HA   GLU  88           HA       GLU  88  11.264  -9.290  -7.243
  674   1HB   GLU  88          2HB       GLU  88  13.176  -7.639  -6.589
  675   2HB   GLU  88          1HB       GLU  88  12.894  -8.200  -4.941
  676   1HG   GLU  88          2HG       GLU  88  14.417  -9.802  -5.524
  677   2HG   GLU  88          1HG       GLU  88  13.000 -10.582  -6.230
  678    H    LEU  89           H        LEU  89  11.148  -8.018  -3.894
  679    HA   LEU  89           HA       LEU  89  10.567 -10.330  -2.446
  680   1HB   LEU  89          2HB       LEU  89  10.159  -7.431  -2.241
  681   2HB   LEU  89          1HB       LEU  89   8.928  -8.334  -1.361
  682    HG   LEU  89           HG       LEU  89  11.871  -8.947  -1.075
  683   1HD1  LEU  89          1HD1      LEU  89  11.413  -6.564  -0.476
  684   2HD1  LEU  89          2HD1      LEU  89  11.885  -7.539   0.912
  685   3HD1  LEU  89          3HD1      LEU  89  10.191  -7.119   0.669
  686   1HD2  LEU  89          1HD2      LEU  89   9.889 -10.505  -0.351
  687   2HD2  LEU  89          2HD2      LEU  89   9.688  -9.344   0.961
  688   3HD2  LEU  89          3HD2      LEU  89  11.208 -10.218   0.785
  689    H    ILE  90           H        ILE  90   8.107  -8.113  -3.835
  690    HA   ILE  90           HA       ILE  90   5.829  -9.715  -3.256
  691    HB   ILE  90           HB       ILE  90   6.354  -7.807  -5.563
  692   1HG1  ILE  90          2HG1      ILE  90   6.863  -6.731  -3.433
  693   2HG1  ILE  90          1HG1      ILE  90   5.317  -6.123  -4.018
  694   1HG2  ILE  90          1HG2      ILE  90   3.802  -7.429  -5.125
  695   2HG2  ILE  90          2HG2      ILE  90   3.875  -9.019  -4.366
  696   3HG2  ILE  90          3HG2      ILE  90   4.309  -8.832  -6.066
  697   1HD1  ILE  90          1HD1      ILE  90   5.904  -7.856  -1.677
  698   2HD1  ILE  90          2HD1      ILE  90   4.440  -8.235  -2.585
  699   3HD1  ILE  90          3HD1      ILE  90   4.654  -6.630  -1.885
  700    H    ASN  91           H        ASN  91   8.070  -9.743  -6.009
  701    HA   ASN  91           HA       ASN  91   6.639 -11.456  -7.765
  702   1HB   ASN  91          2HB       ASN  91   9.289 -10.362  -7.415
  703   2HB   ASN  91          1HB       ASN  91   9.416 -12.049  -7.908
  704   1HD2  ASN  91          1HD2      ASN  91   9.904  -9.488  -9.493
  705   2HD2  ASN  91          2HD2      ASN  91   8.918  -9.643 -10.867
  706    H    TYR  92           H        TYR  92   8.783 -12.224  -5.027
  707    HA   TYR  92           HA       TYR  92   9.004 -15.023  -5.358
  708   1HB   TYR  92          2HB       TYR  92   8.899 -13.192  -2.953
  709   2HB   TYR  92          1HB       TYR  92   9.255 -14.913  -2.803
  710    HD1  TYR  92           1HD      TYR  92  10.553 -11.660  -3.712
  711    HD2  TYR  92           2HD      TYR  92  11.212 -15.878  -4.076
  712    HE1  TYR  92           1HE      TYR  92  12.901 -11.232  -4.381
  713    HE2  TYR  92           2HE      TYR  92  13.564 -15.460  -4.744
  714    HH   TYR  92           HH       TYR  92  14.968 -12.244  -4.601
  715    H    HIS  93           H        HIS  93   6.208 -13.146  -4.441
  716    HA   HIS  93           HA       HIS  93   4.754 -15.697  -3.810
  717   1HB   HIS  93          2HB       HIS  93   4.789 -12.980  -2.521
  718   2HB   HIS  93          1HB       HIS  93   3.350 -13.990  -2.383
  719    HD1  HIS  93           1HD      HIS  93   3.386 -15.394  -0.336
  720    HD2  HIS  93           2HD      HIS  93   7.235 -14.755  -1.805
  721    HE1  HIS  93           1HE      HIS  93   4.961 -16.608   1.232
  722    H    GLN  94           H        GLN  94   4.471 -12.379  -5.075
  723    HA   GLN  94           HA       GLN  94   1.778 -12.622  -6.061
  724   1HB   GLN  94          2HB       GLN  94   2.996 -10.508  -5.613
  725   2HB   GLN  94          1HB       GLN  94   4.103 -10.875  -6.936
  726   1HG   GLN  94          2HG       GLN  94   2.554 -10.378  -8.555
  727   2HG   GLN  94          1HG       GLN  94   1.198 -10.936  -7.575
  728   1HE2  GLN  94          1HE2      GLN  94   1.703  -8.262  -9.017
  729   2HE2  GLN  94          2HE2      GLN  94   1.454  -7.091  -7.813
  730    H    HIS  95           H        HIS  95   4.957 -13.004  -7.624
  731    HA   HIS  95           HA       HIS  95   5.586 -14.064  -9.628
  732   1HB   HIS  95          2HB       HIS  95   3.036 -15.503  -8.854
  733   2HB   HIS  95          1HB       HIS  95   4.049 -16.023 -10.200
  734    HD1  HIS  95           1HD      HIS  95   6.836 -15.531  -8.981
  735    HD2  HIS  95           2HD      HIS  95   3.722 -17.398  -6.930
  736    HE1  HIS  95           1HE      HIS  95   7.911 -16.925  -7.160
  737    H    ASN  96           H        ASN  96   2.120 -14.422 -10.282
  738    HA   ASN  96           HA       ASN  96   0.764 -13.489 -11.973
  739   1HB   ASN  96          2HB       ASN  96   1.677 -11.436 -10.669
  740   2HB   ASN  96          1HB       ASN  96   2.760 -11.223 -12.044
  741   1HD2  ASN  96          1HD2      ASN  96   1.887  -9.621 -13.364
  742   2HD2  ASN  96          2HD2      ASN  96   0.251  -9.503 -13.797
  743    H    SER  97           H        SER  97   0.701 -13.600 -14.246
  744    HA   SER  97           HA       SER  97   3.127 -13.382 -15.870
  745   1HB   SER  97          2HB       SER  97   2.104 -15.951 -14.801
  746   2HB   SER  97          1HB       SER  97   2.507 -15.959 -16.516
  747    HG   SER  97           HG       SER  97   4.141 -16.027 -14.410
  748    H    ALA  98           H        ALA  98  -0.040 -15.078 -15.899
  749    HA   ALA  98           HA       ALA  98  -0.513 -14.239 -18.687
  750   1HB   ALA  98          1HB       ALA  98  -2.114 -15.913 -18.633
  751   2HB   ALA  98          2HB       ALA  98  -2.566 -15.568 -16.964
  752   3HB   ALA  98          3HB       ALA  98  -1.086 -16.462 -17.310
  753    H    GLY  99           H        GLY  99  -0.395 -11.869 -17.638
  754   1HA   GLY  99          2HA       GLY  99  -1.923  -9.984 -17.799
  755   2HA   GLY  99          1HA       GLY  99  -3.223 -11.032 -17.230
  756    H    LEU 100           H        LEU 100  -3.509  -9.131 -15.698
  757    HA   LEU 100           HA       LEU 100  -1.674  -9.408 -13.338
  758   1HB   LEU 100          2HB       LEU 100  -2.291  -7.028 -12.907
  759   2HB   LEU 100          1HB       LEU 100  -1.511  -7.244 -14.473
  760    HG   LEU 100           HG       LEU 100  -4.445  -7.553 -14.535
  761   1HD1  LEU 100          1HD1      LEU 100  -5.068  -5.368 -14.038
  762   2HD1  LEU 100          2HD1      LEU 100  -3.445  -4.733 -14.309
  763   3HD1  LEU 100          3HD1      LEU 100  -3.807  -5.630 -12.834
  764   1HD2  LEU 100          1HD2      LEU 100  -3.795  -5.669 -16.370
  765   2HD2  LEU 100          2HD2      LEU 100  -3.606  -7.397 -16.666
  766   3HD2  LEU 100          3HD2      LEU 100  -2.220  -6.433 -16.160
  767    H    ILE 101           H        ILE 101  -4.855  -9.886 -14.479
  768    HA   ILE 101           HA       ILE 101  -6.467  -9.227 -12.233
  769    HB   ILE 101           HB       ILE 101  -7.278  -9.865 -14.476
  770   1HG1  ILE 101          2HG1      ILE 101  -8.211 -11.838 -12.365
  771   2HG1  ILE 101          1HG1      ILE 101  -8.741 -10.158 -12.462
  772   1HG2  ILE 101          1HG2      ILE 101  -6.880 -11.911 -15.455
  773   2HG2  ILE 101          2HG2      ILE 101  -6.826 -12.760 -13.910
  774   3HG2  ILE 101          3HG2      ILE 101  -5.436 -11.818 -14.447
  775   1HD1  ILE 101          1HD1      ILE 101  -9.249 -12.398 -14.417
  776   2HD1  ILE 101          2HD1      ILE 101  -9.398 -10.708 -14.901
  777   3HD1  ILE 101          3HD1      ILE 101 -10.422 -11.352 -13.618
  778    H    SER 102           H        SER 102  -4.156 -11.802 -12.683
  779    HA   SER 102           HA       SER 102  -5.128 -13.741 -10.839
  780   1HB   SER 102          2HB       SER 102  -3.329 -14.299 -12.283
  781   2HB   SER 102          1HB       SER 102  -2.406 -12.872 -11.819
  782    HG   SER 102           HG       SER 102  -2.969 -15.190 -10.283
  783    H    ARG 103           H        ARG 103  -3.146 -10.824 -10.319
  784    HA   ARG 103           HA       ARG 103  -3.525 -11.205  -7.365
  785   1HB   ARG 103          2HB       ARG 103  -1.182 -11.184  -8.873
  786   2HB   ARG 103          1HB       ARG 103  -1.267  -9.545  -8.226
  787   1HG   ARG 103          2HG       ARG 103  -0.361 -10.430  -6.346
  788   2HG   ARG 103          1HG       ARG 103  -1.975 -11.073  -6.040
  789   1HD   ARG 103          2HD       ARG 103   0.091 -12.563  -7.694
  790   2HD   ARG 103          1HD       ARG 103  -0.121 -12.813  -5.950
  791    HE   ARG 103           HE       ARG 103  -2.539 -12.995  -7.664
  792   1HH1  ARG 103          1HH2      ARG 103  -0.316 -15.242  -7.674
  793   2HH1  ARG 103          2HH2      ARG 103  -1.077 -16.385  -6.619
  794   1HH2  ARG 103          1HH1      ARG 103  -3.446 -14.138  -5.455
  795   2HH2  ARG 103          2HH1      ARG 103  -2.849 -15.761  -5.363
  796    H    LEU 104           H        LEU 104  -2.894  -8.827  -6.363
  797    HA   LEU 104           HA       LEU 104  -3.623  -6.599  -6.070
  798   1HB   LEU 104          2HB       LEU 104  -2.464  -6.652  -8.418
  799   2HB   LEU 104          1HB       LEU 104  -4.110  -6.532  -9.044
  800    HG   LEU 104           HG       LEU 104  -3.254  -4.653  -6.875
  801   1HD1  LEU 104          1HD1      LEU 104  -2.675  -3.115  -8.950
  802   2HD1  LEU 104          2HD1      LEU 104  -2.309  -4.660  -9.718
  803   3HD1  LEU 104          3HD1      LEU 104  -1.451  -4.175  -8.255
  804   1HD2  LEU 104          1HD2      LEU 104  -5.388  -4.042  -7.349
  805   2HD2  LEU 104          2HD2      LEU 104  -5.395  -4.936  -8.868
  806   3HD2  LEU 104          3HD2      LEU 104  -4.715  -3.310  -8.805
  807    H    LYS 105           H        LYS 105  -5.629  -5.387  -5.948
  808    HA   LYS 105           HA       LYS 105  -8.026  -7.028  -6.667
  809   1HB   LYS 105          2HB       LYS 105  -7.184  -5.356  -4.366
  810   2HB   LYS 105          1HB       LYS 105  -8.893  -5.267  -4.803
  811   1HG   LYS 105          2HG       LYS 105  -7.511  -7.932  -4.550
  812   2HG   LYS 105          1HG       LYS 105  -8.151  -7.112  -3.125
  813   1HD   LYS 105          2HD       LYS 105 -10.294  -6.861  -4.709
  814   2HD   LYS 105          1HD       LYS 105  -9.608  -8.317  -5.432
  815   1HE   LYS 105          2HE       LYS 105  -9.392  -8.855  -2.727
  816   2HE   LYS 105          1HE       LYS 105 -10.936  -7.987  -2.830
  817   1HZ   LYS 105          1HZ       LYS 105 -11.444  -9.416  -4.803
  818   2HZ   LYS 105          2HZ       LYS 105 -11.394 -10.248  -3.322
  819   3HZ   LYS 105          3HZ       LYS 105 -10.089 -10.355  -4.405
  820    H    TYR 106           H        TYR 106  -7.777  -3.507  -5.868
  821    HA   TYR 106           HA       TYR 106  -8.877  -2.990  -8.613
  822   1HB   TYR 106          2HB       TYR 106 -10.706  -2.992  -7.007
  823   2HB   TYR 106          1HB       TYR 106  -9.820  -1.890  -5.952
  824    HD1  TYR 106           1HD      TYR 106 -10.323   0.375  -6.105
  825    HD2  TYR 106           2HD      TYR 106 -10.859  -2.121  -9.553
  826    HE1  TYR 106           1HE      TYR 106 -11.147   2.329  -7.387
  827    HE2  TYR 106           2HE      TYR 106 -11.691  -0.171 -10.835
  828    HH   TYR 106           HH       TYR 106 -11.292   2.499 -10.587
  829    HA   PRO 107           HA       PRO 107  -5.489  -0.037  -8.526
  830   1HB   PRO 107          2HB       PRO 107  -6.456   1.037 -11.008
  831   2HB   PRO 107          1HB       PRO 107  -5.086  -0.046 -10.754
  832   1HG   PRO 107          2HG       PRO 107  -7.571  -0.675 -11.989
  833   2HG   PRO 107          1HG       PRO 107  -6.246  -1.784 -11.621
  834   1HD   PRO 107          2HD       PRO 107  -8.835  -1.546 -10.301
  835   2HD   PRO 107          1HD       PRO 107  -7.574  -2.779 -10.060
  836    H    VAL 108           H        VAL 108  -5.600   1.864  -7.412
  837    HA   VAL 108           HA       VAL 108  -7.824   3.780  -7.983
  838    HB   VAL 108           HB       VAL 108  -6.745   2.881  -5.287
  839   1HG1  VAL 108          1HG1      VAL 108  -7.324   5.083  -4.854
  840   2HG1  VAL 108          2HG1      VAL 108  -8.890   4.305  -4.627
  841   3HG1  VAL 108          3HG1      VAL 108  -8.527   5.130  -6.142
  842   1HG2  VAL 108          1HG2      VAL 108  -8.336   1.295  -5.424
  843   2HG2  VAL 108          2HG2      VAL 108  -8.854   1.911  -6.992
  844   3HG2  VAL 108          3HG2      VAL 108  -9.553   2.567  -5.513
  845    H    SER 109           H        SER 109  -7.120   5.987  -7.922
  846    HA   SER 109           HA       SER 109  -4.175   6.360  -7.768
  847   1HB   SER 109          2HB       SER 109  -6.506   7.916  -8.905
  848   2HB   SER 109          1HB       SER 109  -4.888   8.608  -8.806
  849    HG   SER 109           HG       SER 109  -4.494   7.549 -10.565
  850    H    GLN 110           H        GLN 110  -6.658   8.792  -7.112
  851    HA   GLN 110           HA       GLN 110  -5.745   8.998  -4.304
  852   1HB   GLN 110          2HB       GLN 110  -5.970  11.398  -6.119
  853   2HB   GLN 110          1HB       GLN 110  -5.091  11.262  -4.597
  854   1HG   GLN 110          2HG       GLN 110  -3.659   9.478  -5.804
  855   2HG   GLN 110          1HG       GLN 110  -4.357  10.117  -7.292
  856   1HE2  GLN 110          1HE2      GLN 110  -1.625  10.402  -5.505
  857   2HE2  GLN 110          2HE2      GLN 110  -1.240  12.031  -5.788
  858    H    GLN 111           H        GLN 111  -7.199  11.697  -4.320
  859    HA   GLN 111           HA       GLN 111  -9.784  10.728  -3.514
  860   1HB   GLN 111          2HB       GLN 111  -8.742  13.509  -4.128
  861   2HB   GLN 111          1HB       GLN 111 -10.220  13.154  -3.229
  862   1HG   GLN 111          2HG       GLN 111  -9.080  12.468  -1.355
  863   2HG   GLN 111          1HG       GLN 111  -7.719  11.839  -2.284
  864   1HE2  GLN 111          1HE2      GLN 111  -9.256  15.004  -1.469
  865   2HE2  GLN 111          2HE2      GLN 111  -7.792  15.861  -1.402
  866    H    ASN 112           H        ASN 112  -9.874   9.647  -5.894
  867    HA   ASN 112           HA       ASN 112 -11.251  11.537  -7.731
  868   1HB   ASN 112          2HB       ASN 112  -9.085  10.189  -8.303
  869   2HB   ASN 112          1HB       ASN 112 -10.184   8.819  -8.454
  870   1HD2  ASN 112          1HD2      ASN 112  -8.687  10.139 -10.660
  871   2HD2  ASN 112          2HD2      ASN 112  -9.858  10.712 -11.747
  872    H    LYS 113           H        LYS 113 -11.397   8.346  -6.205
  873    HA   LYS 113           HA       LYS 113 -13.207   6.868  -5.858
  874   1HB   LYS 113          2HB       LYS 113 -14.936   9.317  -6.235
  875   2HB   LYS 113          1HB       LYS 113 -15.165   7.977  -5.113
  876   1HG   LYS 113          2HG       LYS 113 -12.963  10.064  -4.964
  877   2HG   LYS 113          1HG       LYS 113 -14.373   9.970  -3.910
  878   1HD   LYS 113          2HD       LYS 113 -13.504   8.266  -2.682
  879   2HD   LYS 113          1HD       LYS 113 -12.797   7.475  -4.087
  880   1HE   LYS 113          2HE       LYS 113 -11.017   8.310  -2.581
  881   2HE   LYS 113          1HE       LYS 113 -10.982   9.199  -4.114
  882   1HZ   LYS 113          1HZ       LYS 113 -12.105  11.003  -3.184
  883   2HZ   LYS 113          2HZ       LYS 113 -10.993  10.568  -1.976
  884   3HZ   LYS 113          3HZ       LYS 113 -12.624  10.121  -1.834
  885    H    ASN 114           H        ASN 114 -15.596   6.442  -6.870
  886    HA   ASN 114           HA       ASN 114 -15.389   6.778  -9.841
  887   1HB   ASN 114          2HB       ASN 114 -15.206   4.435  -8.198
  888   2HB   ASN 114          1HB       ASN 114 -16.660   4.322  -9.186
  889   1HD2  ASN 114          1HD2      ASN 114 -16.305   3.471 -11.237
  890   2HD2  ASN 114          2HD2      ASN 114 -14.829   3.525 -12.074
  891    H    ALA 115           H        ALA 115 -17.764   5.508 -10.513
  892    HA   ALA 115           HA       ALA 115 -20.068   5.991 -10.731
  893   1HB   ALA 115          1HB       ALA 115 -19.423   5.875  -7.803
  894   2HB   ALA 115          2HB       ALA 115 -20.385   4.762  -8.774
  895   3HB   ALA 115          3HB       ALA 115 -21.057   6.321  -8.293
  896    HA   PRO 116           HA       PRO 116 -19.056  10.579 -10.306
  897   1HB   PRO 116          2HB       PRO 116 -19.852  10.809 -13.063
  898   2HB   PRO 116          1HB       PRO 116 -18.244  11.043 -12.373
  899   1HG   PRO 116          2HG       PRO 116 -19.155   8.868 -14.006
  900   2HG   PRO 116          1HG       PRO 116 -17.550   9.102 -13.307
  901   1HD   PRO 116          2HD       PRO 116 -19.556   7.180 -12.527
  902   2HD   PRO 116          1HD       PRO 116 -17.940   7.421 -11.819
  903    H    SER 117           H        SER 117 -21.052  10.478  -8.974
  904    HA   SER 117           HA       SER 117 -23.668  10.414 -10.297
  905   1HB   SER 117          2HB       SER 117 -22.591  10.000  -7.737
  906   2HB   SER 117          1HB       SER 117 -23.588  11.441  -7.572
  907    HG   SER 117           HG       SER 117 -24.287   8.819  -8.155
  908    H    THR 118           H        THR 118 -21.500  12.876  -8.938
  909    HA   THR 118           HA       THR 118 -23.410  15.064  -9.234
  910    HB   THR 118           HB       THR 118 -21.253  16.379  -8.779
  911    HG1  THR 118           1HG      THR 118 -19.645  15.123  -9.421
  912   1HG2  THR 118          1HG2      THR 118 -22.398  14.231  -7.029
  913   2HG2  THR 118          2HG2      THR 118 -22.496  15.984  -6.855
  914   3HG2  THR 118          3HG2      THR 118 -20.997  15.141  -6.464
  Start of MODEL    8
    1    H    THR   1           1H       THR   1  19.419  -8.651  -8.726
    2    HA   THR   1           HA       THR   1  18.205  -9.233 -10.841
    3    HB   THR   1           HB       THR   1  16.979 -11.092  -9.508
    4    HG1  THR   1           1HG      THR   1  16.790 -10.738  -7.465
    5   1HG2  THR   1          1HG2      THR   1  19.850 -10.404  -9.625
    6   2HG2  THR   1          2HG2      THR   1  19.024 -11.885 -10.109
    7   3HG2  THR   1          3HG2      THR   1  19.422 -11.611  -8.413
    8    H    GLU   2           H        GLU   2  16.385  -8.745 -12.001
    9    HA   GLU   2           HA       GLU   2  14.226  -7.933 -12.512
   10   1HB   GLU   2          2HB       GLU   2  14.119  -9.930 -10.542
   11   2HB   GLU   2          1HB       GLU   2  13.043  -8.664  -9.950
   12   1HG   GLU   2          2HG       GLU   2  11.526  -9.685 -11.320
   13   2HG   GLU   2          1HG       GLU   2  12.319  -8.722 -12.568
   14    H    ALA   3           H        ALA   3  14.557  -5.673 -12.469
   15    HA   ALA   3           HA       ALA   3  14.086  -4.294  -9.845
   16   1HB   ALA   3          1HB       ALA   3  15.493  -2.567 -10.695
   17   2HB   ALA   3          2HB       ALA   3  15.332  -3.147 -12.353
   18   3HB   ALA   3          3HB       ALA   3  16.280  -4.067 -11.185
   19    H    GLU   4           H        GLU   4  13.606  -1.749 -11.149
   20    HA   GLU   4           HA       GLU   4  11.364  -1.981 -12.991
   21   1HB   GLU   4          2HB       GLU   4   9.699  -1.178 -11.234
   22   2HB   GLU   4          1HB       GLU   4  10.251  -2.840 -11.033
   23   1HG   GLU   4          2HG       GLU   4  11.315  -2.378  -9.081
   24   2HG   GLU   4          1HG       GLU   4  11.960  -0.854  -9.690
   25    H    ASP   5           H        ASP   5  10.268   0.236 -13.205
   26    HA   ASP   5           HA       ASP   5  12.024   2.471 -12.284
   27   1HB   ASP   5          2HB       ASP   5  12.082   3.319 -14.592
   28   2HB   ASP   5          1HB       ASP   5  12.706   1.672 -14.544
   29    H    SER   6           H        SER   6  10.631   4.435 -13.859
   30    HA   SER   6           HA       SER   6   7.977   4.412 -12.469
   31   1HB   SER   6          2HB       SER   6   9.866   6.589 -13.396
   32   2HB   SER   6          1HB       SER   6   8.236   6.928 -12.822
   33    HG   SER   6           HG       SER   6   9.771   7.052 -11.137
   34    H    ILE   7           H        ILE   7   7.898   2.968 -14.779
   35    HA   ILE   7           HA       ILE   7   6.977   4.820 -16.933
   36    HB   ILE   7           HB       ILE   7   8.713   3.088 -17.407
   37   1HG1  ILE   7          2HG1      ILE   7   7.363   1.969 -19.318
   38   2HG1  ILE   7          1HG1      ILE   7   6.012   2.946 -18.739
   39   1HG2  ILE   7          1HG2      ILE   7   7.837   1.395 -15.780
   40   2HG2  ILE   7          2HG2      ILE   7   8.115   0.728 -17.387
   41   3HG2  ILE   7          3HG2      ILE   7   6.476   1.112 -16.864
   42   1HD1  ILE   7          1HD1      ILE   7   7.375   4.027 -20.576
   43   2HD1  ILE   7          2HD1      ILE   7   8.721   4.103 -19.440
   44   3HD1  ILE   7          3HD1      ILE   7   7.234   4.990 -19.105
   45    H    GLU   8           H        GLU   8   5.930   2.017 -14.996
   46    HA   GLU   8           HA       GLU   8   3.244   2.053 -16.159
   47   1HB   GLU   8          2HB       GLU   8   4.532   0.528 -13.875
   48   2HB   GLU   8          1HB       GLU   8   2.932   0.182 -14.532
   49   1HG   GLU   8          2HG       GLU   8   4.335   0.149 -16.825
   50   2HG   GLU   8          1HG       GLU   8   5.617  -0.334 -15.713
   51    H    MET   9           H        MET   9   1.491   3.114 -15.244
   52    HA   MET   9           HA       MET   9   1.419   3.806 -12.421
   53   1HB   MET   9          2HB       MET   9   1.198   6.337 -13.208
   54   2HB   MET   9          1HB       MET   9   2.776   5.626 -12.892
   55   1HG   MET   9          2HG       MET   9   2.893   6.798 -15.006
   56   2HG   MET   9          1HG       MET   9   2.940   5.073 -15.347
   57   1HE   MET   9          1HE       MET   9   0.979   4.989 -18.169
   58   2HE   MET   9          2HE       MET   9   0.636   3.828 -16.890
   59   3HE   MET   9          3HE       MET   9   2.274   4.442 -17.098
   60    H    TYR  10           H        TYR  10  -0.415   2.299 -13.788
   61    HA   TYR  10           HA       TYR  10  -2.555   3.560 -15.117
   62   1HB   TYR  10          2HB       TYR  10  -2.247   1.197 -13.280
   63   2HB   TYR  10          1HB       TYR  10  -3.850   1.640 -13.867
   64    HD1  TYR  10           1HD      TYR  10  -4.506   1.232 -16.128
   65    HD2  TYR  10           2HD      TYR  10  -0.421   0.673 -14.926
   66    HE1  TYR  10           1HE      TYR  10  -4.019   0.127 -18.295
   67    HE2  TYR  10           2HE      TYR  10   0.066  -0.432 -17.092
   68    HH   TYR  10           HH       TYR  10  -1.744  -1.787 -18.911
   69    H    GLU  11           H        GLU  11  -2.789   2.596 -11.685
   70    HA   GLU  11           HA       GLU  11  -3.832   5.285 -10.970
   71   1HB   GLU  11          2HB       GLU  11  -5.570   3.382 -11.799
   72   2HB   GLU  11          1HB       GLU  11  -5.451   2.948 -10.098
   73   1HG   GLU  11          2HG       GLU  11  -7.069   4.520  -9.837
   74   2HG   GLU  11          1HG       GLU  11  -5.712   5.641  -9.898
   75    H    TRP  12           H        TRP  12  -3.371   1.943  -9.792
   76    HA   TRP  12           HA       TRP  12  -3.182   2.416  -7.042
   77   1HB   TRP  12          2HB       TRP  12  -1.860   0.317  -7.056
   78   2HB   TRP  12          1HB       TRP  12  -3.249   0.217  -8.135
   79    HD1  TRP  12           HD       TRP  12  -2.803   0.110 -10.725
   80    HE1  TRP  12           1HE      TRP  12  -0.676  -0.310 -12.121
   81    HE3  TRP  12           3HE      TRP  12   0.755   0.724  -7.115
   82    HZ2  TRP  12           2HZ      TRP  12   2.161  -0.377 -11.753
   83    HZ3  TRP  12           3HZ      TRP  12   3.158   0.476  -7.663
   84    HH2  TRP  12           HH       TRP  12   3.866  -0.073  -9.975
   85    H    TYR  13           H        TYR  13  -0.860   3.244  -9.528
   86    HA   TYR  13           HA       TYR  13   1.388   3.515  -7.654
   87   1HB   TYR  13          2HB       TYR  13   1.441   2.902 -10.139
   88   2HB   TYR  13          1HB       TYR  13   1.100   4.604 -10.466
   89    HD1  TYR  13           1HD      TYR  13   3.345   2.636  -8.183
   90    HD2  TYR  13           2HD      TYR  13   2.958   5.917 -10.926
   91    HE1  TYR  13           1HE      TYR  13   5.743   3.179  -7.869
   92    HE2  TYR  13           2HE      TYR  13   5.358   6.461 -10.614
   93    HH   TYR  13           HH       TYR  13   7.544   4.339  -9.158
   94    H    SER  14           H        SER  14   2.013   5.404  -6.629
   95    HA   SER  14           HA       SER  14   0.772   7.984  -7.464
   96   1HB   SER  14          2HB       SER  14   0.831   7.098  -4.583
   97   2HB   SER  14          1HB       SER  14  -0.139   8.370  -5.317
   98    HG   SER  14           HG       SER  14  -1.422   6.856  -6.251
   99    H    LYS  15           H        LYS  15   2.292   9.577  -7.413
  100    HA   LYS  15           HA       LYS  15   4.968   9.008  -6.347
  101   1HB   LYS  15          2HB       LYS  15   3.683  10.702  -8.316
  102   2HB   LYS  15          1HB       LYS  15   4.769  11.654  -7.304
  103   1HG   LYS  15          2HG       LYS  15   5.869  10.637  -9.339
  104   2HG   LYS  15          1HG       LYS  15   6.631  10.206  -7.808
  105   1HD   LYS  15          2HD       LYS  15   4.481   8.360  -8.548
  106   2HD   LYS  15          1HD       LYS  15   5.773   8.410  -9.746
  107   1HE   LYS  15          2HE       LYS  15   7.163   7.251  -8.383
  108   2HE   LYS  15          1HE       LYS  15   6.864   8.374  -7.045
  109   1HZ   LYS  15          1HZ       LYS  15   6.005   5.880  -6.990
  110   2HZ   LYS  15          2HZ       LYS  15   4.681   6.578  -7.792
  111   3HZ   LYS  15          3HZ       LYS  15   5.144   7.143  -6.259
  112    H    HIS  16           H        HIS  16   5.267   9.314  -4.202
  113    HA   HIS  16           HA       HIS  16   5.323  10.363  -2.102
  114   1HB   HIS  16          2HB       HIS  16   4.740  12.749  -3.884
  115   2HB   HIS  16          1HB       HIS  16   5.334  12.839  -2.227
  116    HD1  HIS  16           1HD      HIS  16   7.384  10.479  -2.397
  117    HD2  HIS  16           2HD      HIS  16   7.085  13.557  -5.194
  118    HE1  HIS  16           1HE      HIS  16   9.628  10.608  -3.565
  119    H    MET  17           H        MET  17   2.871   9.112  -2.697
  120    HA   MET  17           HA       MET  17   0.658  10.965  -2.162
  121   1HB   MET  17          2HB       MET  17   0.472   8.905  -3.537
  122   2HB   MET  17          1HB       MET  17   0.856   7.934  -2.117
  123   1HG   MET  17          2HG       MET  17  -1.146   8.727  -0.976
  124   2HG   MET  17          1HG       MET  17  -1.509   9.820  -2.313
  125   1HE   MET  17          1HE       MET  17  -0.279   5.827  -2.933
  126   2HE   MET  17          2HE       MET  17  -1.663   5.355  -1.949
  127   3HE   MET  17          3HE       MET  17  -0.486   6.500  -1.309
  128    H    THR  18           H        THR  18  -0.747  10.578  -0.180
  129    HA   THR  18           HA       THR  18   1.001  10.197   2.209
  130    HB   THR  18           HB       THR  18  -1.791  11.339   2.113
  131    HG1  THR  18           1HG      THR  18   0.679  12.577   1.490
  132   1HG2  THR  18          1HG2      THR  18   0.566  12.120   3.829
  133   2HG2  THR  18          2HG2      THR  18  -0.532  10.816   4.281
  134   3HG2  THR  18          3HG2      THR  18  -1.142  12.461   4.105
  135    H    ARG  19           H        ARG  19   0.640   8.521   3.603
  136    HA   ARG  19           HA       ARG  19  -0.819   6.206   3.049
  137   1HB   ARG  19          2HB       ARG  19  -0.539   5.762   5.448
  138   2HB   ARG  19          1HB       ARG  19   0.893   6.595   4.843
  139   1HG   ARG  19          2HG       ARG  19  -0.229   8.779   5.592
  140   2HG   ARG  19          1HG       ARG  19  -1.397   7.772   6.451
  141   1HD   ARG  19          2HD       ARG  19   0.072   7.444   8.148
  142   2HD   ARG  19          1HD       ARG  19   1.318   6.881   7.015
  143    HE   ARG  19           HE       ARG  19   1.734   9.358   6.538
  144   1HH1  ARG  19          1HH2      ARG  19   2.851   8.547   9.204
  145   2HH1  ARG  19          2HH2      ARG  19   2.225   9.781  10.246
  146   1HH2  ARG  19          1HH1      ARG  19  -0.187  10.836   7.990
  147   2HH2  ARG  19          2HH1      ARG  19   0.505  11.077   9.559
  148    H    SER  20           H        SER  20  -1.873   9.102   4.765
  149    HA   SER  20           HA       SER  20  -4.475   8.121   5.523
  150   1HB   SER  20          2HB       SER  20  -4.029   9.928   6.807
  151   2HB   SER  20          1HB       SER  20  -2.776  10.476   5.702
  152    HG   SER  20           HG       SER  20  -4.988  11.669   6.084
  153    H    GLN  21           H        GLN  21  -3.237  10.031   2.777
  154    HA   GLN  21           HA       GLN  21  -5.739  10.647   1.554
  155   1HB   GLN  21          2HB       GLN  21  -2.905  10.230   0.599
  156   2HB   GLN  21          1HB       GLN  21  -4.191  10.632  -0.539
  157   1HG   GLN  21          2HG       GLN  21  -3.959  12.284   1.939
  158   2HG   GLN  21          1HG       GLN  21  -2.767  12.536   0.664
  159   1HE2  GLN  21          1HE2      GLN  21  -6.056  13.136   1.601
  160   2HE2  GLN  21          2HE2      GLN  21  -6.546  13.899   0.166
  161    H    ALA  22           H        ALA  22  -3.616   7.804   1.320
  162    HA   ALA  22           HA       ALA  22  -5.128   6.417  -0.680
  163   1HB   ALA  22          1HB       ALA  22  -2.743   6.067   0.516
  164   2HB   ALA  22          2HB       ALA  22  -3.594   4.729  -0.255
  165   3HB   ALA  22          3HB       ALA  22  -3.694   4.948   1.492
  166    H    GLU  23           H        GLU  23  -5.163   6.275   2.885
  167    HA   GLU  23           HA       GLU  23  -7.199   4.353   3.249
  168   1HB   GLU  23          2HB       GLU  23  -6.434   6.860   4.774
  169   2HB   GLU  23          1HB       GLU  23  -7.579   5.674   5.399
  170   1HG   GLU  23          2HG       GLU  23  -5.827   3.918   5.175
  171   2HG   GLU  23          1HG       GLU  23  -4.690   5.161   4.658
  172    H    GLN  24           H        GLN  24  -7.589   7.927   3.086
  173    HA   GLN  24           HA       GLN  24 -10.443   7.822   3.167
  174   1HB   GLN  24          2HB       GLN  24 -10.268  10.190   2.489
  175   2HB   GLN  24          1HB       GLN  24  -9.098   9.799   3.745
  176   1HG   GLN  24          2HG       GLN  24  -7.361   9.503   1.984
  177   2HG   GLN  24          1HG       GLN  24  -8.541  10.006   0.774
  178   1HE2  GLN  24          1HE2      GLN  24  -8.894  12.248   0.509
  179   2HE2  GLN  24          2HE2      GLN  24  -8.177  13.438   1.484
  180    H    LEU  25           H        LEU  25  -8.211   8.161   0.338
  181    HA   LEU  25           HA       LEU  25 -10.432   8.173  -1.509
  182   1HB   LEU  25          2HB       LEU  25  -8.703   7.999  -3.210
  183   2HB   LEU  25          1HB       LEU  25  -8.151   9.097  -1.951
  184    HG   LEU  25           HG       LEU  25  -7.089   6.911  -0.929
  185   1HD1  LEU  25          1HD1      LEU  25  -7.081   5.075  -2.236
  186   2HD1  LEU  25          2HD1      LEU  25  -6.503   5.998  -3.621
  187   3HD1  LEU  25          3HD1      LEU  25  -8.231   5.897  -3.289
  188   1HD2  LEU  25          1HD2      LEU  25  -6.192   9.028  -2.571
  189   2HD2  LEU  25          2HD2      LEU  25  -5.453   7.570  -3.231
  190   3HD2  LEU  25          3HD2      LEU  25  -5.201   7.999  -1.542
  191    H    LEU  26           H        LEU  26  -8.679   5.651   0.151
  192    HA   LEU  26           HA       LEU  26  -9.527   3.493  -1.629
  193   1HB   LEU  26          2HB       LEU  26  -8.197   3.850   1.020
  194   2HB   LEU  26          1HB       LEU  26  -9.018   2.322   0.764
  195    HG   LEU  26           HG       LEU  26  -6.989   3.482  -1.162
  196   1HD1  LEU  26          1HD1      LEU  26  -5.854   1.223  -0.096
  197   2HD1  LEU  26          2HD1      LEU  26  -6.682   1.897   1.306
  198   3HD1  LEU  26          3HD1      LEU  26  -5.493   2.865   0.439
  199   1HD2  LEU  26          1HD2      LEU  26  -8.907   1.655  -1.700
  200   2HD2  LEU  26          2HD2      LEU  26  -7.668   0.585  -1.046
  201   3HD2  LEU  26          3HD2      LEU  26  -7.309   1.599  -2.443
  202    H    LYS  27           H        LYS  27 -10.471   4.458   1.697
  203    HA   LYS  27           HA       LYS  27 -12.845   2.923   1.910
  204   1HB   LYS  27          2HB       LYS  27 -11.395   4.674   3.425
  205   2HB   LYS  27          1HB       LYS  27 -12.815   5.654   3.059
  206   1HG   LYS  27          2HG       LYS  27 -13.389   2.860   3.851
  207   2HG   LYS  27          1HG       LYS  27 -12.699   3.873   5.120
  208   1HD   LYS  27          2HD       LYS  27 -14.526   5.259   5.199
  209   2HD   LYS  27          1HD       LYS  27 -14.869   5.078   3.478
  210   1HE   LYS  27          2HE       LYS  27 -16.623   3.826   4.360
  211   2HE   LYS  27          1HE       LYS  27 -15.388   2.556   4.244
  212   1HZ   LYS  27          1HZ       LYS  27 -16.164   2.522   6.466
  213   2HZ   LYS  27          2HZ       LYS  27 -16.069   4.212   6.611
  214   3HZ   LYS  27          3HZ       LYS  27 -14.650   3.282   6.514
  215    H    GLN  28           H        GLN  28 -12.293   6.160   0.558
  216    HA   GLN  28           HA       GLN  28 -15.016   6.877   0.086
  217   1HB   GLN  28          2HB       GLN  28 -13.063   8.397   0.070
  218   2HB   GLN  28          1HB       GLN  28 -12.493   7.640  -1.417
  219   1HG   GLN  28          2HG       GLN  28 -13.693   9.645  -2.036
  220   2HG   GLN  28          1HG       GLN  28 -14.702   8.267  -2.476
  221   1HE2  GLN  28          1HE2      GLN  28 -16.598   9.772  -2.286
  222   2HE2  GLN  28          2HE2      GLN  28 -17.221  10.135  -0.750
  223    H    GLU  29           H        GLU  29 -12.646   5.312  -2.160
  224    HA   GLU  29           HA       GLU  29 -14.419   5.146  -4.395
  225   1HB   GLU  29          2HB       GLU  29 -11.806   4.445  -3.791
  226   2HB   GLU  29          1HB       GLU  29 -12.568   2.873  -4.041
  227   1HG   GLU  29          2HG       GLU  29 -12.507   5.215  -5.957
  228   2HG   GLU  29          1HG       GLU  29 -11.731   3.655  -6.170
  229    H    GLY  30           H        GLY  30 -13.970   3.075  -1.563
  230   1HA   GLY  30          2HA       GLY  30 -15.569   1.696  -0.538
  231   2HA   GLY  30          1HA       GLY  30 -16.673   2.102  -1.843
  232    H    LYS  31           H        LYS  31 -13.609   0.857  -2.864
  233    HA   LYS  31           HA       LYS  31 -14.926  -1.543  -3.934
  234   1HB   LYS  31          2HB       LYS  31 -12.020  -0.664  -3.909
  235   2HB   LYS  31          1HB       LYS  31 -12.727  -1.879  -4.973
  236   1HG   LYS  31          2HG       LYS  31 -13.205   1.104  -4.959
  237   2HG   LYS  31          1HG       LYS  31 -12.659   0.091  -6.290
  238   1HD   LYS  31          2HD       LYS  31 -15.425   0.050  -5.050
  239   2HD   LYS  31          1HD       LYS  31 -15.004   0.718  -6.626
  240   1HE   LYS  31          2HE       LYS  31 -13.969  -1.829  -6.815
  241   2HE   LYS  31          1HE       LYS  31 -15.440  -2.092  -5.857
  242   1HZ   LYS  31          1HZ       LYS  31 -16.737  -0.946  -7.453
  243   2HZ   LYS  31          2HZ       LYS  31 -15.789  -2.053  -8.324
  244   3HZ   LYS  31          3HZ       LYS  31 -15.369  -0.407  -8.298
  245    H    GLU  32           H        GLU  32 -13.604  -3.697  -3.634
  246    HA   GLU  32           HA       GLU  32 -12.897  -3.967  -0.739
  247   1HB   GLU  32          2HB       GLU  32 -13.622  -6.395  -1.154
  248   2HB   GLU  32          1HB       GLU  32 -14.888  -5.173  -1.076
  249   1HG   GLU  32          2HG       GLU  32 -15.033  -5.081  -3.500
  250   2HG   GLU  32          1HG       GLU  32 -13.634  -6.142  -3.662
  251    H    GLY  33           H        GLY  33 -10.656  -3.599  -1.152
  252   1HA   GLY  33          2HA       GLY  33  -8.666  -5.106  -1.179
  253   2HA   GLY  33          1HA       GLY  33  -9.330  -5.776  -2.668
  254    H    GLY  34           H        GLY  34  -9.609  -2.330  -2.190
  255   1HA   GLY  34          2HA       GLY  34  -8.390  -1.609  -4.606
  256   2HA   GLY  34          1HA       GLY  34  -8.487  -0.532  -3.210
  257    H    PHE  35           H        PHE  35  -6.248  -0.916  -5.140
  258    HA   PHE  35           HA       PHE  35  -4.142  -1.601  -3.120
  259   1HB   PHE  35          2HB       PHE  35  -4.621  -3.485  -4.652
  260   2HB   PHE  35          1HB       PHE  35  -4.305  -2.436  -6.032
  261    HD1  PHE  35           1HD      PHE  35  -1.997  -1.352  -6.227
  262    HD2  PHE  35           2HD      PHE  35  -2.855  -4.587  -3.538
  263    HE1  PHE  35           1HE      PHE  35   0.427  -1.863  -6.068
  264    HE2  PHE  35           2HE      PHE  35  -0.433  -5.099  -3.378
  265    HZ   PHE  35           HZ       PHE  35   1.208  -3.736  -4.644
  266    H    ILE  36           H        ILE  36  -2.713   0.082  -2.933
  267    HA   ILE  36           HA       ILE  36  -2.109   1.734  -5.356
  268    HB   ILE  36           HB       ILE  36  -2.695   2.742  -2.550
  269   1HG1  ILE  36          2HG1      ILE  36  -4.306   2.915  -5.119
  270   2HG1  ILE  36          1HG1      ILE  36  -4.731   1.967  -3.694
  271   1HG2  ILE  36          1HG2      ILE  36  -2.096   4.181  -5.154
  272   2HG2  ILE  36          2HG2      ILE  36  -1.060   4.130  -3.729
  273   3HG2  ILE  36          3HG2      ILE  36  -2.607   4.972  -3.664
  274   1HD1  ILE  36          1HD1      ILE  36  -5.984   3.903  -3.349
  275   2HD1  ILE  36          2HD1      ILE  36  -4.754   4.949  -4.059
  276   3HD1  ILE  36          3HD1      ILE  36  -4.515   4.276  -2.446
  277    H    VAL  37           H        VAL  37  -0.000   2.928  -5.070
  278    HA   VAL  37           HA       VAL  37   1.748   1.933  -2.893
  279    HB   VAL  37           HB       VAL  37   2.336   1.534  -5.843
  280   1HG1  VAL  37          1HG1      VAL  37   3.823   0.645  -3.348
  281   2HG1  VAL  37          2HG1      VAL  37   4.330   1.944  -4.428
  282   3HG1  VAL  37          3HG1      VAL  37   4.290   0.279  -5.009
  283   1HG2  VAL  37          1HG2      VAL  37   2.199  -0.921  -5.165
  284   2HG2  VAL  37          2HG2      VAL  37   0.657  -0.066  -5.203
  285   3HG2  VAL  37          3HG2      VAL  37   1.454  -0.380  -3.662
  286    H    ARG  38           H        ARG  38   3.568   3.299  -2.547
  287    HA   ARG  38           HA       ARG  38   4.073   5.510  -4.462
  288   1HB   ARG  38          2HB       ARG  38   3.763   7.195  -2.645
  289   2HB   ARG  38          1HB       ARG  38   2.269   6.342  -3.026
  290   1HG   ARG  38          2HG       ARG  38   2.104   5.704  -0.873
  291   2HG   ARG  38          1HG       ARG  38   3.619   4.815  -1.035
  292   1HD   ARG  38          2HD       ARG  38   4.866   6.938  -0.548
  293   2HD   ARG  38          1HD       ARG  38   3.309   7.733  -0.243
  294    HE   ARG  38           HE       ARG  38   3.298   5.358   1.277
  295   1HH1  ARG  38          1HH2      ARG  38   6.238   6.376   1.425
  296   2HH1  ARG  38          2HH2      ARG  38   6.178   7.250   2.918
  297   1HH2  ARG  38          1HH1      ARG  38   2.713   7.313   3.048
  298   2HH2  ARG  38          2HH1      ARG  38   4.183   7.780   3.838
  299    H    ASP  39           H        ASP  39   6.090   6.651  -3.949
  300    HA   ASP  39           HA       ASP  39   8.148   4.881  -2.901
  301   1HB   ASP  39          2HB       ASP  39   8.219   6.617  -4.809
  302   2HB   ASP  39          1HB       ASP  39   8.394   7.826  -3.535
  303    H    SER  40           H        SER  40   9.690   5.591  -1.174
  304    HA   SER  40           HA       SER  40   8.237   6.960   1.059
  305   1HB   SER  40          2HB       SER  40   8.957   4.537   1.218
  306   2HB   SER  40          1HB       SER  40  10.627   5.095   1.138
  307    HG   SER  40           HG       SER  40  10.394   5.308   3.219
  308    H    SER  41           H        SER  41  10.875   7.124   2.518
  309    HA   SER  41           HA       SER  41  12.361   9.137   0.906
  310   1HB   SER  41          2HB       SER  41  11.017   9.645   3.579
  311   2HB   SER  41          1HB       SER  41  12.084  10.781   2.759
  312    HG   SER  41           HG       SER  41   9.809  11.111   2.357
  313    H    LYS  42           H        LYS  42  12.115   7.900   4.273
  314    HA   LYS  42           HA       LYS  42  14.845   8.181   4.971
  315   1HB   LYS  42          2HB       LYS  42  12.699   6.202   5.796
  316   2HB   LYS  42          1HB       LYS  42  14.238   6.372   6.641
  317   1HG   LYS  42          2HG       LYS  42  13.696   8.850   6.878
  318   2HG   LYS  42          1HG       LYS  42  12.069   8.457   6.320
  319   1HD   LYS  42          2HD       LYS  42  11.531   7.320   8.250
  320   2HD   LYS  42          1HD       LYS  42  13.192   6.796   8.529
  321   1HE   LYS  42          2HE       LYS  42  13.749   8.725   9.667
  322   2HE   LYS  42          1HE       LYS  42  12.650   9.731   8.703
  323   1HZ   LYS  42          1HZ       LYS  42  10.778   8.820   9.812
  324   2HZ   LYS  42          2HZ       LYS  42  11.877   9.276  11.025
  325   3HZ   LYS  42          3HZ       LYS  42  11.716   7.641  10.592
  326    H    ALA  43           H        ALA  43  13.308   5.035   4.218
  327    HA   ALA  43           HA       ALA  43  15.918   3.901   3.435
  328   1HB   ALA  43          1HB       ALA  43  14.844   2.036   4.138
  329   2HB   ALA  43          2HB       ALA  43  13.627   2.238   2.878
  330   3HB   ALA  43          3HB       ALA  43  13.410   3.014   4.446
  331    H    GLY  44           H        GLY  44  13.268   5.459   1.892
  332   1HA   GLY  44          2HA       GLY  44  12.901   5.914  -0.394
  333   2HA   GLY  44          1HA       GLY  44  14.450   5.126  -0.741
  334    H    LYS  45           H        LYS  45  11.956   3.590   1.159
  335    HA   LYS  45           HA       LYS  45  11.855   1.355  -0.752
  336   1HB   LYS  45          2HB       LYS  45  10.664   0.268   1.106
  337   2HB   LYS  45          1HB       LYS  45  12.129   1.053   1.696
  338   1HG   LYS  45          2HG       LYS  45   9.913   2.917   1.738
  339   2HG   LYS  45          1HG       LYS  45   9.493   1.453   2.624
  340   1HD   LYS  45          2HD       LYS  45  11.793   1.687   3.756
  341   2HD   LYS  45          1HD       LYS  45  11.811   3.326   3.104
  342   1HE   LYS  45          2HE       LYS  45  10.487   4.022   4.802
  343   2HE   LYS  45          1HE       LYS  45   9.244   2.849   4.323
  344   1HZ   LYS  45          1HZ       LYS  45  11.593   2.378   6.076
  345   2HZ   LYS  45          2HZ       LYS  45  10.656   1.120   5.423
  346   3HZ   LYS  45          3HZ       LYS  45   9.953   2.241   6.490
  347    H    TYR  46           H        TYR  46   9.302   0.405  -0.559
  348    HA   TYR  46           HA       TYR  46   7.617   2.672  -1.592
  349   1HB   TYR  46          2HB       TYR  46   7.737  -0.256  -2.383
  350   2HB   TYR  46          1HB       TYR  46   6.639   0.932  -3.079
  351    HD1  TYR  46           1HD      TYR  46  10.324   0.498  -2.405
  352    HD2  TYR  46           2HD      TYR  46   7.279   1.990  -5.046
  353    HE1  TYR  46           1HE      TYR  46  12.064   1.139  -4.042
  354    HE2  TYR  46           2HE      TYR  46   9.025   2.634  -6.683
  355    HH   TYR  46           HH       TYR  46  12.167   1.520  -6.561
  356    H    THR  47           H        THR  47   5.303   2.470  -1.139
  357    HA   THR  47           HA       THR  47   4.656   0.611   1.130
  358    HB   THR  47           HB       THR  47   3.798   3.490   0.669
  359    HG1  THR  47           1HG      THR  47   5.176   3.958   2.282
  360   1HG2  THR  47          1HG2      THR  47   3.096   2.924   3.227
  361   2HG2  THR  47          2HG2      THR  47   2.851   1.341   2.491
  362   3HG2  THR  47          3HG2      THR  47   1.989   2.746   1.865
  363    H    VAL  48           H        VAL  48   2.930  -0.696   0.662
  364    HA   VAL  48           HA       VAL  48   1.294  -0.036  -1.749
  365    HB   VAL  48           HB       VAL  48   1.672  -2.548  -0.096
  366   1HG1  VAL  48          1HG1      VAL  48   0.514  -3.668  -1.995
  367   2HG1  VAL  48          2HG1      VAL  48   0.175  -2.082  -2.690
  368   3HG1  VAL  48          3HG1      VAL  48  -0.536  -2.537  -1.141
  369   1HG2  VAL  48          1HG2      VAL  48   2.602  -1.959  -2.914
  370   2HG2  VAL  48          2HG2      VAL  48   3.077  -3.306  -1.880
  371   3HG2  VAL  48          3HG2      VAL  48   3.615  -1.670  -1.500
  372    H    SER  49           H        SER  49  -0.507   1.154  -1.205
  373    HA   SER  49           HA       SER  49  -1.873   0.718   1.392
  374   1HB   SER  49          2HB       SER  49  -1.710   2.765  -0.745
  375   2HB   SER  49          1HB       SER  49  -3.279   2.627   0.045
  376    HG   SER  49           HG       SER  49  -0.798   3.400   1.066
  377    H    VAL  50           H        VAL  50  -3.349  -0.977   1.391
  378    HA   VAL  50           HA       VAL  50  -5.136  -1.191  -1.010
  379    HB   VAL  50           HB       VAL  50  -5.108  -3.664  -0.511
  380   1HG1  VAL  50          1HG1      VAL  50  -2.792  -2.034  -1.397
  381   2HG1  VAL  50          2HG1      VAL  50  -3.661  -3.313  -2.245
  382   3HG1  VAL  50          3HG1      VAL  50  -2.449  -3.725  -1.033
  383   1HG2  VAL  50          1HG2      VAL  50  -3.884  -4.551   1.216
  384   2HG2  VAL  50          2HG2      VAL  50  -4.150  -2.959   1.923
  385   3HG2  VAL  50          3HG2      VAL  50  -2.634  -3.313   1.100
  386    H    PHE  51           H        PHE  51  -7.365  -1.321  -0.543
  387    HA   PHE  51           HA       PHE  51  -8.118  -1.750   2.332
  388   1HB   PHE  51          2HB       PHE  51  -8.731   0.424   2.451
  389   2HB   PHE  51          1HB       PHE  51  -8.140   0.663   0.813
  390    HD1  PHE  51           1HD      PHE  51 -11.051   0.548   2.913
  391    HD2  PHE  51           2HD      PHE  51  -9.716   0.020  -1.134
  392    HE1  PHE  51           1HE      PHE  51 -13.379   0.808   2.110
  393    HE2  PHE  51           2HE      PHE  51 -12.041   0.291  -1.937
  394    HZ   PHE  51           HZ       PHE  51 -13.875   0.683  -0.315
  395    H    ALA  52           H        ALA  52 -10.637  -1.962   2.453
  396    HA   ALA  52           HA       ALA  52 -11.994  -2.904   0.055
  397   1HB   ALA  52          1HB       ALA  52 -11.238  -4.882   2.224
  398   2HB   ALA  52          2HB       ALA  52 -10.550  -4.830   0.601
  399   3HB   ALA  52          3HB       ALA  52 -12.252  -5.234   0.825
  400    H    LYS  53           H        LYS  53 -14.114  -4.204   0.971
  401    HA   LYS  53           HA       LYS  53 -15.209  -2.559   3.240
  402   1HB   LYS  53          2HB       LYS  53 -16.195  -3.279   0.487
  403   2HB   LYS  53          1HB       LYS  53 -17.353  -2.905   1.764
  404   1HG   LYS  53          2HG       LYS  53 -15.028  -1.080   1.150
  405   2HG   LYS  53          1HG       LYS  53 -16.566  -0.941   0.296
  406   1HD   LYS  53          2HD       LYS  53 -16.782  -1.140   3.235
  407   2HD   LYS  53          1HD       LYS  53 -16.018   0.336   2.644
  408   1HE   LYS  53          2HE       LYS  53 -18.624  -0.673   1.476
  409   2HE   LYS  53          1HE       LYS  53 -18.581   0.408   2.884
  410   1HZ   LYS  53          1HZ       LYS  53 -17.303   0.903   0.246
  411   2HZ   LYS  53          2HZ       LYS  53 -17.131   1.902   1.609
  412   3HZ   LYS  53          3HZ       LYS  53 -18.651   1.716   0.873
  413    H    SER  54           H        SER  54 -14.072  -5.305   3.430
  414    HA   SER  54           HA       SER  54 -16.416  -6.635   4.624
  415   1HB   SER  54          2HB       SER  54 -16.518  -7.154   2.190
  416   2HB   SER  54          1HB       SER  54 -14.904  -7.852   2.291
  417    HG   SER  54           HG       SER  54 -15.816  -9.602   2.984
  418    H    THR  55           H        THR  55 -14.807  -6.206   6.432
  419    HA   THR  55           HA       THR  55 -13.316  -8.617   7.075
  420    HB   THR  55           HB       THR  55 -11.493  -6.298   7.012
  421    HG1  THR  55           1HG      THR  55 -11.110  -6.529   4.789
  422   1HG2  THR  55          1HG2      THR  55 -11.266  -9.184   6.142
  423   2HG2  THR  55          2HG2      THR  55 -10.756  -8.524   7.696
  424   3HG2  THR  55          3HG2      THR  55  -9.926  -8.041   6.216
  425    H    GLY  56           H        GLY  56 -11.468  -6.910   8.840
  426   1HA   GLY  56          2HA       GLY  56 -12.968  -6.823  11.211
  427   2HA   GLY  56          1HA       GLY  56 -11.570  -5.783  10.916
  428    H    ASP  57           H        ASP  57 -12.777  -4.551   8.569
  429    HA   ASP  57           HA       ASP  57 -14.841  -2.812   9.869
  430   1HB   ASP  57          2HB       ASP  57 -12.328  -2.161   9.035
  431   2HB   ASP  57          1HB       ASP  57 -13.239  -1.887   7.552
  432    HA   PRO  58           HA       PRO  58 -16.771  -5.324   6.434
  433   1HB   PRO  58          2HB       PRO  58 -19.254  -4.420   7.580
  434   2HB   PRO  58          1HB       PRO  58 -18.586  -6.054   7.552
  435   1HG   PRO  58          2HG       PRO  58 -18.724  -4.201   9.771
  436   2HG   PRO  58          1HG       PRO  58 -18.201  -5.888   9.777
  437   1HD   PRO  58          2HD       PRO  58 -16.546  -3.627  10.135
  438   2HD   PRO  58          1HD       PRO  58 -15.994  -5.290   9.812
  439    H    GLN  59           H        GLN  59 -17.081  -2.013   7.463
  440    HA   GLN  59           HA       GLN  59 -18.300  -1.333   4.812
  441   1HB   GLN  59          2HB       GLN  59 -19.015   0.757   6.089
  442   2HB   GLN  59          1HB       GLN  59 -19.744  -0.752   6.641
  443   1HG   GLN  59          2HG       GLN  59 -18.370  -0.868   8.545
  444   2HG   GLN  59          1HG       GLN  59 -17.188   0.255   7.872
  445   1HE2  GLN  59          1HE2      GLN  59 -20.723   0.281   8.654
  446   2HE2  GLN  59          2HE2      GLN  59 -20.709   1.841   9.323
  447    H    GLY  60           H        GLY  60 -15.296  -1.576   5.668
  448   1HA   GLY  60          2HA       GLY  60 -14.129   0.192   3.970
  449   2HA   GLY  60          1HA       GLY  60 -14.412   1.194   5.385
  450    H    VAL  61           H        VAL  61 -12.507  -1.424   4.076
  451    HA   VAL  61           HA       VAL  61 -10.867  -1.454   6.592
  452    HB   VAL  61           HB       VAL  61 -11.056  -3.484   4.342
  453   1HG1  VAL  61          1HG1      VAL  61  -9.984  -3.943   7.120
  454   2HG1  VAL  61          2HG1      VAL  61  -8.949  -3.301   5.845
  455   3HG1  VAL  61          3HG1      VAL  61  -9.698  -4.886   5.658
  456   1HG2  VAL  61          1HG2      VAL  61 -12.300  -3.530   7.097
  457   2HG2  VAL  61          2HG2      VAL  61 -12.398  -4.815   5.898
  458   3HG2  VAL  61          3HG2      VAL  61 -13.171  -3.263   5.589
  459    H    ILE  62           H        ILE  62  -8.705  -1.079   6.433
  460    HA   ILE  62           HA       ILE  62  -7.495  -0.655   3.746
  461    HB   ILE  62           HB       ILE  62  -6.864   1.379   5.796
  462   1HG1  ILE  62          2HG1      ILE  62  -9.644   1.129   4.606
  463   2HG1  ILE  62          1HG1      ILE  62  -9.233   1.069   6.311
  464   1HG2  ILE  62          1HG2      ILE  62  -6.545   1.085   3.089
  465   2HG2  ILE  62          2HG2      ILE  62  -6.468   2.628   3.935
  466   3HG2  ILE  62          3HG2      ILE  62  -7.968   2.124   3.162
  467   1HD1  ILE  62          1HD1      ILE  62  -9.955   3.261   6.055
  468   2HD1  ILE  62          2HD1      ILE  62  -9.218   3.422   4.462
  469   3HD1  ILE  62          3HD1      ILE  62  -8.206   3.417   5.907
  470    H    ARG  63           H        ARG  63  -5.120  -0.526   3.858
  471    HA   ARG  63           HA       ARG  63  -3.634  -1.038   6.282
  472   1HB   ARG  63          2HB       ARG  63  -5.071  -3.199   5.403
  473   2HB   ARG  63          1HB       ARG  63  -3.544  -3.447   4.557
  474   1HG   ARG  63          2HG       ARG  63  -2.304  -3.470   6.598
  475   2HG   ARG  63          1HG       ARG  63  -3.674  -2.847   7.519
  476   1HD   ARG  63          2HD       ARG  63  -4.452  -5.277   6.145
  477   2HD   ARG  63          1HD       ARG  63  -3.005  -5.564   7.132
  478    HE   ARG  63           HE       ARG  63  -5.435  -4.213   8.248
  479   1HH1  ARG  63          1HH2      ARG  63  -2.498  -4.855   9.390
  480   2HH1  ARG  63          2HH2      ARG  63  -2.947  -6.039  10.572
  481   1HH2  ARG  63          1HH1      ARG  63  -6.167  -6.430   9.345
  482   2HH2  ARG  63          2HH1      ARG  63  -5.023  -6.931  10.546
  483    H    HIS  64           H        HIS  64  -1.775   0.045   5.685
  484    HA   HIS  64           HA       HIS  64  -0.924  -0.027   2.840
  485   1HB   HIS  64          2HB       HIS  64   0.419   1.525   5.042
  486   2HB   HIS  64          1HB       HIS  64   0.260   1.941   3.337
  487    HD1  HIS  64           1HD      HIS  64  -2.585   1.971   2.714
  488    HD2  HIS  64           2HD      HIS  64  -1.263   3.161   6.483
  489    HE1  HIS  64           1HE      HIS  64  -4.434   3.379   3.705
  490    H    TYR  65           H        TYR  65   0.267  -1.852   2.429
  491    HA   TYR  65           HA       TYR  65   2.127  -2.996   4.397
  492   1HB   TYR  65          2HB       TYR  65   1.898  -3.518   1.427
  493   2HB   TYR  65          1HB       TYR  65   2.492  -4.616   2.666
  494    HD1  TYR  65           1HD      TYR  65   0.259  -3.859   4.726
  495    HD2  TYR  65           2HD      TYR  65   0.169  -5.024   0.590
  496    HE1  TYR  65           1HE      TYR  65  -2.024  -4.769   5.032
  497    HE2  TYR  65           2HE      TYR  65  -2.114  -5.933   0.900
  498    HH   TYR  65           HH       TYR  65  -4.102  -5.176   3.167
  499    H    VAL  66           H        VAL  66   4.195  -2.226   4.625
  500    HA   VAL  66           HA       VAL  66   5.274  -0.531   2.406
  501    HB   VAL  66           HB       VAL  66   5.939  -0.590   5.369
  502   1HG1  VAL  66          1HG1      VAL  66   6.877   1.079   3.037
  503   2HG1  VAL  66          2HG1      VAL  66   7.843   0.270   4.271
  504   3HG1  VAL  66          3HG1      VAL  66   6.922   1.718   4.680
  505   1HG2  VAL  66          1HG2      VAL  66   4.443   1.156   5.680
  506   2HG2  VAL  66          2HG2      VAL  66   3.606   0.287   4.394
  507   3HG2  VAL  66          3HG2      VAL  66   4.580   1.705   4.010
  508    H    VAL  67           H        VAL  67   7.709  -0.598   2.252
  509    HA   VAL  67           HA       VAL  67   8.685  -3.396   2.682
  510    HB   VAL  67           HB       VAL  67   9.310  -1.282   0.598
  511   1HG1  VAL  67          1HG1      VAL  67  10.600  -3.886   1.309
  512   2HG1  VAL  67          2HG1      VAL  67  11.339  -2.390   0.742
  513   3HG1  VAL  67          3HG1      VAL  67  10.492  -3.440  -0.392
  514   1HG2  VAL  67          1HG2      VAL  67   7.456  -3.563   0.782
  515   2HG2  VAL  67          2HG2      VAL  67   8.460  -3.585  -0.668
  516   3HG2  VAL  67          3HG2      VAL  67   7.439  -2.189  -0.323
  517    H    CYS  68           H        CYS  68  10.348  -3.563   4.117
  518    HA   CYS  68           HA       CYS  68  11.713  -1.132   5.084
  519   1HB   CYS  68          2HB       CYS  68  10.814  -3.169   6.436
  520   2HB   CYS  68          1HB       CYS  68  12.258  -4.003   5.861
  521    HG   CYS  68           HG       CYS  68  12.260  -1.557   7.788
  522    H    SER  69           H        SER  69  14.105  -0.990   5.004
  523    HA   SER  69           HA       SER  69  15.296  -2.690   2.838
  524   1HB   SER  69          2HB       SER  69  15.161   0.276   3.242
  525   2HB   SER  69          1HB       SER  69  16.545  -0.410   2.392
  526    HG   SER  69           HG       SER  69  14.054   0.012   1.506
  527    H    THR  70           H        THR  70  17.397  -3.331   3.164
  528    HA   THR  70           HA       THR  70  18.710  -2.497   5.728
  529    HB   THR  70           HB       THR  70  17.881  -4.869   5.512
  530    HG1  THR  70           1HG      THR  70  19.479  -5.124   6.815
  531   1HG2  THR  70          1HG2      THR  70  20.108  -5.467   3.629
  532   2HG2  THR  70          2HG2      THR  70  18.639  -4.770   2.950
  533   3HG2  THR  70          3HG2      THR  70  18.565  -6.288   3.844
  534    HA   PRO  71           HA       PRO  71  21.988  -0.833   3.341
  535   1HB   PRO  71          2HB       PRO  71  24.103  -1.904   4.970
  536   2HB   PRO  71          1HB       PRO  71  23.422  -0.274   4.996
  537   1HG   PRO  71          2HG       PRO  71  23.108  -2.315   6.967
  538   2HG   PRO  71          1HG       PRO  71  22.356  -0.718   6.943
  539   1HD   PRO  71          2HD       PRO  71  21.118  -3.298   6.454
  540   2HD   PRO  71          1HD       PRO  71  20.337  -1.702   6.554
  541    H    GLN  72           H        GLN  72  21.509  -4.131   3.391
  542    HA   GLN  72           HA       GLN  72  23.957  -4.752   1.821
  543   1HB   GLN  72          2HB       GLN  72  23.165  -6.240   3.643
  544   2HB   GLN  72          1HB       GLN  72  21.628  -6.435   2.813
  545   1HG   GLN  72          2HG       GLN  72  22.783  -8.340   2.119
  546   2HG   GLN  72          1HG       GLN  72  23.134  -7.224   0.804
  547   1HE2  GLN  72          1HE2      GLN  72  24.501  -8.410   3.909
  548   2HE2  GLN  72          2HE2      GLN  72  26.121  -8.161   3.465
  549    H    SER  73           H        SER  73  21.639  -2.971   0.922
  550    HA   SER  73           HA       SER  73  20.424  -2.583  -1.058
  551   1HB   SER  73          2HB       SER  73  21.561  -3.280  -2.965
  552   2HB   SER  73          1HB       SER  73  22.817  -3.534  -1.760
  553    HG   SER  73           HG       SER  73  22.633  -5.619  -2.023
  554    H    GLN  74           H        GLN  74  19.098  -4.088   0.832
  555    HA   GLN  74           HA       GLN  74  17.627  -6.083  -0.845
  556   1HB   GLN  74          2HB       GLN  74  17.949  -6.568   2.068
  557   2HB   GLN  74          1HB       GLN  74  17.959  -7.722   0.739
  558   1HG   GLN  74          2HG       GLN  74  20.209  -6.627   0.086
  559   2HG   GLN  74          1HG       GLN  74  20.202  -5.960   1.716
  560   1HE2  GLN  74          1HE2      GLN  74  20.593  -8.908  -0.163
  561   2HE2  GLN  74          2HE2      GLN  74  20.999  -9.916   1.141
  562    H    TYR  75           H        TYR  75  15.434  -6.613   0.217
  563    HA   TYR  75           HA       TYR  75  14.334  -4.360   1.845
  564   1HB   TYR  75          2HB       TYR  75  13.124  -5.306  -0.760
  565   2HB   TYR  75          1HB       TYR  75  12.611  -3.931   0.207
  566    HD1  TYR  75           1HD      TYR  75  13.590  -1.804  -0.077
  567    HD2  TYR  75           2HD      TYR  75  15.449  -5.267  -1.796
  568    HE1  TYR  75           1HE      TYR  75  15.162  -0.351  -1.312
  569    HE2  TYR  75           2HE      TYR  75  17.026  -3.820  -3.025
  570    HH   TYR  75           HH       TYR  75  16.577  -0.456  -3.331
  571    H    TYR  76           H        TYR  76  12.204  -4.852   2.757
  572    HA   TYR  76           HA       TYR  76  10.803  -7.330   2.362
  573   1HB   TYR  76          2HB       TYR  76  11.520  -8.481   4.459
  574   2HB   TYR  76          1HB       TYR  76  12.868  -8.267   3.351
  575    HD1  TYR  76           1HD      TYR  76  14.757  -6.887   3.942
  576    HD2  TYR  76           2HD      TYR  76  11.237  -6.920   6.389
  577    HE1  TYR  76           1HE      TYR  76  15.977  -5.670   5.718
  578    HE2  TYR  76           2HE      TYR  76  12.449  -5.702   8.165
  579    HH   TYR  76           HH       TYR  76  14.461  -4.140   8.270
  580    H    LEU  77           H        LEU  77   9.032  -7.592   3.936
  581    HA   LEU  77           HA       LEU  77   8.328  -5.035   5.336
  582   1HB   LEU  77          2HB       LEU  77   6.881  -6.516   3.612
  583   2HB   LEU  77          1HB       LEU  77   6.497  -7.408   5.085
  584    HG   LEU  77           HG       LEU  77   6.335  -4.458   5.313
  585   1HD1  LEU  77          1HD1      LEU  77   4.049  -5.866   3.954
  586   2HD1  LEU  77          2HD1      LEU  77   5.365  -5.197   2.990
  587   3HD1  LEU  77          3HD1      LEU  77   4.405  -4.140   4.025
  588   1HD2  LEU  77          1HD2      LEU  77   4.185  -5.161   6.475
  589   2HD2  LEU  77          2HD2      LEU  77   5.663  -5.812   7.183
  590   3HD2  LEU  77          3HD2      LEU  77   4.653  -6.831   6.158
  591    H    ALA  78           H        ALA  78   9.704  -8.016   5.743
  592    HA   ALA  78           HA       ALA  78   9.682  -7.891   8.673
  593   1HB   ALA  78          1HB       ALA  78   8.672 -10.292   7.087
  594   2HB   ALA  78          2HB       ALA  78   7.647  -9.214   8.035
  595   3HB   ALA  78          3HB       ALA  78   8.848 -10.223   8.841
  596    H    GLU  79           H        GLU  79  11.862  -8.168   9.081
  597    HA   GLU  79           HA       GLU  79  13.861  -8.726   7.238
  598   1HB   GLU  79          2HB       GLU  79  13.533  -8.976  10.198
  599   2HB   GLU  79          1HB       GLU  79  14.991  -9.672   9.486
  600   1HG   GLU  79          2HG       GLU  79  15.336  -7.465   8.292
  601   2HG   GLU  79          1HG       GLU  79  14.035  -6.810   9.288
  602    H    LYS  80           H        LYS  80  11.663 -10.996   8.628
  603    HA   LYS  80           HA       LYS  80  12.896 -13.465   8.682
  604   1HB   LYS  80          2HB       LYS  80  10.285 -12.375   8.252
  605   2HB   LYS  80          1HB       LYS  80  10.508 -13.707   7.118
  606   1HG   LYS  80          2HG       LYS  80  11.467 -14.227   9.872
  607   2HG   LYS  80          1HG       LYS  80   9.721 -14.043   9.708
  608   1HD   LYS  80          2HD       LYS  80   9.592 -16.137   8.900
  609   2HD   LYS  80          1HD       LYS  80  10.593 -15.655   7.531
  610   1HE   LYS  80          2HE       LYS  80  12.613 -16.277   8.663
  611   2HE   LYS  80          1HE       LYS  80  11.767 -16.448  10.213
  612   1HZ   LYS  80          1HZ       LYS  80  12.113 -18.586   9.002
  613   2HZ   LYS  80          2HZ       LYS  80  11.079 -18.009   7.784
  614   3HZ   LYS  80          3HZ       LYS  80  10.491 -18.246   9.361
  615    H    HIS  81           H        HIS  81  12.000 -11.634   5.764
  616    HA   HIS  81           HA       HIS  81  13.984 -13.156   4.185
  617   1HB   HIS  81          2HB       HIS  81  10.985 -13.271   3.811
  618   2HB   HIS  81          1HB       HIS  81  12.091 -13.610   2.479
  619    HD1  HIS  81           1HD      HIS  81  10.372 -15.280   5.149
  620    HD2  HIS  81           2HD      HIS  81  14.113 -15.724   3.363
  621    HE1  HIS  81           1HE      HIS  81  11.185 -17.600   5.756
  622    H    LEU  82           H        LEU  82  14.745 -11.848   2.476
  623    HA   LEU  82           HA       LEU  82  13.170  -9.448   1.750
  624   1HB   LEU  82          2HB       LEU  82  15.028  -7.978   2.364
  625   2HB   LEU  82          1HB       LEU  82  14.573  -8.950   3.760
  626    HG   LEU  82           HG       LEU  82  16.771  -9.765   1.873
  627   1HD1  LEU  82          1HD1      LEU  82  16.843  -7.468   3.385
  628   2HD1  LEU  82          2HD1      LEU  82  18.265  -8.399   2.917
  629   3HD1  LEU  82          3HD1      LEU  82  17.529  -8.651   4.498
  630   1HD2  LEU  82          1HD2      LEU  82  17.321 -10.680   4.434
  631   2HD2  LEU  82          2HD2      LEU  82  16.569 -11.635   3.159
  632   3HD2  LEU  82          3HD2      LEU  82  15.564 -10.804   4.346
  633    H    PHE  83           H        PHE  83  13.643  -8.705  -0.335
  634    HA   PHE  83           HA       PHE  83  15.644 -10.325  -1.867
  635   1HB   PHE  83          2HB       PHE  83  12.938  -9.138  -2.501
  636   2HB   PHE  83          1HB       PHE  83  14.041  -9.638  -3.789
  637    HD1  PHE  83           1HD      PHE  83  12.598 -10.907  -0.568
  638    HD2  PHE  83           2HD      PHE  83  14.022 -11.863  -4.506
  639    HE1  PHE  83           1HE      PHE  83  11.944 -13.274  -0.231
  640    HE2  PHE  83           2HE      PHE  83  13.364 -14.228  -4.171
  641    HZ   PHE  83           HZ       PHE  83  12.326 -14.935  -2.033
  642    H    SER  84           H        SER  84  15.193  -8.338  -4.164
  643    HA   SER  84           HA       SER  84  16.988  -6.214  -3.047
  644   1HB   SER  84          2HB       SER  84  16.715  -7.506  -5.773
  645   2HB   SER  84          1HB       SER  84  17.734  -6.101  -5.477
  646    HG   SER  84           HG       SER  84  18.970  -7.947  -5.226
  647    H    THR  85           H        THR  85  13.790  -6.530  -3.916
  648    HA   THR  85           HA       THR  85  13.434  -3.658  -4.227
  649    HB   THR  85           HB       THR  85  12.535  -5.139  -6.666
  650    HG1  THR  85           1HG      THR  85  14.502  -5.773  -7.013
  651   1HG2  THR  85          1HG2      THR  85  13.938  -2.568  -6.874
  652   2HG2  THR  85          2HG2      THR  85  12.516  -2.523  -5.833
  653   3HG2  THR  85          3HG2      THR  85  12.366  -3.048  -7.510
  654    H    ILE  86           H        ILE  86  11.054  -3.139  -4.655
  655    HA   ILE  86           HA       ILE  86   9.306  -4.655  -3.003
  656    HB   ILE  86           HB       ILE  86   8.281  -3.061  -5.333
  657   1HG1  ILE  86          2HG1      ILE  86  10.149  -1.692  -4.624
  658   2HG1  ILE  86          1HG1      ILE  86   8.671  -0.991  -3.987
  659   1HG2  ILE  86          1HG2      ILE  86   7.463  -3.757  -2.565
  660   2HG2  ILE  86          2HG2      ILE  86   6.485  -3.594  -4.024
  661   3HG2  ILE  86          3HG2      ILE  86   7.006  -2.156  -3.146
  662   1HD1  ILE  86          1HD1      ILE  86   9.436  -1.175  -1.886
  663   2HD1  ILE  86          2HD1      ILE  86  10.962  -1.782  -2.527
  664   3HD1  ILE  86          3HD1      ILE  86   9.676  -2.908  -2.099
  665    HA   PRO  87           HA       PRO  87   7.475  -6.468  -7.163
  666   1HB   PRO  87          2HB       PRO  87   9.719  -6.741  -8.947
  667   2HB   PRO  87          1HB       PRO  87   8.235  -5.816  -9.193
  668   1HG   PRO  87          2HG       PRO  87  10.877  -4.817  -8.643
  669   2HG   PRO  87          1HG       PRO  87   9.401  -3.895  -8.944
  670   1HD   PRO  87          2HD       PRO  87  10.793  -4.186  -6.463
  671   2HD   PRO  87          1HD       PRO  87   9.249  -3.349  -6.739
  672    H    GLU  88           H        GLU  88  10.957  -7.093  -6.574
  673    HA   GLU  88           HA       GLU  88  10.889  -9.919  -6.936
  674   1HB   GLU  88          2HB       GLU  88  12.800  -8.117  -6.516
  675   2HB   GLU  88          1HB       GLU  88  12.597  -8.622  -4.837
  676   1HG   GLU  88          2HG       GLU  88  14.236 -10.106  -5.636
  677   2HG   GLU  88          1HG       GLU  88  12.746 -11.040  -5.783
  678    H    LEU  89           H        LEU  89  10.335  -7.910  -4.041
  679    HA   LEU  89           HA       LEU  89   9.948 -10.047  -2.174
  680   1HB   LEU  89          2HB       LEU  89   9.583  -7.151  -2.385
  681   2HB   LEU  89          1HB       LEU  89   8.329  -7.897  -1.395
  682    HG   LEU  89           HG       LEU  89  11.072  -8.881  -0.885
  683   1HD1  LEU  89          1HD1      LEU  89  10.685  -6.087  -1.119
  684   2HD1  LEU  89          2HD1      LEU  89  12.063  -6.918  -0.403
  685   3HD1  LEU  89          3HD1      LEU  89  10.704  -6.435   0.609
  686   1HD2  LEU  89          1HD2      LEU  89  10.237  -9.178   1.254
  687   2HD2  LEU  89          2HD2      LEU  89   8.727  -9.212   0.344
  688   3HD2  LEU  89          3HD2      LEU  89   9.225  -7.736   1.171
  689    H    ILE  90           H        ILE  90   7.509  -8.059  -3.910
  690    HA   ILE  90           HA       ILE  90   5.234  -9.607  -3.124
  691    HB   ILE  90           HB       ILE  90   5.788  -7.927  -5.595
  692   1HG1  ILE  90          2HG1      ILE  90   4.205  -6.992  -3.234
  693   2HG1  ILE  90          1HG1      ILE  90   5.962  -7.035  -3.087
  694   1HG2  ILE  90          1HG2      ILE  90   3.808  -9.061  -6.119
  695   2HG2  ILE  90          2HG2      ILE  90   3.199  -7.613  -5.319
  696   3HG2  ILE  90          3HG2      ILE  90   3.290  -9.136  -4.436
  697   1HD1  ILE  90          1HD1      ILE  90   6.278  -5.439  -4.748
  698   2HD1  ILE  90          2HD1      ILE  90   4.763  -4.881  -4.039
  699   3HD1  ILE  90          3HD1      ILE  90   4.746  -5.809  -5.538
  700    H    ASN  91           H        ASN  91   7.556  -9.938  -5.764
  701    HA   ASN  91           HA       ASN  91   6.199 -11.833  -7.393
  702   1HB   ASN  91          2HB       ASN  91   9.010 -10.998  -6.820
  703   2HB   ASN  91          1HB       ASN  91   8.779 -12.492  -7.730
  704   1HD2  ASN  91          1HD2      ASN  91   9.590 -11.477  -9.718
  705   2HD2  ASN  91          2HD2      ASN  91   8.651 -10.349 -10.569
  706    H    TYR  92           H        TYR  92   8.623 -12.452  -4.808
  707    HA   TYR  92           HA       TYR  92   8.151 -15.320  -4.855
  708   1HB   TYR  92          2HB       TYR  92   9.968 -15.348  -3.432
  709   2HB   TYR  92          1HB       TYR  92  10.175 -13.726  -4.085
  710    HD1  TYR  92           1HD      TYR  92   9.858 -11.776  -2.716
  711    HD2  TYR  92           2HD      TYR  92   8.887 -15.670  -1.203
  712    HE1  TYR  92           1HE      TYR  92   9.632 -10.836  -0.431
  713    HE2  TYR  92           2HE      TYR  92   8.658 -14.734   1.080
  714    HH   TYR  92           HH       TYR  92   9.807 -12.404   2.228
  715    H    HIS  93           H        HIS  93   6.615 -12.638  -3.282
  716    HA   HIS  93           HA       HIS  93   5.599 -13.821  -0.912
  717   1HB   HIS  93          2HB       HIS  93   5.487 -11.419  -1.659
  718   2HB   HIS  93          1HB       HIS  93   4.221 -11.881  -2.796
  719    HD1  HIS  93           1HD      HIS  93   2.590 -10.294  -1.404
  720    HD2  HIS  93           2HD      HIS  93   3.999 -13.630   0.661
  721    HE1  HIS  93           1HE      HIS  93   1.112 -10.549   0.637
  722    H    GLN  94           H        GLN  94   4.098 -13.693  -4.168
  723    HA   GLN  94           HA       GLN  94   2.579 -16.176  -3.470
  724   1HB   GLN  94          2HB       GLN  94   1.593 -13.516  -4.512
  725   2HB   GLN  94          1HB       GLN  94   0.655 -14.994  -4.729
  726   1HG   GLN  94          2HG       GLN  94   0.332 -15.280  -2.420
  727   2HG   GLN  94          1HG       GLN  94   1.694 -14.239  -2.006
  728   1HE2  GLN  94          1HE2      GLN  94  -1.693 -14.231  -3.065
  729   2HE2  GLN  94          2HE2      GLN  94  -1.962 -12.581  -2.769
  730    H    HIS  95           H        HIS  95   2.523 -14.005  -6.299
  731    HA   HIS  95           HA       HIS  95   4.167 -15.733  -7.961
  732   1HB   HIS  95          2HB       HIS  95   2.292 -16.593  -9.340
  733   2HB   HIS  95          1HB       HIS  95   2.145 -17.126  -7.665
  734    HD1  HIS  95           1HD      HIS  95   0.882 -14.270  -9.863
  735    HD2  HIS  95           2HD      HIS  95  -0.311 -16.510  -6.556
  736    HE1  HIS  95           1HE      HIS  95  -1.463 -13.506  -9.289
  737    H    ASN  96           H        ASN  96   4.026 -14.985 -10.309
  738    HA   ASN  96           HA       ASN  96   2.729 -12.387 -10.799
  739   1HB   ASN  96          2HB       ASN  96   4.797 -11.897  -9.475
  740   2HB   ASN  96          1HB       ASN  96   5.750 -12.673 -10.739
  741   1HD2  ASN  96          1HD2      ASN  96   6.686 -10.309 -10.754
  742   2HD2  ASN  96          2HD2      ASN  96   5.926  -9.210 -11.800
  743    H    SER  97           H        SER  97   1.824 -13.851 -12.494
  744    HA   SER  97           HA       SER  97   3.735 -14.599 -14.659
  745   1HB   SER  97          2HB       SER  97   2.187 -16.296 -13.772
  746   2HB   SER  97          1HB       SER  97   0.816 -15.251 -14.129
  747    HG   SER  97           HG       SER  97   2.647 -16.418 -15.959
  748    H    ALA  98           H        ALA  98   2.701 -14.274 -16.945
  749    HA   ALA  98           HA       ALA  98   1.994 -11.419 -17.199
  750   1HB   ALA  98          1HB       ALA  98   3.073 -13.628 -18.838
  751   2HB   ALA  98          2HB       ALA  98   3.458 -11.907 -18.882
  752   3HB   ALA  98          3HB       ALA  98   2.030 -12.513 -19.720
  753    H    GLY  99           H        GLY  99   0.705 -14.117 -19.132
  754   1HA   GLY  99          2HA       GLY  99  -1.493 -14.569 -19.823
  755   2HA   GLY  99          1HA       GLY  99  -1.936 -14.199 -18.155
  756    H    LEU 100           H        LEU 100  -2.993 -12.287 -17.741
  757    HA   LEU 100           HA       LEU 100  -3.058 -10.198 -19.874
  758   1HB   LEU 100          2HB       LEU 100  -5.288 -11.866 -18.752
  759   2HB   LEU 100          1HB       LEU 100  -5.633 -10.211 -19.251
  760    HG   LEU 100           HG       LEU 100  -4.184 -11.064 -21.385
  761   1HD1  LEU 100          1HD1      LEU 100  -4.412 -13.312 -21.831
  762   2HD1  LEU 100          2HD1      LEU 100  -5.917 -13.447 -20.921
  763   3HD1  LEU 100          3HD1      LEU 100  -4.373 -13.393 -20.070
  764   1HD2  LEU 100          1HD2      LEU 100  -7.097 -11.778 -21.301
  765   2HD2  LEU 100          2HD2      LEU 100  -6.194 -10.922 -22.551
  766   3HD2  LEU 100          3HD2      LEU 100  -6.628 -10.096 -21.055
  767    H    ILE 101           H        ILE 101  -1.563  -9.648 -17.761
  768    HA   ILE 101           HA       ILE 101  -1.287  -8.227 -15.892
  769    HB   ILE 101           HB       ILE 101  -3.886  -7.160 -17.048
  770   1HG1  ILE 101          2HG1      ILE 101  -1.134  -6.053 -17.562
  771   2HG1  ILE 101          1HG1      ILE 101  -1.727  -7.412 -18.518
  772   1HG2  ILE 101          1HG2      ILE 101  -3.688  -6.040 -15.016
  773   2HG2  ILE 101          2HG2      ILE 101  -2.747  -4.987 -16.072
  774   3HG2  ILE 101          3HG2      ILE 101  -1.927  -6.137 -15.017
  775   1HD1  ILE 101          1HD1      ILE 101  -3.314  -4.863 -18.154
  776   2HD1  ILE 101          2HD1      ILE 101  -3.595  -6.153 -19.324
  777   3HD1  ILE 101          3HD1      ILE 101  -2.189  -5.101 -19.492
  778    H    SER 102           H        SER 102  -2.120 -10.548 -14.912
  779    HA   SER 102           HA       SER 102  -4.563 -10.018 -13.259
  780   1HB   SER 102          2HB       SER 102  -3.951 -12.104 -14.894
  781   2HB   SER 102          1HB       SER 102  -3.294 -12.702 -13.373
  782    HG   SER 102           HG       SER 102  -5.934 -11.799 -13.904
  783    H    ARG 103           H        ARG 103  -3.647  -8.903 -11.484
  784    HA   ARG 103           HA       ARG 103  -2.197 -10.515  -9.535
  785   1HB   ARG 103          2HB       ARG 103  -0.410  -9.918 -11.139
  786   2HB   ARG 103          1HB       ARG 103  -0.806  -8.210 -10.943
  787   1HG   ARG 103          2HG       ARG 103   0.711  -8.189  -9.267
  788   2HG   ARG 103          1HG       ARG 103  -0.473  -9.098  -8.328
  789   1HD   ARG 103          2HD       ARG 103   0.508 -11.210  -9.003
  790   2HD   ARG 103          1HD       ARG 103   1.588 -10.391 -10.148
  791    HE   ARG 103           HE       ARG 103   2.936  -9.716  -8.320
  792   1HH1  ARG 103          1HH2      ARG 103   0.965  -8.335  -6.655
  793   2HH1  ARG 103          2HH2      ARG 103   0.840  -9.347  -5.255
  794   1HH2  ARG 103          1HH1      ARG 103   2.293 -12.097  -6.788
  795   2HH2  ARG 103          2HH1      ARG 103   1.593 -11.477  -5.330
  796    H    LEU 104           H        LEU 104  -2.261  -7.016 -10.309
  797    HA   LEU 104           HA       LEU 104  -2.711  -6.133  -7.640
  798   1HB   LEU 104          2HB       LEU 104  -1.923  -4.844  -9.681
  799   2HB   LEU 104          1HB       LEU 104  -3.605  -4.801 -10.213
  800    HG   LEU 104           HG       LEU 104  -3.012  -3.933  -7.417
  801   1HD1  LEU 104          1HD1      LEU 104  -1.493  -2.408  -8.123
  802   2HD1  LEU 104          2HD1      LEU 104  -2.858  -1.580  -8.870
  803   3HD1  LEU 104          3HD1      LEU 104  -1.875  -2.692  -9.821
  804   1HD2  LEU 104          1HD2      LEU 104  -4.717  -2.167  -8.832
  805   2HD2  LEU 104          2HD2      LEU 104  -5.187  -3.378  -7.641
  806   3HD2  LEU 104          3HD2      LEU 104  -5.157  -3.794  -9.354
  807    H    LYS 105           H        LYS 105  -4.729  -5.140  -6.787
  808    HA   LYS 105           HA       LYS 105  -7.094  -6.804  -7.446
  809   1HB   LYS 105          2HB       LYS 105  -6.240  -4.959  -5.217
  810   2HB   LYS 105          1HB       LYS 105  -7.906  -5.527  -5.334
  811   1HG   LYS 105          2HG       LYS 105  -7.101  -7.271  -4.091
  812   2HG   LYS 105          1HG       LYS 105  -6.597  -7.874  -5.670
  813   1HD   LYS 105          2HD       LYS 105  -4.490  -7.895  -4.860
  814   2HD   LYS 105          1HD       LYS 105  -4.544  -6.134  -4.933
  815   1HE   LYS 105          2HE       LYS 105  -4.977  -5.916  -2.653
  816   2HE   LYS 105          1HE       LYS 105  -5.728  -7.520  -2.540
  817   1HZ   LYS 105          1HZ       LYS 105  -3.517  -7.601  -1.605
  818   2HZ   LYS 105          2HZ       LYS 105  -2.850  -6.954  -3.027
  819   3HZ   LYS 105          3HZ       LYS 105  -3.552  -8.501  -3.042
  820    H    TYR 106           H        TYR 106  -7.060  -3.388  -6.373
  821    HA   TYR 106           HA       TYR 106  -8.583  -2.695  -8.861
  822   1HB   TYR 106          2HB       TYR 106 -10.214  -2.961  -7.147
  823   2HB   TYR 106          1HB       TYR 106  -9.192  -2.183  -5.948
  824    HD1  TYR 106           1HD      TYR 106 -10.566  -1.374  -9.351
  825    HD2  TYR 106           2HD      TYR 106  -9.795  -0.029  -5.348
  826    HE1  TYR 106           1HE      TYR 106 -11.575   0.824  -9.897
  827    HE2  TYR 106           2HE      TYR 106 -10.800   2.166  -5.890
  828    HH   TYR 106           HH       TYR 106 -11.133   3.415  -8.619
  829    HA   PRO 107           HA       PRO 107  -5.223   0.310  -8.843
  830   1HB   PRO 107          2HB       PRO 107  -6.429   1.534 -11.149
  831   2HB   PRO 107          1HB       PRO 107  -5.008   0.486 -11.088
  832   1HG   PRO 107          2HG       PRO 107  -7.587  -0.143 -12.141
  833   2HG   PRO 107          1HG       PRO 107  -6.188  -1.212 -12.006
  834   1HD   PRO 107          2HD       PRO 107  -8.637  -1.250 -10.446
  835   2HD   PRO 107          1HD       PRO 107  -7.273  -2.393 -10.388
  836    H    VAL 108           H        VAL 108  -5.214   2.172  -7.669
  837    HA   VAL 108           HA       VAL 108  -7.487   4.094  -7.895
  838    HB   VAL 108           HB       VAL 108  -6.275   3.215  -5.263
  839   1HG1  VAL 108          1HG1      VAL 108  -7.413   5.393  -5.285
  840   2HG1  VAL 108          2HG1      VAL 108  -8.343   4.223  -4.352
  841   3HG1  VAL 108          3HG1      VAL 108  -8.847   4.646  -5.988
  842   1HG2  VAL 108          1HG2      VAL 108  -7.305   1.222  -5.773
  843   2HG2  VAL 108          2HG2      VAL 108  -8.432   1.975  -6.898
  844   3HG2  VAL 108          3HG2      VAL 108  -8.709   2.098  -5.162
  845    H    SER 109           H        SER 109  -6.635   6.214  -8.011
  846    HA   SER 109           HA       SER 109  -3.705   6.512  -7.602
  847   1HB   SER 109          2HB       SER 109  -5.880   7.976  -9.074
  848   2HB   SER 109          1HB       SER 109  -4.364   8.801  -8.712
  849    HG   SER 109           HG       SER 109  -3.320   6.943  -9.704
  850    H    GLN 110           H        GLN 110  -6.272   8.929  -7.198
  851    HA   GLN 110           HA       GLN 110  -5.450   9.297  -4.375
  852   1HB   GLN 110          2HB       GLN 110  -5.737  11.560  -6.356
  853   2HB   GLN 110          1HB       GLN 110  -4.975  11.607  -4.767
  854   1HG   GLN 110          2HG       GLN 110  -3.370   9.798  -5.755
  855   2HG   GLN 110          1HG       GLN 110  -3.951  10.378  -7.317
  856   1HE2  GLN 110          1HE2      GLN 110  -2.076  11.276  -4.450
  857   2HE2  GLN 110          2HE2      GLN 110  -1.448  12.716  -5.093
  858    H    GLN 111           H        GLN 111  -7.745  10.175  -6.958
  859    HA   GLN 111           HA       GLN 111  -9.907  10.143  -4.954
  860   1HB   GLN 111          2HB       GLN 111 -10.718  12.333  -5.824
  861   2HB   GLN 111          1HB       GLN 111  -9.114  12.458  -5.092
  862   1HG   GLN 111          2HG       GLN 111  -8.113  12.953  -7.074
  863   2HG   GLN 111          1HG       GLN 111  -9.097  11.797  -7.972
  864   1HE2  GLN 111          1HE2      GLN 111  -9.772  13.247  -9.655
  865   2HE2  GLN 111          2HE2      GLN 111 -10.757  14.597  -9.359
  866    H    ASN 112           H        ASN 112  -9.352   8.212  -6.909
  867    HA   ASN 112           HA       ASN 112 -11.121   8.696  -9.203
  868   1HB   ASN 112          2HB       ASN 112  -8.821   7.501  -9.092
  869   2HB   ASN 112          1HB       ASN 112  -9.727   6.142  -8.429
  870   1HD2  ASN 112          1HD2      ASN 112 -11.381   5.133  -9.836
  871   2HD2  ASN 112          2HD2      ASN 112 -11.328   5.353 -11.519
  872    H    LYS 113           H        LYS 113 -12.853   8.913  -7.251
  873    HA   LYS 113           HA       LYS 113 -13.854   6.314  -6.277
  874   1HB   LYS 113          2HB       LYS 113 -15.213   9.005  -6.060
  875   2HB   LYS 113          1HB       LYS 113 -15.277   7.655  -4.931
  876   1HG   LYS 113          2HG       LYS 113 -12.864   9.414  -5.480
  877   2HG   LYS 113          1HG       LYS 113 -13.855   9.430  -4.025
  878   1HD   LYS 113          2HD       LYS 113 -13.000   7.420  -3.252
  879   2HD   LYS 113          1HD       LYS 113 -12.621   6.836  -4.868
  880   1HE   LYS 113          2HE       LYS 113 -10.567   7.443  -3.561
  881   2HE   LYS 113          1HE       LYS 113 -10.742   8.421  -5.028
  882   1HZ   LYS 113          1HZ       LYS 113 -11.844   9.238  -2.399
  883   2HZ   LYS 113          2HZ       LYS 113 -11.690  10.187  -3.798
  884   3HZ   LYS 113          3HZ       LYS 113 -10.307   9.713  -2.933
  885    H    ASN 114           H        ASN 114 -14.018   5.926  -8.884
  886    HA   ASN 114           HA       ASN 114 -16.854   5.791  -9.471
  887   1HB   ASN 114          2HB       ASN 114 -15.598   8.227  -9.964
  888   2HB   ASN 114          1HB       ASN 114 -15.637   7.439 -11.539
  889   1HD2  ASN 114          1HD2      ASN 114 -17.354   8.731 -12.435
  890   2HD2  ASN 114          2HD2      ASN 114 -18.942   8.672 -11.839
  891    H    ALA 115           H        ALA 115 -13.691   6.045 -11.139
  892    HA   ALA 115           HA       ALA 115 -12.694   4.636 -12.753
  893   1HB   ALA 115          1HB       ALA 115 -12.436   2.798 -11.452
  894   2HB   ALA 115          2HB       ALA 115 -13.896   2.167 -12.212
  895   3HB   ALA 115          3HB       ALA 115 -14.005   3.043 -10.687
  896    HA   PRO 116           HA       PRO 116 -16.570   4.986 -15.339
  897   1HB   PRO 116          2HB       PRO 116 -14.871   6.161 -17.344
  898   2HB   PRO 116          1HB       PRO 116 -16.150   6.942 -16.408
  899   1HG   PRO 116          2HG       PRO 116 -13.319   7.310 -16.157
  900   2HG   PRO 116          1HG       PRO 116 -14.600   8.070 -15.207
  901   1HD   PRO 116          2HD       PRO 116 -12.737   6.025 -14.366
  902   2HD   PRO 116          1HD       PRO 116 -14.013   6.809 -13.402
  903    H    SER 117           H        SER 117 -13.501   4.714 -17.150
  904    HA   SER 117           HA       SER 117 -14.381   1.993 -18.069
  905   1HB   SER 117          2HB       SER 117 -13.566   4.464 -19.443
  906   2HB   SER 117          1HB       SER 117 -12.729   3.029 -20.029
  907    HG   SER 117           HG       SER 117 -14.509   2.525 -21.003
  908    H    THR 118           H        THR 118 -12.640   0.475 -18.474
  909    HA   THR 118           HA       THR 118 -10.610  -0.594 -17.915
  910    HB   THR 118           HB       THR 118  -9.530   2.235 -18.054
  911    HG1  THR 118           1HG      THR 118 -10.024   0.445 -20.195
  912   1HG2  THR 118          1HG2      THR 118  -7.535   1.137 -18.924
  913   2HG2  THR 118          2HG2      THR 118  -8.349  -0.427 -18.892
  914   3HG2  THR 118          3HG2      THR 118  -7.976   0.403 -17.381
  Start of MODEL    9
    1    H    THR   1           1H       THR   1  16.520 -10.092 -11.888
    2    HA   THR   1           HA       THR   1  15.659  -9.063  -9.941
    3    HB   THR   1           HB       THR   1  17.329  -6.651 -10.666
    4    HG1  THR   1           1HG      THR   1  18.984  -7.773 -10.076
    5   1HG2  THR   1          1HG2      THR   1  17.079  -6.622  -7.998
    6   2HG2  THR   1          2HG2      THR   1  15.637  -7.558  -8.389
    7   3HG2  THR   1          3HG2      THR   1  15.846  -5.941  -9.059
    8    H    GLU   2           H        GLU   2  13.676  -8.021 -10.184
    9    HA   GLU   2           HA       GLU   2  12.883  -7.185 -12.871
   10   1HB   GLU   2          2HB       GLU   2  11.668  -7.680 -10.196
   11   2HB   GLU   2          1HB       GLU   2  10.780  -6.601 -11.274
   12   1HG   GLU   2          2HG       GLU   2  11.772  -9.355 -12.063
   13   2HG   GLU   2          1HG       GLU   2  10.126  -9.009 -11.530
   14    H    ALA   3           H        ALA   3  12.508  -5.493  -9.735
   15    HA   ALA   3           HA       ALA   3  12.750  -3.211  -9.180
   16   1HB   ALA   3          1HB       ALA   3  14.251  -2.609 -11.663
   17   2HB   ALA   3          2HB       ALA   3  14.916  -3.927 -10.698
   18   3HB   ALA   3          3HB       ALA   3  14.707  -2.328  -9.982
   19    H    GLU   4           H        GLU   4  10.614  -2.688  -9.478
   20    HA   GLU   4           HA       GLU   4   9.143  -2.313 -11.819
   21   1HB   GLU   4          2HB       GLU   4   7.916  -0.620 -10.347
   22   2HB   GLU   4          1HB       GLU   4   8.148  -2.217  -9.638
   23   1HG   GLU   4          2HG       GLU   4   9.695  -1.468  -8.105
   24   2HG   GLU   4          1HG       GLU   4  10.301  -0.207  -9.177
   25    H    ASP   5           H        ASP   5  10.481  -1.322 -13.483
   26    HA   ASP   5           HA       ASP   5  11.038   1.583 -12.999
   27   1HB   ASP   5          2HB       ASP   5  12.934   1.259 -14.574
   28   2HB   ASP   5          1HB       ASP   5  13.059   0.183 -13.183
   29    H    SER   6           H        SER   6   8.586   0.236 -14.126
   30    HA   SER   6           HA       SER   6   8.649   0.872 -17.006
   31   1HB   SER   6          2HB       SER   6   6.241   0.094 -16.770
   32   2HB   SER   6          1HB       SER   6   7.450  -1.083 -16.264
   33    HG   SER   6           HG       SER   6   6.323  -1.060 -14.479
   34    H    ILE   7           H        ILE   7   7.056   2.404 -17.928
   35    HA   ILE   7           HA       ILE   7   6.649   4.763 -16.141
   36    HB   ILE   7           HB       ILE   7   8.014   5.037 -18.170
   37   1HG1  ILE   7          2HG1      ILE   7   5.508   6.406 -18.995
   38   2HG1  ILE   7          1HG1      ILE   7   6.039   6.699 -17.338
   39   1HG2  ILE   7          1HG2      ILE   7   6.299   4.928 -20.313
   40   2HG2  ILE   7          2HG2      ILE   7   5.755   3.552 -19.351
   41   3HG2  ILE   7          3HG2      ILE   7   7.435   3.652 -19.877
   42   1HD1  ILE   7          1HD1      ILE   7   8.236   7.412 -18.125
   43   2HD1  ILE   7          2HD1      ILE   7   6.989   8.348 -18.952
   44   3HD1  ILE   7          3HD1      ILE   7   7.797   7.021 -19.788
   45    H    GLU   8           H        GLU   8   4.916   2.214 -17.636
   46    HA   GLU   8           HA       GLU   8   2.472   3.348 -18.434
   47   1HB   GLU   8          2HB       GLU   8   3.129   0.774 -16.970
   48   2HB   GLU   8          1HB       GLU   8   1.567   1.096 -17.722
   49   1HG   GLU   8          2HG       GLU   8   2.634   1.360 -19.906
   50   2HG   GLU   8          1HG       GLU   8   4.227   1.144 -19.178
   51    H    MET   9           H        MET   9   2.768   1.718 -15.271
   52    HA   MET   9           HA       MET   9   1.711   2.186 -13.211
   53   1HB   MET   9          2HB       MET   9   2.309   4.985 -14.224
   54   2HB   MET   9          1HB       MET   9   2.023   4.544 -12.541
   55   1HG   MET   9          2HG       MET   9   4.256   3.413 -14.251
   56   2HG   MET   9          1HG       MET   9   4.454   4.726 -13.091
   57   1HE   MET   9          1HE       MET   9   4.718   0.358 -12.413
   58   2HE   MET   9          2HE       MET   9   5.243   1.430 -13.709
   59   3HE   MET   9          3HE       MET   9   3.553   0.940 -13.610
   60    H    TYR  10           H        TYR  10  -0.425   1.446 -13.910
   61    HA   TYR  10           HA       TYR  10  -2.342   3.010 -15.303
   62   1HB   TYR  10          2HB       TYR  10  -2.410   0.752 -13.313
   63   2HB   TYR  10          1HB       TYR  10  -3.917   1.452 -13.905
   64    HD1  TYR  10           1HD      TYR  10  -4.710   1.010 -16.113
   65    HD2  TYR  10           2HD      TYR  10  -0.757  -0.208 -14.955
   66    HE1  TYR  10           1HE      TYR  10  -4.504  -0.309 -18.204
   67    HE2  TYR  10           2HE      TYR  10  -0.551  -1.526 -17.044
   68    HH   TYR  10           HH       TYR  10  -2.321  -1.121 -19.655
   69    H    GLU  11           H        GLU  11  -2.672   2.287 -11.822
   70    HA   GLU  11           HA       GLU  11  -3.163   5.187 -11.285
   71   1HB   GLU  11          2HB       GLU  11  -5.233   3.531 -11.785
   72   2HB   GLU  11          1HB       GLU  11  -4.996   3.169 -10.077
   73   1HG   GLU  11          2HG       GLU  11  -6.515   4.954 -10.051
   74   2HG   GLU  11          1HG       GLU  11  -4.960   5.721  -9.739
   75    H    TRP  12           H        TRP  12  -2.960   1.925  -9.869
   76    HA   TRP  12           HA       TRP  12  -2.674   2.406  -7.190
   77   1HB   TRP  12          2HB       TRP  12  -1.213   0.388  -7.189
   78   2HB   TRP  12          1HB       TRP  12  -2.635   0.199  -8.215
   79    HD1  TRP  12           HD       TRP  12  -2.276   0.122 -10.832
   80    HE1  TRP  12           1HE      TRP  12  -0.181  -0.232 -12.292
   81    HE3  TRP  12           3HE      TRP  12   1.372   0.856  -7.335
   82    HZ2  TRP  12           2HZ      TRP  12   2.665  -0.209 -12.013
   83    HZ3  TRP  12           3HZ      TRP  12   3.764   0.686  -7.957
   84    HH2  TRP  12           HH       TRP  12   4.416   0.155 -10.290
   85    H    TYR  13           H        TYR  13  -0.340   3.285  -9.656
   86    HA   TYR  13           HA       TYR  13   1.825   3.717  -7.708
   87   1HB   TYR  13          2HB       TYR  13   2.079   3.043 -10.141
   88   2HB   TYR  13          1HB       TYR  13   1.594   4.685 -10.569
   89    HD1  TYR  13           1HD      TYR  13   3.326   6.193 -10.955
   90    HD2  TYR  13           2HD      TYR  13   3.905   3.021  -8.118
   91    HE1  TYR  13           1HE      TYR  13   5.633   6.995 -10.528
   92    HE2  TYR  13           2HE      TYR  13   6.212   3.821  -7.692
   93    HH   TYR  13           HH       TYR  13   7.934   5.509  -9.503
   94    H    SER  14           H        SER  14   1.995   5.526  -6.475
   95    HA   SER  14           HA       SER  14   0.814   8.083  -7.497
   96   1HB   SER  14          2HB       SER  14   0.720   7.165  -4.621
   97   2HB   SER  14          1HB       SER  14  -0.226   8.438  -5.385
   98    HG   SER  14           HG       SER  14  -0.413   5.633  -5.719
   99    H    LYS  15           H        LYS  15   2.218   9.777  -7.315
  100    HA   LYS  15           HA       LYS  15   4.908   9.363  -6.385
  101   1HB   LYS  15          2HB       LYS  15   5.296  11.481  -7.325
  102   2HB   LYS  15          1HB       LYS  15   3.942  10.860  -8.259
  103   1HG   LYS  15          2HG       LYS  15   3.856  12.891  -6.013
  104   2HG   LYS  15          1HG       LYS  15   3.419  13.133  -7.701
  105   1HD   LYS  15          2HD       LYS  15   1.462  11.811  -7.503
  106   2HD   LYS  15          1HD       LYS  15   1.987  11.113  -5.977
  107   1HE   LYS  15          2HE       LYS  15   1.780  14.064  -5.957
  108   2HE   LYS  15          1HE       LYS  15   0.239  13.194  -6.113
  109   1HZ   LYS  15          1HZ       LYS  15   0.812  11.820  -4.248
  110   2HZ   LYS  15          2HZ       LYS  15   0.971  13.444  -3.773
  111   3HZ   LYS  15          3HZ       LYS  15   2.352  12.522  -4.132
  112    H    HIS  16           H        HIS  16   4.953   8.922  -4.172
  113    HA   HIS  16           HA       HIS  16   5.058   9.400  -1.878
  114   1HB   HIS  16          2HB       HIS  16   4.944  12.196  -3.052
  115   2HB   HIS  16          1HB       HIS  16   5.401  11.825  -1.392
  116    HD1  HIS  16           1HD      HIS  16   7.437   9.866  -1.322
  117    HD2  HIS  16           2HD      HIS  16   7.155  12.311  -4.687
  118    HE1  HIS  16           1HE      HIS  16   9.685   9.749  -2.483
  119    H    MET  17           H        MET  17   2.598   8.574  -2.517
  120    HA   MET  17           HA       MET  17   0.521  10.540  -1.854
  121   1HB   MET  17          2HB       MET  17   0.082   8.734  -3.417
  122   2HB   MET  17          1HB       MET  17   0.590   7.529  -2.236
  123   1HG   MET  17          2HG       MET  17  -1.598   9.378  -1.415
  124   2HG   MET  17          1HG       MET  17  -1.998   8.160  -2.625
  125   1HE   MET  17          1HE       MET  17  -0.773   6.060  -2.550
  126   2HE   MET  17          2HE       MET  17  -1.674   4.981  -1.488
  127   3HE   MET  17          3HE       MET  17   0.014   5.344  -1.137
  128    H    THR  18           H        THR  18  -0.305  10.905   0.188
  129    HA   THR  18           HA       THR  18   1.083   9.936   2.524
  130    HB   THR  18           HB       THR  18  -1.658  11.201   2.415
  131    HG1  THR  18           1HG      THR  18  -0.595  13.159   2.166
  132   1HG2  THR  18          1HG2      THR  18   0.576  11.896   4.289
  133   2HG2  THR  18          2HG2      THR  18  -0.357  10.426   4.568
  134   3HG2  THR  18          3HG2      THR  18  -1.166  11.993   4.546
  135    H    ARG  19           H        ARG  19   0.658   8.181   3.787
  136    HA   ARG  19           HA       ARG  19  -0.905   5.973   3.080
  137   1HB   ARG  19          2HB       ARG  19  -0.564   5.306   5.393
  138   2HB   ARG  19          1HB       ARG  19   0.858   6.212   4.881
  139   1HG   ARG  19          2HG       ARG  19  -0.210   8.286   5.890
  140   2HG   ARG  19          1HG       ARG  19  -1.458   7.236   6.564
  141   1HD   ARG  19          2HD       ARG  19   0.984   5.990   7.244
  142   2HD   ARG  19          1HD       ARG  19   1.227   7.721   7.560
  143    HE   ARG  19           HE       ARG  19  -0.979   6.073   8.723
  144   1HH1  ARG  19          1HH2      ARG  19  -0.692   9.259   8.092
  145   2HH1  ARG  19          2HH2      ARG  19  -0.607   9.805   9.734
  146   1HH2  ARG  19          1HH1      ARG  19  -0.172   6.626  11.048
  147   2HH2  ARG  19          2HH1      ARG  19  -0.312   8.315  11.406
  148    H    SER  20           H        SER  20  -1.813   8.768   5.032
  149    HA   SER  20           HA       SER  20  -4.425   7.849   5.789
  150   1HB   SER  20          2HB       SER  20  -3.929   9.595   7.131
  151   2HB   SER  20          1HB       SER  20  -2.641  10.115   6.053
  152    HG   SER  20           HG       SER  20  -4.847  11.370   6.473
  153    H    GLN  21           H        GLN  21  -3.183   9.758   3.059
  154    HA   GLN  21           HA       GLN  21  -5.716  10.512   1.954
  155   1HB   GLN  21          2HB       GLN  21  -2.924  10.089   0.882
  156   2HB   GLN  21          1HB       GLN  21  -4.240  10.596  -0.176
  157   1HG   GLN  21          2HG       GLN  21  -3.788  12.064   2.400
  158   2HG   GLN  21          1HG       GLN  21  -2.750  12.409   1.019
  159   1HE2  GLN  21          1HE2      GLN  21  -5.709  13.243   2.451
  160   2HE2  GLN  21          2HE2      GLN  21  -6.438  13.978   1.106
  161    H    ALA  22           H        ALA  22  -3.633   7.658   1.520
  162    HA   ALA  22           HA       ALA  22  -5.170   6.361  -0.504
  163   1HB   ALA  22          1HB       ALA  22  -2.974   5.809   1.311
  164   2HB   ALA  22          2HB       ALA  22  -3.317   5.075  -0.256
  165   3HB   ALA  22          3HB       ALA  22  -4.045   4.411   1.206
  166    H    GLU  23           H        GLU  23  -5.256   6.037   3.053
  167    HA   GLU  23           HA       GLU  23  -7.360   4.176   3.278
  168   1HB   GLU  23          2HB       GLU  23  -6.634   6.584   4.977
  169   2HB   GLU  23          1HB       GLU  23  -7.698   5.284   5.510
  170   1HG   GLU  23          2HG       GLU  23  -5.868   3.657   5.175
  171   2HG   GLU  23          1HG       GLU  23  -4.807   4.969   4.667
  172    H    GLN  24           H        GLN  24  -7.647   7.761   3.283
  173    HA   GLN  24           HA       GLN  24 -10.510   7.711   3.310
  174   1HB   GLN  24          2HB       GLN  24 -10.268  10.115   2.783
  175   2HB   GLN  24          1HB       GLN  24  -9.150   9.620   4.049
  176   1HG   GLN  24          2HG       GLN  24  -7.358   9.399   2.335
  177   2HG   GLN  24          1HG       GLN  24  -8.484   9.994   1.116
  178   1HE2  GLN  24          1HE2      GLN  24  -7.199  10.962   4.349
  179   2HE2  GLN  24          2HE2      GLN  24  -7.165  12.622   3.997
  180    H    LEU  25           H        LEU  25  -8.197   8.166   0.565
  181    HA   LEU  25           HA       LEU  25 -10.369   8.360  -1.332
  182   1HB   LEU  25          2HB       LEU  25  -8.593   8.244  -3.000
  183   2HB   LEU  25          1HB       LEU  25  -8.066   9.269  -1.667
  184    HG   LEU  25           HG       LEU  25  -7.092   6.982  -0.736
  185   1HD1  LEU  25          1HD1      LEU  25  -8.036   6.267  -3.338
  186   2HD1  LEU  25          2HD1      LEU  25  -7.173   5.262  -2.179
  187   3HD1  LEU  25          3HD1      LEU  25  -6.274   6.207  -3.361
  188   1HD2  LEU  25          1HD2      LEU  25  -5.442   7.967  -2.983
  189   2HD2  LEU  25          2HD2      LEU  25  -5.074   7.927  -1.262
  190   3HD2  LEU  25          3HD2      LEU  25  -6.051   9.234  -1.920
  191    H    LEU  26           H        LEU  26  -8.866   5.700   0.293
  192    HA   LEU  26           HA       LEU  26  -9.656   3.698  -1.720
  193   1HB   LEU  26          2HB       LEU  26  -8.299   3.816   0.931
  194   2HB   LEU  26          1HB       LEU  26  -9.154   2.328   0.574
  195    HG   LEU  26           HG       LEU  26  -7.186   3.569  -1.355
  196   1HD1  LEU  26          1HD1      LEU  26  -5.962   1.320  -0.342
  197   2HD1  LEU  26          2HD1      LEU  26  -6.726   2.000   1.093
  198   3HD1  LEU  26          3HD1      LEU  26  -5.596   2.972   0.154
  199   1HD2  LEU  26          1HD2      LEU  26  -9.084   1.673  -1.795
  200   2HD2  LEU  26          2HD2      LEU  26  -7.745   0.655  -1.263
  201   3HD2  LEU  26          3HD2      LEU  26  -7.545   1.718  -2.655
  202    H    LYS  27           H        LYS  27 -10.603   4.410   1.673
  203    HA   LYS  27           HA       LYS  27 -12.971   2.835   1.738
  204   1HB   LYS  27          2HB       LYS  27 -11.524   4.426   3.424
  205   2HB   LYS  27          1HB       LYS  27 -12.960   5.420   3.175
  206   1HG   LYS  27          2HG       LYS  27 -13.374   2.513   3.720
  207   2HG   LYS  27          1HG       LYS  27 -12.879   3.535   5.071
  208   1HD   LYS  27          2HD       LYS  27 -14.815   4.818   4.991
  209   2HD   LYS  27          1HD       LYS  27 -15.097   4.471   3.284
  210   1HE   LYS  27          2HE       LYS  27 -16.750   3.195   4.455
  211   2HE   LYS  27          1HE       LYS  27 -15.484   2.020   4.043
  212   1HZ   LYS  27          1HZ       LYS  27 -15.918   1.780   6.352
  213   2HZ   LYS  27          2HZ       LYS  27 -15.843   3.458   6.616
  214   3HZ   LYS  27          3HZ       LYS  27 -14.435   2.593   6.220
  215    H    GLN  28           H        GLN  28 -12.462   6.207   0.725
  216    HA   GLN  28           HA       GLN  28 -15.252   6.831   0.340
  217   1HB   GLN  28          2HB       GLN  28 -13.218   8.357   0.653
  218   2HB   GLN  28          1HB       GLN  28 -12.892   8.091  -1.061
  219   1HG   GLN  28          2HG       GLN  28 -14.208  10.061  -1.019
  220   2HG   GLN  28          1HG       GLN  28 -15.352   8.785  -1.437
  221   1HE2  GLN  28          1HE2      GLN  28 -14.031  10.385   1.523
  222   2HE2  GLN  28          2HE2      GLN  28 -15.503  10.358   2.368
  223    H    GLU  29           H        GLU  29 -12.730   5.647  -1.937
  224    HA   GLU  29           HA       GLU  29 -14.422   5.882  -4.272
  225   1HB   GLU  29          2HB       GLU  29 -11.848   5.666  -4.053
  226   2HB   GLU  29          1HB       GLU  29 -12.138   3.933  -3.910
  227   1HG   GLU  29          2HG       GLU  29 -11.666   4.648  -6.257
  228   2HG   GLU  29          1HG       GLU  29 -13.247   3.896  -6.083
  229    H    GLY  30           H        GLY  30 -13.797   3.303  -1.925
  230   1HA   GLY  30          2HA       GLY  30 -15.291   1.578  -1.321
  231   2HA   GLY  30          1HA       GLY  30 -16.327   2.073  -2.654
  232    H    LYS  31           H        LYS  31 -12.930   1.392  -3.177
  233    HA   LYS  31           HA       LYS  31 -13.690  -0.851  -4.976
  234   1HB   LYS  31          2HB       LYS  31 -10.930   0.263  -4.428
  235   2HB   LYS  31          1HB       LYS  31 -11.510  -0.525  -5.892
  236   1HG   LYS  31          2HG       LYS  31 -12.222   2.240  -4.878
  237   2HG   LYS  31          1HG       LYS  31 -11.395   1.827  -6.377
  238   1HD   LYS  31          2HD       LYS  31 -13.834   0.411  -6.449
  239   2HD   LYS  31          1HD       LYS  31 -14.239   2.023  -5.860
  240   1HE   LYS  31          2HE       LYS  31 -13.704   3.023  -7.854
  241   2HE   LYS  31          1HE       LYS  31 -12.341   1.926  -8.151
  242   1HZ   LYS  31          1HZ       LYS  31 -15.227   1.248  -8.371
  243   2HZ   LYS  31          2HZ       LYS  31 -13.953   0.138  -8.545
  244   3HZ   LYS  31          3HZ       LYS  31 -14.136   1.406  -9.660
  245    H    GLU  32           H        GLU  32 -14.080  -2.644  -3.510
  246    HA   GLU  32           HA       GLU  32 -12.456  -3.203  -1.239
  247   1HB   GLU  32          2HB       GLU  32 -13.325  -5.585  -1.605
  248   2HB   GLU  32          1HB       GLU  32 -14.535  -4.322  -1.392
  249   1HG   GLU  32          2HG       GLU  32 -13.746  -4.630  -4.195
  250   2HG   GLU  32          1HG       GLU  32 -14.407  -6.120  -3.521
  251    H    GLY  33           H        GLY  33 -10.352  -3.685  -1.217
  252   1HA   GLY  33          2HA       GLY  33  -8.441  -4.994  -1.733
  253   2HA   GLY  33          1HA       GLY  33  -9.260  -5.550  -3.194
  254    H    GLY  34           H        GLY  34  -9.369  -2.127  -2.598
  255   1HA   GLY  34          2HA       GLY  34  -8.134  -1.466  -5.064
  256   2HA   GLY  34          1HA       GLY  34  -8.324  -0.342  -3.713
  257    H    PHE  35           H        PHE  35  -5.991  -0.874  -5.566
  258    HA   PHE  35           HA       PHE  35  -3.978  -1.467  -3.416
  259   1HB   PHE  35          2HB       PHE  35  -4.410  -3.275  -5.102
  260   2HB   PHE  35          1HB       PHE  35  -3.858  -2.169  -6.358
  261    HD1  PHE  35           1HD      PHE  35  -1.504  -1.321  -6.329
  262    HD2  PHE  35           2HD      PHE  35  -2.872  -4.387  -3.653
  263    HE1  PHE  35           1HE      PHE  35   0.846  -1.974  -5.876
  264    HE2  PHE  35           2HE      PHE  35  -0.522  -5.038  -3.196
  265    HZ   PHE  35           HZ       PHE  35   1.338  -3.830  -4.307
  266    H    ILE  36           H        ILE  36  -2.621   0.241  -3.082
  267    HA   ILE  36           HA       ILE  36  -1.950   2.009  -5.412
  268    HB   ILE  36           HB       ILE  36  -2.527   2.818  -2.536
  269   1HG1  ILE  36          2HG1      ILE  36  -4.117   3.246  -5.085
  270   2HG1  ILE  36          1HG1      ILE  36  -4.574   2.189  -3.750
  271   1HG2  ILE  36          1HG2      ILE  36  -2.374   5.126  -3.458
  272   2HG2  ILE  36          2HG2      ILE  36  -1.885   4.451  -5.012
  273   3HG2  ILE  36          3HG2      ILE  36  -0.848   4.252  -3.599
  274   1HD1  ILE  36          1HD1      ILE  36  -4.604   4.173  -2.231
  275   2HD1  ILE  36          2HD1      ILE  36  -5.767   4.321  -3.547
  276   3HD1  ILE  36          3HD1      ILE  36  -4.244   5.207  -3.613
  277    H    VAL  37           H        VAL  37   0.164   3.120  -5.094
  278    HA   VAL  37           HA       VAL  37   1.919   2.028  -2.975
  279    HB   VAL  37           HB       VAL  37   2.471   1.750  -5.945
  280   1HG1  VAL  37          1HG1      VAL  37   4.437   0.447  -5.171
  281   2HG1  VAL  37          2HG1      VAL  37   4.021   0.834  -3.502
  282   3HG1  VAL  37          3HG1      VAL  37   4.504   2.118  -4.611
  283   1HG2  VAL  37          1HG2      VAL  37   0.832   0.109  -5.355
  284   2HG2  VAL  37          2HG2      VAL  37   1.621  -0.225  -3.814
  285   3HG2  VAL  37          3HG2      VAL  37   2.382  -0.733  -5.322
  286    H    ARG  38           H        ARG  38   3.816   3.351  -2.661
  287    HA   ARG  38           HA       ARG  38   4.115   5.741  -4.411
  288   1HB   ARG  38          2HB       ARG  38   3.970   7.209  -2.384
  289   2HB   ARG  38          1HB       ARG  38   2.456   6.381  -2.742
  290   1HG   ARG  38          2HG       ARG  38   2.548   5.814  -0.532
  291   2HG   ARG  38          1HG       ARG  38   3.637   4.554  -1.107
  292   1HD   ARG  38          2HD       ARG  38   4.797   5.637   0.694
  293   2HD   ARG  38          1HD       ARG  38   5.529   6.283  -0.787
  294    HE   ARG  38           HE       ARG  38   3.591   8.092  -0.464
  295   1HH1  ARG  38          1HH2      ARG  38   6.413   7.531   1.168
  296   2HH1  ARG  38          2HH2      ARG  38   6.001   8.425   2.594
  297   1HH2  ARG  38          1HH1      ARG  38   2.677   8.838   1.695
  298   2HH2  ARG  38          2HH1      ARG  38   3.887   9.165   2.892
  299    H    ASP  39           H        ASP  39   6.146   6.886  -4.009
  300    HA   ASP  39           HA       ASP  39   8.327   5.080  -3.253
  301   1HB   ASP  39          2HB       ASP  39   8.089   6.942  -5.111
  302   2HB   ASP  39          1HB       ASP  39   8.616   8.017  -3.815
  303    H    SER  40           H        SER  40   9.964   5.658  -1.627
  304    HA   SER  40           HA       SER  40   8.783   7.138   0.696
  305   1HB   SER  40          2HB       SER  40   9.328   4.676   0.848
  306   2HB   SER  40          1HB       SER  40  11.021   5.091   0.598
  307    HG   SER  40           HG       SER  40   9.309   5.735   2.749
  308    H    SER  41           H        SER  41  11.424   7.215   2.022
  309    HA   SER  41           HA       SER  41  13.032   9.004   0.268
  310   1HB   SER  41          2HB       SER  41  11.729   9.765   2.899
  311   2HB   SER  41          1HB       SER  41  12.934  10.750   2.076
  312    HG   SER  41           HG       SER  41  11.529  10.911   0.320
  313    H    LYS  42           H        LYS  42  12.770   8.052   3.725
  314    HA   LYS  42           HA       LYS  42  15.500   8.136   4.393
  315   1HB   LYS  42          2HB       LYS  42  13.269   6.275   5.274
  316   2HB   LYS  42          1HB       LYS  42  14.805   6.437   6.126
  317   1HG   LYS  42          2HG       LYS  42  14.345   8.610   6.825
  318   2HG   LYS  42          1HG       LYS  42  13.214   8.903   5.504
  319   1HD   LYS  42          2HD       LYS  42  12.519   6.748   7.446
  320   2HD   LYS  42          1HD       LYS  42  12.370   8.416   8.000
  321   1HE   LYS  42          2HE       LYS  42  11.246   8.361   5.396
  322   2HE   LYS  42          1HE       LYS  42  10.597   6.950   6.256
  323   1HZ   LYS  42          1HZ       LYS  42  10.246   8.473   8.193
  324   2HZ   LYS  42          2HZ       LYS  42   9.248   8.790   6.855
  325   3HZ   LYS  42          3HZ       LYS  42  10.597   9.775   7.165
  326    H    ALA  43           H        ALA  43  13.781   5.066   3.729
  327    HA   ALA  43           HA       ALA  43  16.318   3.772   2.941
  328   1HB   ALA  43          1HB       ALA  43  14.104   2.089   2.472
  329   2HB   ALA  43          2HB       ALA  43  13.658   3.058   3.875
  330   3HB   ALA  43          3HB       ALA  43  15.133   2.094   3.904
  331    H    GLY  44           H        GLY  44  13.669   5.379   1.424
  332   1HA   GLY  44          2HA       GLY  44  13.289   5.808  -0.867
  333   2HA   GLY  44          1HA       GLY  44  14.775   4.915  -1.232
  334    H    LYS  45           H        LYS  45  12.301   3.550   0.804
  335    HA   LYS  45           HA       LYS  45  11.976   1.307  -1.069
  336   1HB   LYS  45          2HB       LYS  45  10.855   0.291   0.854
  337   2HB   LYS  45          1HB       LYS  45  12.370   1.032   1.369
  338   1HG   LYS  45          2HG       LYS  45  10.660   3.133   1.677
  339   2HG   LYS  45          1HG       LYS  45   9.582   1.782   2.030
  340   1HD   LYS  45          2HD       LYS  45  10.681   1.235   3.952
  341   2HD   LYS  45          1HD       LYS  45  12.263   1.622   3.276
  342   1HE   LYS  45          2HE       LYS  45  11.834   4.024   3.566
  343   2HE   LYS  45          1HE       LYS  45  10.209   3.670   4.187
  344   1HZ   LYS  45          1HZ       LYS  45  12.576   2.360   5.366
  345   2HZ   LYS  45          2HZ       LYS  45  11.048   2.628   6.058
  346   3HZ   LYS  45          3HZ       LYS  45  12.134   3.919   5.865
  347    H    TYR  46           H        TYR  46   9.493   0.452  -0.981
  348    HA   TYR  46           HA       TYR  46   7.785   2.790  -1.782
  349   1HB   TYR  46          2HB       TYR  46   7.568  -0.099  -2.681
  350   2HB   TYR  46          1HB       TYR  46   6.772   1.297  -3.394
  351    HD1  TYR  46           1HD      TYR  46   8.586  -0.762  -4.812
  352    HD2  TYR  46           2HD      TYR  46   9.372   3.089  -3.084
  353    HE1  TYR  46           1HE      TYR  46  10.506  -0.461  -6.350
  354    HE2  TYR  46           2HE      TYR  46  11.290   3.390  -4.621
  355    HH   TYR  46           HH       TYR  46  12.881   1.771  -5.911
  356    H    THR  47           H        THR  47   5.472   2.559  -1.294
  357    HA   THR  47           HA       THR  47   4.897   0.668   0.964
  358    HB   THR  47           HB       THR  47   3.990   3.539   0.536
  359    HG1  THR  47           1HG      THR  47   5.572   4.028   1.811
  360   1HG2  THR  47          1HG2      THR  47   3.000   1.363   2.260
  361   2HG2  THR  47          2HG2      THR  47   2.214   2.868   1.788
  362   3HG2  THR  47          3HG2      THR  47   3.360   2.855   3.127
  363    H    VAL  48           H        VAL  48   3.139  -0.629   0.571
  364    HA   VAL  48           HA       VAL  48   1.495  -0.028  -1.854
  365    HB   VAL  48           HB       VAL  48   2.103  -2.487  -0.201
  366   1HG1  VAL  48          1HG1      VAL  48   0.125  -2.104  -2.454
  367   2HG1  VAL  48          2HG1      VAL  48  -0.165  -2.800  -0.860
  368   3HG1  VAL  48          3HG1      VAL  48   0.798  -3.682  -2.043
  369   1HG2  VAL  48          1HG2      VAL  48   2.928  -1.377  -2.851
  370   2HG2  VAL  48          2HG2      VAL  48   2.807  -3.129  -2.687
  371   3HG2  VAL  48          3HG2      VAL  48   3.894  -2.219  -1.638
  372    H    SER  49           H        SER  49  -0.312   1.151  -1.290
  373    HA   SER  49           HA       SER  49  -1.690   0.637   1.294
  374   1HB   SER  49          2HB       SER  49  -1.606   2.749  -0.820
  375   2HB   SER  49          1HB       SER  49  -3.062   2.632   0.164
  376    HG   SER  49           HG       SER  49  -1.783   3.902   1.354
  377    H    VAL  50           H        VAL  50  -3.221  -1.004   1.228
  378    HA   VAL  50           HA       VAL  50  -4.979  -1.098  -1.202
  379    HB   VAL  50           HB       VAL  50  -4.905  -3.522  -1.076
  380   1HG1  VAL  50          1HG1      VAL  50  -2.677  -3.876  -1.734
  381   2HG1  VAL  50          2HG1      VAL  50  -2.051  -2.710  -0.571
  382   3HG1  VAL  50          3HG1      VAL  50  -2.896  -2.149  -2.012
  383   1HG2  VAL  50          1HG2      VAL  50  -3.623  -4.681   0.673
  384   2HG2  VAL  50          2HG2      VAL  50  -4.882  -3.689   1.402
  385   3HG2  VAL  50          3HG2      VAL  50  -3.207  -3.137   1.413
  386    H    PHE  51           H        PHE  51  -7.225  -1.259  -0.759
  387    HA   PHE  51           HA       PHE  51  -7.956  -1.770   2.109
  388   1HB   PHE  51          2HB       PHE  51  -8.520   0.407   2.283
  389   2HB   PHE  51          1HB       PHE  51  -8.095   0.674   0.600
  390    HD1  PHE  51           1HD      PHE  51  -9.846   0.005  -1.191
  391    HD2  PHE  51           2HD      PHE  51 -10.779   0.505   2.972
  392    HE1  PHE  51           1HE      PHE  51 -12.240   0.263  -1.752
  393    HE2  PHE  51           2HE      PHE  51 -13.176   0.757   2.402
  394    HZ   PHE  51           HZ       PHE  51 -13.909   0.637   0.039
  395    H    ALA  52           H        ALA  52 -10.256  -2.381   2.386
  396    HA   ALA  52           HA       ALA  52 -11.801  -3.103   0.003
  397   1HB   ALA  52          1HB       ALA  52 -10.102  -4.940   0.361
  398   2HB   ALA  52          2HB       ALA  52 -11.782  -5.477   0.396
  399   3HB   ALA  52          3HB       ALA  52 -10.891  -5.268   1.903
  400    H    LYS  53           H        LYS  53 -13.874  -4.331   0.774
  401    HA   LYS  53           HA       LYS  53 -14.705  -3.236   3.448
  402   1HB   LYS  53          2HB       LYS  53 -15.940  -3.254   0.704
  403   2HB   LYS  53          1HB       LYS  53 -16.970  -3.143   2.131
  404   1HG   LYS  53          2HG       LYS  53 -15.538  -1.207   2.901
  405   2HG   LYS  53          1HG       LYS  53 -14.739  -1.258   1.333
  406   1HD   LYS  53          2HD       LYS  53 -16.504   0.401   1.247
  407   2HD   LYS  53          1HD       LYS  53 -16.973  -0.972   0.245
  408   1HE   LYS  53          2HE       LYS  53 -18.390  -1.844   2.065
  409   2HE   LYS  53          1HE       LYS  53 -17.897  -0.491   3.102
  410   1HZ   LYS  53          1HZ       LYS  53 -19.114  -0.151   0.416
  411   2HZ   LYS  53          2HZ       LYS  53 -18.798   1.062   1.562
  412   3HZ   LYS  53          3HZ       LYS  53 -20.004  -0.097   1.859
  413    H    SER  54           H        SER  54 -13.761  -5.828   3.522
  414    HA   SER  54           HA       SER  54 -16.164  -7.376   4.148
  415   1HB   SER  54          2HB       SER  54 -16.179  -7.633   1.754
  416   2HB   SER  54          1HB       SER  54 -14.453  -7.984   1.724
  417    HG   SER  54           HG       SER  54 -16.545  -9.550   2.834
  418    H    THR  55           H        THR  55 -14.664  -7.158   6.138
  419    HA   THR  55           HA       THR  55 -13.454  -9.663   6.758
  420    HB   THR  55           HB       THR  55 -11.736  -9.019   5.146
  421    HG1  THR  55           1HG      THR  55 -10.207  -9.577   6.463
  422   1HG2  THR  55          1HG2      THR  55 -11.989  -6.404   6.544
  423   2HG2  THR  55          2HG2      THR  55 -11.735  -6.746   4.833
  424   3HG2  THR  55          3HG2      THR  55 -10.385  -6.855   5.964
  425    H    GLY  56           H        GLY  56 -11.270  -7.693   8.212
  426   1HA   GLY  56          2HA       GLY  56 -12.476  -7.646  10.752
  427   2HA   GLY  56          1HA       GLY  56 -11.221  -6.507  10.251
  428    H    ASP  57           H        ASP  57 -12.743  -5.421   8.052
  429    HA   ASP  57           HA       ASP  57 -14.922  -3.954   9.485
  430   1HB   ASP  57          2HB       ASP  57 -12.476  -2.985   8.771
  431   2HB   ASP  57          1HB       ASP  57 -13.401  -2.662   7.308
  432    HA   PRO  58           HA       PRO  58 -16.731  -6.152   5.855
  433   1HB   PRO  58          2HB       PRO  58 -19.267  -5.266   6.888
  434   2HB   PRO  58          1HB       PRO  58 -18.608  -6.904   6.851
  435   1HG   PRO  58          2HG       PRO  58 -18.910  -5.156   9.118
  436   2HG   PRO  58          1HG       PRO  58 -18.312  -6.817   9.092
  437   1HD   PRO  58          2HD       PRO  58 -16.792  -4.450   9.569
  438   2HD   PRO  58          1HD       PRO  58 -16.165  -6.106   9.371
  439    H    GLN  59           H        GLN  59 -17.051  -2.874   6.998
  440    HA   GLN  59           HA       GLN  59 -18.045  -2.073   4.283
  441   1HB   GLN  59          2HB       GLN  59 -19.113  -0.173   5.551
  442   2HB   GLN  59          1HB       GLN  59 -19.727  -1.767   5.992
  443   1HG   GLN  59          2HG       GLN  59 -18.558  -1.799   8.025
  444   2HG   GLN  59          1HG       GLN  59 -17.416  -0.563   7.495
  445   1HE2  GLN  59          1HE2      GLN  59 -20.820  -1.043   8.492
  446   2HE2  GLN  59          2HE2      GLN  59 -21.083   0.572   8.944
  447    H    GLY  60           H        GLY  60 -15.145  -2.210   5.172
  448   1HA   GLY  60          2HA       GLY  60 -14.013  -0.121   3.913
  449   2HA   GLY  60          1HA       GLY  60 -14.452   0.625   5.441
  450    H    VAL  61           H        VAL  61 -12.171  -1.384   3.833
  451    HA   VAL  61           HA       VAL  61 -10.639  -1.666   6.396
  452    HB   VAL  61           HB       VAL  61 -10.804  -3.618   4.075
  453   1HG1  VAL  61          1HG1      VAL  61  -9.514  -5.104   5.472
  454   2HG1  VAL  61          2HG1      VAL  61  -9.598  -3.980   6.828
  455   3HG1  VAL  61          3HG1      VAL  61  -8.664  -3.561   5.393
  456   1HG2  VAL  61          1HG2      VAL  61 -12.320  -4.896   5.288
  457   2HG2  VAL  61          2HG2      VAL  61 -12.853  -3.266   5.668
  458   3HG2  VAL  61          3HG2      VAL  61 -11.868  -4.160   6.825
  459    H    ILE  62           H        ILE  62  -8.496  -1.192   6.252
  460    HA   ILE  62           HA       ILE  62  -7.279  -0.710   3.576
  461    HB   ILE  62           HB       ILE  62  -6.747   1.347   5.631
  462   1HG1  ILE  62          2HG1      ILE  62  -9.507   0.983   4.423
  463   2HG1  ILE  62          1HG1      ILE  62  -9.105   0.943   6.129
  464   1HG2  ILE  62          1HG2      ILE  62  -6.183   2.444   3.746
  465   2HG2  ILE  62          2HG2      ILE  62  -7.822   2.275   3.119
  466   3HG2  ILE  62          3HG2      ILE  62  -6.628   1.014   2.816
  467   1HD1  ILE  62          1HD1      ILE  62  -9.830   3.105   5.975
  468   2HD1  ILE  62          2HD1      ILE  62  -9.315   3.271   4.296
  469   3HD1  ILE  62          3HD1      ILE  62  -8.125   3.345   5.596
  470    H    ARG  63           H        ARG  63  -4.930  -0.567   3.662
  471    HA   ARG  63           HA       ARG  63  -3.428  -0.978   6.109
  472   1HB   ARG  63          2HB       ARG  63  -4.792  -3.184   5.249
  473   2HB   ARG  63          1HB       ARG  63  -3.264  -3.392   4.394
  474   1HG   ARG  63          2HG       ARG  63  -2.012  -3.322   6.446
  475   2HG   ARG  63          1HG       ARG  63  -3.431  -2.814   7.361
  476   1HD   ARG  63          2HD       ARG  63  -3.749  -5.346   5.843
  477   2HD   ARG  63          1HD       ARG  63  -2.634  -5.407   7.222
  478    HE   ARG  63           HE       ARG  63  -5.404  -4.299   7.494
  479   1HH1  ARG  63          1HH1      ARG  63  -3.825  -7.156   7.999
  480   2HH1  ARG  63          2HH1      ARG  63  -4.088  -7.233   9.709
  481   1HH2  ARG  63          1HH2      ARG  63  -5.289  -3.988   9.938
  482   2HH2  ARG  63          2HH2      ARG  63  -4.917  -5.440  10.806
  483    H    HIS  64           H        HIS  64  -1.553   0.099   5.539
  484    HA   HIS  64           HA       HIS  64  -0.695   0.063   2.689
  485   1HB   HIS  64          2HB       HIS  64   0.590   1.659   4.895
  486   2HB   HIS  64          1HB       HIS  64   0.434   2.064   3.187
  487    HD1  HIS  64           1HD      HIS  64  -2.423   1.973   2.558
  488    HD2  HIS  64           2HD      HIS  64  -1.136   3.291   6.297
  489    HE1  HIS  64           1HE      HIS  64  -4.313   3.354   3.519
  490    H    TYR  65           H        TYR  65   0.502  -1.777   2.329
  491    HA   TYR  65           HA       TYR  65   2.396  -2.836   4.308
  492   1HB   TYR  65          2HB       TYR  65   2.184  -3.462   1.364
  493   2HB   TYR  65          1HB       TYR  65   2.739  -4.518   2.657
  494    HD1  TYR  65           1HD      TYR  65   0.578  -3.911   4.699
  495    HD2  TYR  65           2HD      TYR  65   0.357  -4.721   0.486
  496    HE1  TYR  65           1HE      TYR  65  -1.717  -4.786   4.988
  497    HE2  TYR  65           2HE      TYR  65  -1.939  -5.596   0.777
  498    HH   TYR  65           HH       TYR  65  -3.844  -4.988   3.215
  499    H    VAL  66           H        VAL  66   4.427  -1.976   4.516
  500    HA   VAL  66           HA       VAL  66   5.539  -0.467   2.183
  501    HB   VAL  66           HB       VAL  66   6.236  -0.310   5.135
  502   1HG1  VAL  66          1HG1      VAL  66   7.043   1.308   2.701
  503   2HG1  VAL  66          2HG1      VAL  66   8.099   0.405   3.788
  504   3HG1  VAL  66          3HG1      VAL  66   7.294   1.868   4.354
  505   1HG2  VAL  66          1HG2      VAL  66   4.983   2.035   3.926
  506   2HG2  VAL  66          2HG2      VAL  66   4.546   1.172   5.401
  507   3HG2  VAL  66          3HG2      VAL  66   3.930   0.623   3.844
  508    H    VAL  67           H        VAL  67   7.972  -0.614   2.015
  509    HA   VAL  67           HA       VAL  67   8.881  -3.374   2.761
  510    HB   VAL  67           HB       VAL  67   9.533  -1.626   0.368
  511   1HG1  VAL  67          1HG1      VAL  67  11.322  -2.957   0.093
  512   2HG1  VAL  67          2HG1      VAL  67  10.243  -4.348  -0.028
  513   3HG1  VAL  67          3HG1      VAL  67  10.900  -3.874   1.539
  514   1HG2  VAL  67          1HG2      VAL  67   7.873  -2.700  -0.758
  515   2HG2  VAL  67          2HG2      VAL  67   7.243  -3.089   0.842
  516   3HG2  VAL  67          3HG2      VAL  67   8.251  -4.254  -0.014
  517    H    CYS  68           H        CYS  68  10.779  -3.494   3.890
  518    HA   CYS  68           HA       CYS  68  12.186  -0.965   4.548
  519   1HB   CYS  68          2HB       CYS  68  11.366  -2.645   6.264
  520   2HB   CYS  68          1HB       CYS  68  12.549  -3.783   5.619
  521    HG   CYS  68           HG       CYS  68  13.335  -1.082   6.995
  522    H    SER  69           H        SER  69  14.642  -1.056   4.479
  523    HA   SER  69           HA       SER  69  15.651  -2.979   2.421
  524   1HB   SER  69          2HB       SER  69  16.919  -0.796   1.634
  525   2HB   SER  69          1HB       SER  69  15.266  -1.105   1.104
  526    HG   SER  69           HG       SER  69  16.226   0.637   3.105
  527    H    THR  70           H        THR  70  17.608  -3.820   2.939
  528    HA   THR  70           HA       THR  70  19.111  -2.649   5.246
  529    HB   THR  70           HB       THR  70  18.281  -4.986   5.408
  530    HG1  THR  70           1HG      THR  70  20.091  -4.951   6.502
  531   1HG2  THR  70          1HG2      THR  70  19.828  -5.261   2.836
  532   2HG2  THR  70          2HG2      THR  70  18.154  -5.699   3.162
  533   3HG2  THR  70          3HG2      THR  70  19.465  -6.657   3.848
  534    HA   PRO  71           HA       PRO  71  22.343  -1.423   2.532
  535   1HB   PRO  71          2HB       PRO  71  24.489  -2.342   4.213
  536   2HB   PRO  71          1HB       PRO  71  23.856  -0.701   4.053
  537   1HG   PRO  71          2HG       PRO  71  23.576  -2.442   6.288
  538   2HG   PRO  71          1HG       PRO  71  22.835  -0.854   6.069
  539   1HD   PRO  71          2HD       PRO  71  21.573  -3.479   5.949
  540   2HD   PRO  71          1HD       PRO  71  20.800  -1.875   5.921
  541    H    GLN  72           H        GLN  72  21.688  -4.640   2.953
  542    HA   GLN  72           HA       GLN  72  24.094  -5.584   1.474
  543   1HB   GLN  72          2HB       GLN  72  23.252  -6.785   3.479
  544   2HB   GLN  72          1HB       GLN  72  21.700  -7.015   2.683
  545   1HG   GLN  72          2HG       GLN  72  22.811  -9.049   2.281
  546   2HG   GLN  72          1HG       GLN  72  23.097  -8.147   0.796
  547   1HE2  GLN  72          1HE2      GLN  72  25.263  -7.844   0.197
  548   2HE2  GLN  72          2HE2      GLN  72  26.590  -8.128   1.218
  549    H    SER  73           H        SER  73  21.819  -3.822   0.396
  550    HA   SER  73           HA       SER  73  20.633  -3.628  -1.638
  551   1HB   SER  73          2HB       SER  73  22.922  -4.762  -2.269
  552   2HB   SER  73          1HB       SER  73  21.942  -6.212  -2.474
  553    HG   SER  73           HG       SER  73  21.194  -5.401  -4.258
  554    H    GLN  74           H        GLN  74  19.278  -4.808   0.490
  555    HA   GLN  74           HA       GLN  74  17.605  -6.858  -0.904
  556   1HB   GLN  74          2HB       GLN  74  18.016  -7.136   2.016
  557   2HB   GLN  74          1HB       GLN  74  17.970  -8.380   0.774
  558   1HG   GLN  74          2HG       GLN  74  20.245  -7.460   0.015
  559   2HG   GLN  74          1HG       GLN  74  20.281  -6.603   1.555
  560   1HE2  GLN  74          1HE2      GLN  74  20.712  -9.711   0.035
  561   2HE2  GLN  74          2HE2      GLN  74  21.034 -10.590   1.450
  562    H    TYR  75           H        TYR  75  15.410  -7.062   0.164
  563    HA   TYR  75           HA       TYR  75  14.596  -4.667   1.759
  564   1HB   TYR  75          2HB       TYR  75  13.211  -5.561  -0.779
  565   2HB   TYR  75          1HB       TYR  75  12.866  -4.116   0.161
  566    HD1  TYR  75           1HD      TYR  75  15.440  -5.776  -1.937
  567    HD2  TYR  75           2HD      TYR  75  14.102  -2.114  -0.146
  568    HE1  TYR  75           1HE      TYR  75  17.131  -4.530  -3.238
  569    HE2  TYR  75           2HE      TYR  75  15.791  -0.863  -1.450
  570    HH   TYR  75           HH       TYR  75  18.362  -2.001  -2.708
  571    H    TYR  76           H        TYR  76  12.439  -4.920   2.732
  572    HA   TYR  76           HA       TYR  76  10.828  -7.293   2.503
  573   1HB   TYR  76          2HB       TYR  76  11.531  -8.381   4.645
  574   2HB   TYR  76          1HB       TYR  76  12.841  -8.348   3.473
  575    HD1  TYR  76           1HD      TYR  76  11.471  -6.699   6.492
  576    HD2  TYR  76           2HD      TYR  76  14.858  -7.085   3.892
  577    HE1  TYR  76           1HE      TYR  76  12.856  -5.480   8.134
  578    HE2  TYR  76           2HE      TYR  76  16.252  -5.863   5.531
  579    HH   TYR  76           HH       TYR  76  14.949  -4.856   8.681
  580    H    LEU  77           H        LEU  77   9.124  -7.346   4.172
  581    HA   LEU  77           HA       LEU  77   8.676  -4.676   5.455
  582   1HB   LEU  77          2HB       LEU  77   6.902  -5.526   3.981
  583   2HB   LEU  77          1HB       LEU  77   6.898  -7.072   4.827
  584    HG   LEU  77           HG       LEU  77   6.201  -5.880   6.914
  585   1HD1  LEU  77          1HD1      LEU  77   7.095  -3.622   5.700
  586   2HD1  LEU  77          2HD1      LEU  77   5.928  -3.610   7.021
  587   3HD1  LEU  77          3HD1      LEU  77   5.371  -3.496   5.352
  588   1HD2  LEU  77          1HD2      LEU  77   3.888  -5.135   5.858
  589   2HD2  LEU  77          2HD2      LEU  77   4.359  -6.834   5.856
  590   3HD2  LEU  77          3HD2      LEU  77   4.562  -5.860   4.400
  591    H    ALA  78           H        ALA  78   9.848  -7.720   5.955
  592    HA   ALA  78           HA       ALA  78   9.987  -7.452   8.871
  593   1HB   ALA  78          1HB       ALA  78   8.904 -10.007   7.654
  594   2HB   ALA  78          2HB       ALA  78   7.809  -8.698   8.099
  595   3HB   ALA  78          3HB       ALA  78   8.806  -9.471   9.331
  596    H    GLU  79           H        GLU  79  12.161  -7.875   9.180
  597    HA   GLU  79           HA       GLU  79  14.014  -8.684   7.281
  598   1HB   GLU  79          2HB       GLU  79  13.816  -8.766  10.260
  599   2HB   GLU  79          1HB       GLU  79  15.178  -9.609   9.517
  600   1HG   GLU  79          2HG       GLU  79  15.626  -7.492   8.195
  601   2HG   GLU  79          1HG       GLU  79  14.438  -6.692   9.224
  602    H    LYS  80           H        LYS  80  11.728 -10.700   8.904
  603    HA   LYS  80           HA       LYS  80  12.790 -13.254   9.001
  604   1HB   LYS  80          2HB       LYS  80  10.166 -12.059   8.213
  605   2HB   LYS  80          1HB       LYS  80  10.381 -13.794   7.978
  606   1HG   LYS  80          2HG       LYS  80   9.896 -14.067  10.164
  607   2HG   LYS  80          1HG       LYS  80  11.429 -13.278  10.533
  608   1HD   LYS  80          2HD       LYS  80   9.946 -11.089  10.051
  609   2HD   LYS  80          1HD       LYS  80   8.665 -12.172  10.598
  610   1HE   LYS  80          2HE       LYS  80   9.970 -12.658  12.660
  611   2HE   LYS  80          1HE       LYS  80  11.211 -11.509  12.122
  612   1HZ   LYS  80          1HZ       LYS  80   9.643  -9.753  12.105
  613   2HZ   LYS  80          2HZ       LYS  80   9.451 -10.539  13.599
  614   3HZ   LYS  80          3HZ       LYS  80   8.337 -10.808  12.345
  615    H    HIS  81           H        HIS  81  11.745 -11.509   6.072
  616    HA   HIS  81           HA       HIS  81  13.433 -13.304   4.414
  617   1HB   HIS  81          2HB       HIS  81  10.440 -12.910   4.064
  618   2HB   HIS  81          1HB       HIS  81  11.482 -13.751   2.916
  619    HD1  HIS  81           1HD      HIS  81   9.572 -14.252   6.013
  620    HD2  HIS  81           2HD      HIS  81  12.723 -16.171   4.071
  621    HE1  HIS  81           1HE      HIS  81   9.762 -16.552   7.055
  622    H    LEU  82           H        LEU  82  14.279 -12.118   2.655
  623    HA   LEU  82           HA       LEU  82  12.936  -9.582   1.927
  624   1HB   LEU  82          2HB       LEU  82  14.966  -8.308   2.417
  625   2HB   LEU  82          1HB       LEU  82  14.482  -9.199   3.857
  626    HG   LEU  82           HG       LEU  82  16.482 -10.283   1.887
  627   1HD1  LEU  82          1HD1      LEU  82  17.468  -9.179   4.446
  628   2HD1  LEU  82          2HD1      LEU  82  16.888  -7.971   3.301
  629   3HD1  LEU  82          3HD1      LEU  82  18.175  -9.082   2.836
  630   1HD2  LEU  82          1HD2      LEU  82  17.064 -11.192   4.443
  631   2HD2  LEU  82          2HD2      LEU  82  16.150 -12.091   3.232
  632   3HD2  LEU  82          3HD2      LEU  82  15.302 -11.131   4.444
  633    H    PHE  83           H        PHE  83  13.386  -8.923  -0.187
  634    HA   PHE  83           HA       PHE  83  15.132 -10.759  -1.792
  635   1HB   PHE  83          2HB       PHE  83  12.511  -9.354  -2.265
  636   2HB   PHE  83          1HB       PHE  83  13.517  -9.815  -3.643
  637    HD1  PHE  83           1HD      PHE  83  12.257 -11.268  -0.418
  638    HD2  PHE  83           2HD      PHE  83  13.229 -11.944  -4.547
  639    HE1  PHE  83           1HE      PHE  83  11.469 -13.610  -0.220
  640    HE2  PHE  83           2HE      PHE  83  12.438 -14.286  -4.350
  641    HZ   PHE  83           HZ       PHE  83  11.559 -15.119  -2.186
  642    H    SER  84           H        SER  84  15.155  -9.062  -4.120
  643    HA   SER  84           HA       SER  84  17.003  -6.952  -3.111
  644   1HB   SER  84          2HB       SER  84  16.564  -8.193  -5.844
  645   2HB   SER  84          1HB       SER  84  17.827  -7.029  -5.456
  646    HG   SER  84           HG       SER  84  17.568  -9.713  -4.769
  647    H    THR  85           H        THR  85  13.788  -6.973  -3.779
  648    HA   THR  85           HA       THR  85  13.732  -4.114  -4.372
  649    HB   THR  85           HB       THR  85  12.450  -5.813  -6.494
  650    HG1  THR  85           1HG      THR  85  14.281  -6.324  -7.353
  651   1HG2  THR  85          1HG2      THR  85  12.103  -3.802  -7.425
  652   2HG2  THR  85          2HG2      THR  85  13.822  -3.418  -7.338
  653   3HG2  THR  85          3HG2      THR  85  12.769  -3.065  -5.968
  654    H    ILE  86           H        ILE  86  11.443  -3.294  -4.472
  655    HA   ILE  86           HA       ILE  86   9.739  -4.582  -2.554
  656    HB   ILE  86           HB       ILE  86   9.572  -2.309  -4.504
  657   1HG1  ILE  86          2HG1      ILE  86   8.842  -1.411  -2.032
  658   2HG1  ILE  86          1HG1      ILE  86   9.888  -2.762  -1.605
  659   1HG2  ILE  86          1HG2      ILE  86   7.264  -3.394  -2.859
  660   2HG2  ILE  86          2HG2      ILE  86   7.324  -3.250  -4.615
  661   3HG2  ILE  86          3HG2      ILE  86   7.282  -1.800  -3.613
  662   1HD1  ILE  86          1HD1      ILE  86  10.627  -0.162  -2.596
  663   2HD1  ILE  86          2HD1      ILE  86  11.183  -1.401  -3.720
  664   3HD1  ILE  86          3HD1      ILE  86  11.671  -1.463  -2.026
  665    HA   PRO  87           HA       PRO  87   6.977  -5.754  -6.432
  666   1HB   PRO  87          2HB       PRO  87   8.826  -6.125  -8.607
  667   2HB   PRO  87          1HB       PRO  87   7.470  -4.998  -8.511
  668   1HG   PRO  87          2HG       PRO  87  10.298  -4.421  -8.335
  669   2HG   PRO  87          1HG       PRO  87   8.945  -3.289  -8.369
  670   1HD   PRO  87          2HD       PRO  87  10.605  -3.882  -6.145
  671   2HD   PRO  87          1HD       PRO  87   9.110  -2.918  -6.128
  672    H    GLU  88           H        GLU  88  10.384  -6.791  -6.299
  673    HA   GLU  88           HA       GLU  88   9.973  -9.549  -6.955
  674   1HB   GLU  88          2HB       GLU  88  12.130  -8.187  -6.808
  675   2HB   GLU  88          1HB       GLU  88  12.029  -8.378  -5.058
  676   1HG   GLU  88          2HG       GLU  88  13.422 -10.161  -5.798
  677   2HG   GLU  88          1HG       GLU  88  11.848 -10.897  -5.499
  678    H    LEU  89           H        LEU  89  10.009  -7.816  -3.832
  679    HA   LEU  89           HA       LEU  89   9.612 -10.075  -2.118
  680   1HB   LEU  89          2HB       LEU  89   9.444  -7.136  -2.057
  681   2HB   LEU  89          1HB       LEU  89   8.337  -7.915  -0.928
  682    HG   LEU  89           HG       LEU  89  11.054  -9.074  -0.986
  683   1HD1  LEU  89          1HD1      LEU  89  12.262  -7.244  -0.448
  684   2HD1  LEU  89          2HD1      LEU  89  11.038  -6.682   0.689
  685   3HD1  LEU  89          3HD1      LEU  89  10.900  -6.284  -1.023
  686   1HD2  LEU  89          1HD2      LEU  89   9.322  -9.757   0.626
  687   2HD2  LEU  89          2HD2      LEU  89   9.198  -8.097   1.209
  688   3HD2  LEU  89          3HD2      LEU  89  10.682  -9.014   1.466
  689    H    ILE  90           H        ILE  90   7.198  -7.723  -3.357
  690    HA   ILE  90           HA       ILE  90   4.853  -8.914  -2.381
  691    HB   ILE  90           HB       ILE  90   5.367  -7.545  -5.043
  692   1HG1  ILE  90          2HG1      ILE  90   6.144  -6.183  -3.167
  693   2HG1  ILE  90          1HG1      ILE  90   4.644  -5.502  -3.792
  694   1HG2  ILE  90          1HG2      ILE  90   2.851  -8.117  -3.472
  695   2HG2  ILE  90          2HG2      ILE  90   3.189  -8.487  -5.163
  696   3HG2  ILE  90          3HG2      ILE  90   2.931  -6.817  -4.660
  697   1HD1  ILE  90          1HD1      ILE  90   4.085  -5.524  -1.565
  698   2HD1  ILE  90          2HD1      ILE  90   5.170  -6.866  -1.199
  699   3HD1  ILE  90          3HD1      ILE  90   3.609  -7.176  -1.958
  700    H    ASN  91           H        ASN  91   6.354  -9.503  -5.591
  701    HA   ASN  91           HA       ASN  91   4.567 -11.555  -6.436
  702   1HB   ASN  91          2HB       ASN  91   6.684 -10.170  -7.462
  703   2HB   ASN  91          1HB       ASN  91   7.421 -11.753  -7.214
  704   1HD2  ASN  91          1HD2      ASN  91   6.480 -10.309  -9.770
  705   2HD2  ASN  91          2HD2      ASN  91   5.481 -11.447 -10.537
  706    H    TYR  92           H        TYR  92   7.606 -11.722  -4.587
  707    HA   TYR  92           HA       TYR  92   7.828 -14.574  -4.487
  708   1HB   TYR  92          2HB       TYR  92   9.769 -13.742  -3.661
  709   2HB   TYR  92          1HB       TYR  92   9.022 -12.186  -3.327
  710    HD1  TYR  92           1HD      TYR  92   9.168 -15.682  -1.985
  711    HD2  TYR  92           2HD      TYR  92   8.747 -11.499  -1.115
  712    HE1  TYR  92           1HE      TYR  92   9.208 -16.181   0.443
  713    HE2  TYR  92           2HE      TYR  92   8.786 -11.996   1.312
  714    HH   TYR  92           HH       TYR  92   8.176 -14.137   2.757
  715    H    HIS  93           H        HIS  93   5.908 -12.279  -2.633
  716    HA   HIS  93           HA       HIS  93   5.230 -14.025  -0.440
  717   1HB   HIS  93          2HB       HIS  93   4.804 -11.373  -1.268
  718   2HB   HIS  93          1HB       HIS  93   3.191 -12.077  -1.181
  719    HD1  HIS  93           1HD      HIS  93   3.960  -9.978   0.903
  720    HD2  HIS  93           2HD      HIS  93   4.557 -14.065   1.474
  721    HE1  HIS  93           1HE      HIS  93   4.093 -10.341   3.405
  722    H    GLN  94           H        GLN  94   3.663 -13.326  -3.569
  723    HA   GLN  94           HA       GLN  94   1.453 -15.191  -3.026
  724   1HB   GLN  94          2HB       GLN  94   2.264 -13.160  -5.007
  725   2HB   GLN  94          1HB       GLN  94   1.381 -14.522  -5.698
  726   1HG   GLN  94          2HG       GLN  94   0.367 -13.202  -3.195
  727   2HG   GLN  94          1HG       GLN  94   0.038 -12.471  -4.766
  728   1HE2  GLN  94          1HE2      GLN  94  -2.255 -12.996  -4.695
  729   2HE2  GLN  94          2HE2      GLN  94  -2.809 -14.594  -4.842
  730    H    HIS  95           H        HIS  95   3.546 -15.050  -5.914
  731    HA   HIS  95           HA       HIS  95   4.480 -16.797  -7.204
  732   1HB   HIS  95          2HB       HIS  95   5.049 -17.212  -4.339
  733   2HB   HIS  95          1HB       HIS  95   5.241 -18.662  -5.325
  734    HD1  HIS  95           1HD      HIS  95   5.945 -15.120  -6.477
  735    HD2  HIS  95           2HD      HIS  95   8.026 -18.624  -5.603
  736    HE1  HIS  95           1HE      HIS  95   8.340 -14.730  -7.200
  737    H    ASN  96           H        ASN  96   1.910 -17.075  -7.599
  738    HA   ASN  96           HA       ASN  96   1.427 -19.975  -7.557
  739   1HB   ASN  96          2HB       ASN  96   0.739 -18.893  -5.300
  740   2HB   ASN  96          1HB       ASN  96  -0.587 -18.170  -6.212
  741   1HD2  ASN  96          1HD2      ASN  96   0.950 -21.435  -5.923
  742   2HD2  ASN  96          2HD2      ASN  96  -0.522 -22.280  -5.892
  743    H    SER  97           H        SER  97   1.695 -18.805  -9.870
  744    HA   SER  97           HA       SER  97  -1.018 -18.689 -11.014
  745   1HB   SER  97          2HB       SER  97   0.639 -16.335 -10.393
  746   2HB   SER  97          1HB       SER  97   0.062 -16.372 -12.058
  747    HG   SER  97           HG       SER  97  -1.567 -16.776  -9.764
  748    H    ALA  98           H        ALA  98  -0.808 -18.326 -13.481
  749    HA   ALA  98           HA       ALA  98   1.454 -19.966 -14.467
  750   1HB   ALA  98          1HB       ALA  98  -1.282 -19.169 -15.306
  751   2HB   ALA  98          2HB       ALA  98  -0.472 -20.728 -15.457
  752   3HB   ALA  98          3HB       ALA  98  -0.128 -19.441 -16.613
  753    H    GLY  99           H        GLY  99   0.080 -16.709 -14.872
  754   1HA   GLY  99          2HA       GLY  99   2.318 -15.993 -16.694
  755   2HA   GLY  99          1HA       GLY  99   0.872 -15.021 -16.420
  756    H    LEU 100           H        LEU 100   3.830 -14.396 -16.133
  757    HA   LEU 100           HA       LEU 100   3.823 -13.588 -13.244
  758   1HB   LEU 100          2HB       LEU 100   6.033 -14.104 -15.259
  759   2HB   LEU 100          1HB       LEU 100   6.319 -13.479 -13.634
  760    HG   LEU 100           HG       LEU 100   4.818 -16.054 -14.158
  761   1HD1  LEU 100          1HD1      LEU 100   7.412 -15.764 -14.841
  762   2HD1  LEU 100          2HD1      LEU 100   6.774 -17.256 -14.150
  763   3HD1  LEU 100          3HD1      LEU 100   7.606 -16.093 -13.119
  764   1HD2  LEU 100          1HD2      LEU 100   5.907 -14.604 -11.758
  765   2HD2  LEU 100          2HD2      LEU 100   5.759 -16.360 -11.720
  766   3HD2  LEU 100          3HD2      LEU 100   4.328 -15.359 -11.976
  767    H    ILE 101           H        ILE 101   2.308 -11.907 -14.707
  768    HA   ILE 101           HA       ILE 101   3.941  -9.750 -15.890
  769    HB   ILE 101           HB       ILE 101   0.966 -10.053 -15.355
  770   1HG1  ILE 101          2HG1      ILE 101   1.854 -11.787 -16.869
  771   2HG1  ILE 101          1HG1      ILE 101   0.851 -10.643 -17.758
  772   1HG2  ILE 101          1HG2      ILE 101   0.712  -8.253 -17.011
  773   2HG2  ILE 101          2HG2      ILE 101   2.464  -8.142 -17.175
  774   3HG2  ILE 101          3HG2      ILE 101   1.693  -7.702 -15.651
  775   1HD1  ILE 101          1HD1      ILE 101   2.837 -10.995 -19.070
  776   2HD1  ILE 101          2HD1      ILE 101   3.877 -10.749 -17.667
  777   3HD1  ILE 101          3HD1      ILE 101   2.979  -9.392 -18.348
  778    H    SER 102           H        SER 102   1.402  -9.817 -13.351
  779    HA   SER 102           HA       SER 102   3.052  -8.293 -11.479
  780   1HB   SER 102          2HB       SER 102   2.406  -6.600 -13.175
  781   2HB   SER 102          1HB       SER 102   0.709  -6.985 -12.902
  782    HG   SER 102           HG       SER 102   1.747  -5.143 -11.697
  783    H    ARG 103           H        ARG 103   1.910  -7.966  -9.430
  784    HA   ARG 103           HA       ARG 103  -0.540  -9.681  -9.163
  785   1HB   ARG 103          2HB       ARG 103   1.730  -9.110  -7.226
  786   2HB   ARG 103          1HB       ARG 103   0.353 -10.163  -6.896
  787   1HG   ARG 103          2HG       ARG 103   2.292 -10.574  -9.191
  788   2HG   ARG 103          1HG       ARG 103   2.405 -11.407  -7.640
  789   1HD   ARG 103          2HD       ARG 103   0.983 -12.966  -8.476
  790   2HD   ARG 103          1HD       ARG 103  -0.282 -11.721  -8.474
  791    HE   ARG 103           HE       ARG 103   1.551 -11.558 -10.758
  792   1HH1  ARG 103          1HH2      ARG 103  -1.568 -11.087 -10.162
  793   2HH1  ARG 103          2HH2      ARG 103  -2.215 -12.137 -11.378
  794   1HH2  ARG 103          1HH1      ARG 103   0.817 -13.687 -12.031
  795   2HH2  ARG 103          2HH1      ARG 103  -0.865 -13.608 -12.437
  796    H    LEU 104           H        LEU 104  -1.824  -7.677  -9.556
  797    HA   LEU 104           HA       LEU 104  -1.896  -5.910  -7.130
  798   1HB   LEU 104          2HB       LEU 104  -0.989  -5.050  -9.426
  799   2HB   LEU 104          1HB       LEU 104  -2.685  -5.045  -9.906
  800    HG   LEU 104           HG       LEU 104  -2.318  -3.840  -7.279
  801   1HD1  LEU 104          1HD1      LEU 104  -1.224  -1.754  -8.216
  802   2HD1  LEU 104          2HD1      LEU 104  -0.785  -2.709  -9.631
  803   3HD1  LEU 104          3HD1      LEU 104  -0.149  -3.141  -8.045
  804   1HD2  LEU 104          1HD2      LEU 104  -4.338  -3.572  -8.627
  805   2HD2  LEU 104          2HD2      LEU 104  -3.399  -2.856  -9.938
  806   3HD2  LEU 104          3HD2      LEU 104  -3.575  -1.998  -8.407
  807    H    LYS 105           H        LYS 105  -4.137  -4.765  -7.035
  808    HA   LYS 105           HA       LYS 105  -6.258  -6.784  -7.683
  809   1HB   LYS 105          2HB       LYS 105  -5.815  -4.826  -5.423
  810   2HB   LYS 105          1HB       LYS 105  -7.386  -5.581  -5.698
  811   1HG   LYS 105          2HG       LYS 105  -6.480  -7.781  -5.388
  812   2HG   LYS 105          1HG       LYS 105  -4.826  -7.170  -5.413
  813   1HD   LYS 105          2HD       LYS 105  -5.724  -5.692  -3.385
  814   2HD   LYS 105          1HD       LYS 105  -6.867  -7.027  -3.235
  815   1HE   LYS 105          2HE       LYS 105  -5.185  -8.589  -2.760
  816   2HE   LYS 105          1HE       LYS 105  -3.923  -7.605  -3.529
  817   1HZ   LYS 105          1HZ       LYS 105  -4.057  -6.004  -1.809
  818   2HZ   LYS 105          2HZ       LYS 105  -3.954  -7.513  -1.036
  819   3HZ   LYS 105          3HZ       LYS 105  -5.449  -6.713  -1.147
  820    H    TYR 106           H        TYR 106  -6.697  -3.397  -6.643
  821    HA   TYR 106           HA       TYR 106  -7.949  -2.854  -9.318
  822   1HB   TYR 106          2HB       TYR 106  -9.477  -3.277  -7.317
  823   2HB   TYR 106          1HB       TYR 106  -8.843  -1.782  -6.634
  824    HD1  TYR 106           1HD      TYR 106 -11.422  -3.122  -8.565
  825    HD2  TYR 106           2HD      TYR 106  -8.781   0.257  -8.398
  826    HE1  TYR 106           1HE      TYR 106 -13.007  -1.815  -9.955
  827    HE2  TYR 106           2HE      TYR 106 -10.360   1.565  -9.789
  828    HH   TYR 106           HH       TYR 106 -12.409   0.588 -11.655
  829    HA   PRO 107           HA       PRO 107  -4.810   0.398  -9.065
  830   1HB   PRO 107          2HB       PRO 107  -5.780   1.391 -11.576
  831   2HB   PRO 107          1HB       PRO 107  -4.306   0.469 -11.265
  832   1HG   PRO 107          2HG       PRO 107  -6.665  -0.429 -12.607
  833   2HG   PRO 107          1HG       PRO 107  -5.217  -1.366 -12.231
  834   1HD   PRO 107          2HD       PRO 107  -7.842  -1.538 -10.996
  835   2HD   PRO 107          1HD       PRO 107  -6.411  -2.555 -10.695
  836    H    VAL 108           H        VAL 108  -6.376   1.221  -7.318
  837    HA   VAL 108           HA       VAL 108  -7.906   3.587  -8.329
  838    HB   VAL 108           HB       VAL 108  -9.250   1.761  -7.340
  839   1HG1  VAL 108          1HG1      VAL 108  -7.103   1.453  -5.614
  840   2HG1  VAL 108          2HG1      VAL 108  -8.672   0.671  -5.447
  841   3HG1  VAL 108          3HG1      VAL 108  -8.342   2.176  -4.590
  842   1HG2  VAL 108          1HG2      VAL 108 -10.287   3.158  -5.474
  843   2HG2  VAL 108          2HG2      VAL 108 -10.140   3.956  -7.040
  844   3HG2  VAL 108          3HG2      VAL 108  -8.990   4.318  -5.755
  845    H    SER 109           H        SER 109  -6.713   5.426  -7.865
  846    HA   SER 109           HA       SER 109  -5.082   5.430  -5.359
  847   1HB   SER 109          2HB       SER 109  -4.860   7.229  -7.778
  848   2HB   SER 109          1HB       SER 109  -3.645   6.948  -6.527
  849    HG   SER 109           HG       SER 109  -3.546   4.781  -7.239
  850    H    GLN 110           H        GLN 110  -4.785   8.354  -5.604
  851    HA   GLN 110           HA       GLN 110  -6.587   9.376  -3.815
  852   1HB   GLN 110          2HB       GLN 110  -6.165  11.574  -5.025
  853   2HB   GLN 110          1HB       GLN 110  -4.714  10.647  -4.644
  854   1HG   GLN 110          2HG       GLN 110  -5.161   9.598  -7.048
  855   2HG   GLN 110          1HG       GLN 110  -6.020  11.116  -7.297
  856   1HE2  GLN 110          1HE2      GLN 110  -2.955  10.266  -5.575
  857   2HE2  GLN 110          2HE2      GLN 110  -2.018  11.442  -6.365
  858    H    GLN 111           H        GLN 111  -7.108   9.190  -7.340
  859    HA   GLN 111           HA       GLN 111  -9.075   9.487  -8.618
  860   1HB   GLN 111          2HB       GLN 111  -9.984   8.063  -6.103
  861   2HB   GLN 111          1HB       GLN 111 -10.931   8.140  -7.595
  862   1HG   GLN 111          2HG       GLN 111  -8.183   7.315  -8.112
  863   2HG   GLN 111          1HG       GLN 111  -8.979   6.234  -6.967
  864   1HE2  GLN 111          1HE2      GLN 111  -9.163   7.530 -10.275
  865   2HE2  GLN 111          2HE2      GLN 111 -10.265   6.375 -10.849
  866    H    ASN 112           H        ASN 112 -11.665   9.975  -8.051
  867    HA   ASN 112           HA       ASN 112 -11.641  12.537  -6.538
  868   1HB   ASN 112          2HB       ASN 112 -11.852  12.579  -9.071
  869   2HB   ASN 112          1HB       ASN 112 -13.396  11.748  -8.874
  870   1HD2  ASN 112          1HD2      ASN 112 -11.674  14.736  -7.846
  871   2HD2  ASN 112          2HD2      ASN 112 -13.082  15.669  -7.678
  872    H    LYS 113           H        LYS 113 -12.338   9.657  -5.743
  873    HA   LYS 113           HA       LYS 113 -13.967   8.591  -4.410
  874   1HB   LYS 113          2HB       LYS 113 -15.130  11.372  -4.110
  875   2HB   LYS 113          1HB       LYS 113 -15.124  10.066  -2.928
  876   1HG   LYS 113          2HG       LYS 113 -12.704  11.615  -3.904
  877   2HG   LYS 113          1HG       LYS 113 -13.445  11.732  -2.309
  878   1HD   LYS 113          2HD       LYS 113 -12.219   9.994  -1.581
  879   2HD   LYS 113          1HD       LYS 113 -12.877   8.969  -2.854
  880   1HE   LYS 113          2HE       LYS 113 -10.631   8.914  -3.454
  881   2HE   LYS 113          1HE       LYS 113 -11.116  10.376  -4.337
  882   1HZ   LYS 113          1HZ       LYS 113 -10.512  11.716  -2.444
  883   2HZ   LYS 113          2HZ       LYS 113  -9.179  10.764  -2.894
  884   3HZ   LYS 113          3HZ       LYS 113 -10.113  10.339  -1.539
  885    H    ASN 114           H        ASN 114 -16.694   9.155  -4.078
  886    HA   ASN 114           HA       ASN 114 -17.904   9.500  -6.755
  887   1HB   ASN 114          2HB       ASN 114 -18.890   7.218  -6.667
  888   2HB   ASN 114          1HB       ASN 114 -17.128   7.163  -6.705
  889   1HD2  ASN 114          1HD2      ASN 114 -18.265   4.906  -5.680
  890   2HD2  ASN 114          2HD2      ASN 114 -18.141   4.858  -3.989
  891    H    ALA 115           H        ALA 115 -20.417   8.526  -6.253
  892    HA   ALA 115           HA       ALA 115 -22.441   9.142  -5.199
  893   1HB   ALA 115          1HB       ALA 115 -20.444   8.585  -3.019
  894   2HB   ALA 115          2HB       ALA 115 -21.847   7.635  -3.508
  895   3HB   ALA 115          3HB       ALA 115 -22.068   9.125  -2.592
  896    HA   PRO 116           HA       PRO 116 -21.074  13.585  -5.050
  897   1HB   PRO 116          2HB       PRO 116 -23.587  14.163  -6.328
  898   2HB   PRO 116          1HB       PRO 116 -21.964  14.292  -7.011
  899   1HG   PRO 116          2HG       PRO 116 -23.983  12.338  -7.612
  900   2HG   PRO 116          1HG       PRO 116 -22.366  12.483  -8.309
  901   1HD   PRO 116          2HD       PRO 116 -23.316  10.474  -6.481
  902   2HD   PRO 116          1HD       PRO 116 -21.672  10.653  -7.143
  903    H    SER 117           H        SER 117 -23.967  11.839  -4.114
  904    HA   SER 117           HA       SER 117 -25.541  12.215  -2.392
  905   1HB   SER 117          2HB       SER 117 -23.034  12.449  -1.425
  906   2HB   SER 117          1HB       SER 117 -23.616  14.074  -1.077
  907    HG   SER 117           HG       SER 117 -24.372  13.049   0.628
  908    H    THR 118           H        THR 118 -26.284  14.331  -0.899
  909    HA   THR 118           HA       THR 118 -26.758  16.532  -2.887
  910    HB   THR 118           HB       THR 118 -28.932  16.751  -1.541
  911    HG1  THR 118           1HG      THR 118 -29.465  14.931  -0.320
  912   1HG2  THR 118          1HG2      THR 118 -30.018  15.157  -2.887
  913   2HG2  THR 118          2HG2      THR 118 -28.659  14.034  -2.811
  914   3HG2  THR 118          3HG2      THR 118 -28.538  15.501  -3.782
  Start of MODEL   10
    1    H    THR   1           1H       THR   1  19.203  -4.549  -9.057
    2    HA   THR   1           HA       THR   1  19.453  -7.474  -9.531
    3    HB   THR   1           HB       THR   1  18.780  -6.075  -6.942
    4    HG1  THR   1           1HG      THR   1  20.794  -5.603  -6.707
    5   1HG2  THR   1          1HG2      THR   1  19.655  -8.839  -7.775
    6   2HG2  THR   1          2HG2      THR   1  18.195  -8.371  -6.903
    7   3HG2  THR   1          3HG2      THR   1  19.764  -8.298  -6.100
    8    H    GLU   2           H        GLU   2  17.677  -6.790 -11.138
    9    HA   GLU   2           HA       GLU   2  15.388  -6.600 -11.694
   10   1HB   GLU   2          2HB       GLU   2  15.626  -8.707 -10.254
   11   2HB   GLU   2          1HB       GLU   2  15.004  -7.739  -8.917
   12   1HG   GLU   2          2HG       GLU   2  12.937  -8.287  -9.646
   13   2HG   GLU   2          1HG       GLU   2  13.233  -7.193 -10.995
   14    H    ALA   3           H        ALA   3  15.214  -4.283 -11.650
   15    HA   ALA   3           HA       ALA   3  14.028  -3.171  -9.125
   16   1HB   ALA   3          1HB       ALA   3  15.374  -1.301  -9.384
   17   2HB   ALA   3          2HB       ALA   3  15.419  -1.453 -11.141
   18   3HB   ALA   3          3HB       ALA   3  16.416  -2.507 -10.138
   19    H    GLU   4           H        GLU   4  13.115  -0.777 -10.087
   20    HA   GLU   4           HA       GLU   4  11.487  -1.317 -12.509
   21   1HB   GLU   4          2HB       GLU   4   9.501  -0.465 -10.950
   22   2HB   GLU   4          1HB       GLU   4   9.951  -2.167 -10.996
   23   1HG   GLU   4          2HG       GLU   4  10.805  -2.136  -8.873
   24   2HG   GLU   4          1HG       GLU   4  11.443  -0.500  -9.042
   25    H    ASP   5           H        ASP   5  10.862   1.101  -9.976
   26    HA   ASP   5           HA       ASP   5  10.880   3.457 -10.098
   27   1HB   ASP   5          2HB       ASP   5  13.392   2.346 -10.883
   28   2HB   ASP   5          1HB       ASP   5  13.096   3.777 -11.865
   29    H    SER   6           H        SER   6   9.238   2.077 -12.072
   30    HA   SER   6           HA       SER   6   9.595   3.731 -14.532
   31   1HB   SER   6          2HB       SER   6   7.855   2.065 -15.371
   32   2HB   SER   6          1HB       SER   6   9.404   1.367 -14.905
   33    HG   SER   6           HG       SER   6   6.957   0.899 -13.908
   34    H    ILE   7           H        ILE   7   8.140   5.350 -15.002
   35    HA   ILE   7           HA       ILE   7   6.138   6.098 -13.001
   36    HB   ILE   7           HB       ILE   7   7.547   7.734 -14.179
   37   1HG1  ILE   7          2HG1      ILE   7   4.885   8.300 -15.380
   38   2HG1  ILE   7          1HG1      ILE   7   4.915   8.015 -13.640
   39   1HG2  ILE   7          1HG2      ILE   7   6.359   6.380 -16.573
   40   2HG2  ILE   7          2HG2      ILE   7   8.012   6.931 -16.303
   41   3HG2  ILE   7          3HG2      ILE   7   6.746   8.098 -16.684
   42   1HD1  ILE   7          1HD1      ILE   7   6.811   9.939 -15.001
   43   2HD1  ILE   7          2HD1      ILE   7   6.465   9.796 -13.276
   44   3HD1  ILE   7          3HD1      ILE   7   5.241  10.440 -14.371
   45    H    GLU   8           H        GLU   8   6.137   4.094 -15.780
   46    HA   GLU   8           HA       GLU   8   3.510   4.563 -16.810
   47   1HB   GLU   8          2HB       GLU   8   5.466   2.264 -16.797
   48   2HB   GLU   8          1HB       GLU   8   3.902   2.123 -17.600
   49   1HG   GLU   8          2HG       GLU   8   4.595   4.424 -18.692
   50   2HG   GLU   8          1HG       GLU   8   6.226   3.892 -18.280
   51    H    MET   9           H        MET   9   1.529   3.893 -16.027
   52    HA   MET   9           HA       MET   9   1.172   1.575 -14.352
   53   1HB   MET   9          2HB       MET   9   0.430   3.050 -12.353
   54   2HB   MET   9          1HB       MET   9   2.160   2.858 -12.624
   55   1HG   MET   9          2HG       MET   9   1.935   5.175 -12.307
   56   2HG   MET   9          1HG       MET   9   1.940   5.025 -14.060
   57   1HE   MET   9          1HE       MET   9  -1.121   5.487 -15.458
   58   2HE   MET   9          2HE       MET   9   0.639   5.514 -15.458
   59   3HE   MET   9          3HE       MET   9  -0.256   6.998 -15.147
   60    H    TYR  10           H        TYR  10  -1.187   2.151 -13.097
   61    HA   TYR  10           HA       TYR  10  -2.943   3.167 -15.277
   62   1HB   TYR  10          2HB       TYR  10  -3.437   0.921 -13.301
   63   2HB   TYR  10          1HB       TYR  10  -4.502   1.386 -14.626
   64    HD1  TYR  10           1HD      TYR  10  -2.343  -1.083 -13.748
   65    HD2  TYR  10           2HD      TYR  10  -2.896   1.753 -16.926
   66    HE1  TYR  10           1HE      TYR  10  -1.072  -2.557 -15.283
   67    HE2  TYR  10           2HE      TYR  10  -1.625   0.279 -18.463
   68    HH   TYR  10           HH       TYR  10   0.366  -1.802 -17.781
   69    H    GLU  11           H        GLU  11  -3.324   2.239 -11.842
   70    HA   GLU  11           HA       GLU  11  -4.275   4.995 -11.217
   71   1HB   GLU  11          2HB       GLU  11  -6.056   3.107 -11.926
   72   2HB   GLU  11          1HB       GLU  11  -5.877   2.680 -10.227
   73   1HG   GLU  11          2HG       GLU  11  -7.552   4.244 -10.039
   74   2HG   GLU  11          1HG       GLU  11  -6.151   5.305  -9.910
   75    H    TRP  12           H        TRP  12  -3.681   1.717  -9.961
   76    HA   TRP  12           HA       TRP  12  -3.511   2.249  -7.213
   77   1HB   TRP  12          2HB       TRP  12  -2.086   0.204  -7.202
   78   2HB   TRP  12          1HB       TRP  12  -3.511   0.024  -8.224
   79    HD1  TRP  12           HD       TRP  12  -3.151  -0.352 -10.762
   80    HE1  TRP  12           1HE      TRP  12  -1.069  -0.652 -12.252
   81    HE3  TRP  12           3HE      TRP  12   0.501   1.002  -7.457
   82    HZ2  TRP  12           2HZ      TRP  12   1.770  -0.358 -12.066
   83    HZ3  TRP  12           3HZ      TRP  12   2.883   0.983  -8.140
   84    HH2  TRP  12           HH       TRP  12   3.522   0.306 -10.439
   85    H    TYR  13           H        TYR  13  -1.272   3.238  -9.699
   86    HA   TYR  13           HA       TYR  13   0.999   3.507  -7.855
   87   1HB   TYR  13          2HB       TYR  13   1.163   2.997 -10.306
   88   2HB   TYR  13          1HB       TYR  13   0.575   4.627 -10.640
   89    HD1  TYR  13           1HD      TYR  13   1.878   6.612  -9.721
   90    HD2  TYR  13           2HD      TYR  13   3.442   2.612  -9.757
   91    HE1  TYR  13           1HE      TYR  13   4.169   7.505  -9.406
   92    HE2  TYR  13           2HE      TYR  13   5.734   3.506  -9.443
   93    HH   TYR  13           HH       TYR  13   6.825   5.506  -8.590
   94    H    SER  14           H        SER  14   1.588   5.334  -6.754
   95    HA   SER  14           HA       SER  14   0.282   7.934  -7.405
   96   1HB   SER  14          2HB       SER  14   0.472   6.967  -4.562
   97   2HB   SER  14          1HB       SER  14  -0.627   8.157  -5.254
   98    HG   SER  14           HG       SER  14  -1.967   6.587  -5.597
   99    H    LYS  15           H        LYS  15   1.788   9.562  -7.290
  100    HA   LYS  15           HA       LYS  15   4.522   8.951  -6.612
  101   1HB   LYS  15          2HB       LYS  15   4.973  11.037  -7.572
  102   2HB   LYS  15          1HB       LYS  15   3.483  10.554  -8.371
  103   1HG   LYS  15          2HG       LYS  15   3.795  12.523  -6.092
  104   2HG   LYS  15          1HG       LYS  15   3.223  12.849  -7.724
  105   1HD   LYS  15          2HD       LYS  15   1.184  11.707  -7.366
  106   2HD   LYS  15          1HD       LYS  15   1.789  10.903  -5.922
  107   1HE   LYS  15          2HE       LYS  15   1.899  13.840  -5.739
  108   2HE   LYS  15          1HE       LYS  15   0.255  13.184  -5.864
  109   1HZ   LYS  15          1HZ       LYS  15   2.374  12.325  -3.966
  110   2HZ   LYS  15          2HZ       LYS  15   0.895  11.515  -4.171
  111   3HZ   LYS  15          3HZ       LYS  15   0.921  13.105  -3.573
  112    H    HIS  16           H        HIS  16   4.665   8.430  -4.416
  113    HA   HIS  16           HA       HIS  16   4.969   8.839  -2.123
  114   1HB   HIS  16          2HB       HIS  16   4.989  11.693  -3.156
  115   2HB   HIS  16          1HB       HIS  16   5.641  11.151  -1.612
  116    HD1  HIS  16           1HD      HIS  16   6.442  11.396  -5.213
  117    HD2  HIS  16           2HD      HIS  16   7.977   9.416  -1.881
  118    HE1  HIS  16           1HE      HIS  16   8.750  10.582  -5.864
  119    H    MET  17           H        MET  17   2.364   8.307  -2.700
  120    HA   MET  17           HA       MET  17   0.573  10.443  -1.787
  121   1HB   MET  17          2HB       MET  17  -0.062   8.719  -3.443
  122   2HB   MET  17          1HB       MET  17   0.188   7.461  -2.233
  123   1HG   MET  17          2HG       MET  17  -1.949   7.739  -1.580
  124   2HG   MET  17          1HG       MET  17  -1.523   9.357  -1.024
  125   1HE   MET  17          1HE       MET  17  -1.195  11.190  -2.344
  126   2HE   MET  17          2HE       MET  17  -2.465  11.794  -3.405
  127   3HE   MET  17          3HE       MET  17  -1.042  11.024  -4.098
  128    H    THR  18           H        THR  18   0.323  10.926   0.345
  129    HA   THR  18           HA       THR  18   1.550   9.678   2.531
  130    HB   THR  18           HB       THR  18  -1.146  11.044   2.598
  131    HG1  THR  18           1HG      THR  18   1.430  12.209   2.385
  132   1HG2  THR  18          1HG2      THR  18  -0.618  11.596   4.776
  133   2HG2  THR  18          2HG2      THR  18   1.119  11.570   4.471
  134   3HG2  THR  18          3HG2      THR  18   0.232  10.056   4.647
  135    H    ARG  19           H        ARG  19   1.016   7.997   3.905
  136    HA   ARG  19           HA       ARG  19  -0.547   5.796   3.131
  137   1HB   ARG  19          2HB       ARG  19  -0.289   5.128   5.462
  138   2HB   ARG  19          1HB       ARG  19   1.168   5.995   4.981
  139   1HG   ARG  19          2HG       ARG  19   0.127   8.102   5.944
  140   2HG   ARG  19          1HG       ARG  19  -1.162   7.088   6.597
  141   1HD   ARG  19          2HD       ARG  19   0.934   5.685   7.529
  142   2HD   ARG  19          1HD       ARG  19   1.698   7.285   7.443
  143    HE   ARG  19           HE       ARG  19  -0.989   7.255   8.643
  144   1HH1  ARG  19          1HH2      ARG  19   1.980   8.644   8.877
  145   2HH1  ARG  19          2HH2      ARG  19   2.136   8.521  10.598
  146   1HH2  ARG  19          1HH1      ARG  19  -0.612   6.438  10.962
  147   2HH2  ARG  19          2HH1      ARG  19   0.667   7.273  11.778
  148    H    SER  20           H        SER  20  -1.447   8.637   5.001
  149    HA   SER  20           HA       SER  20  -4.111   7.763   5.685
  150   1HB   SER  20          2HB       SER  20  -3.607   9.462   7.085
  151   2HB   SER  20          1HB       SER  20  -2.272   9.973   6.061
  152    HG   SER  20           HG       SER  20  -3.515  11.454   5.197
  153    H    GLN  21           H        GLN  21  -2.718   9.723   3.056
  154    HA   GLN  21           HA       GLN  21  -5.166  10.592   1.863
  155   1HB   GLN  21          2HB       GLN  21  -2.365  10.022   0.879
  156   2HB   GLN  21          1HB       GLN  21  -3.616  10.618  -0.214
  157   1HG   GLN  21          2HG       GLN  21  -3.210  12.040   2.388
  158   2HG   GLN  21          1HG       GLN  21  -2.043  12.306   1.095
  159   1HE2  GLN  21          1HE2      GLN  21  -5.033  13.359   2.295
  160   2HE2  GLN  21          2HE2      GLN  21  -5.594  14.152   0.904
  161    H    ALA  22           H        ALA  22  -3.184   7.664   1.348
  162    HA   ALA  22           HA       ALA  22  -4.843   6.508  -0.676
  163   1HB   ALA  22          1HB       ALA  22  -2.475   5.907   0.670
  164   2HB   ALA  22          2HB       ALA  22  -3.257   4.871  -0.523
  165   3HB   ALA  22          3HB       ALA  22  -3.574   4.631   1.194
  166    H    GLU  23           H        GLU  23  -4.826   6.257   2.869
  167    HA   GLU  23           HA       GLU  23  -6.912   4.374   3.216
  168   1HB   GLU  23          2HB       GLU  23  -5.764   6.684   4.751
  169   2HB   GLU  23          1HB       GLU  23  -7.217   5.899   5.367
  170   1HG   GLU  23          2HG       GLU  23  -5.552   3.775   4.667
  171   2HG   GLU  23          1HG       GLU  23  -4.457   4.957   5.382
  172    H    GLN  24           H        GLN  24  -7.188   7.960   3.276
  173    HA   GLN  24           HA       GLN  24 -10.032   7.976   3.375
  174   1HB   GLN  24          2HB       GLN  24  -9.757  10.361   2.744
  175   2HB   GLN  24          1HB       GLN  24  -8.620   9.879   4.000
  176   1HG   GLN  24          2HG       GLN  24  -6.885   9.541   2.240
  177   2HG   GLN  24          1HG       GLN  24  -8.025  10.152   1.042
  178   1HE2  GLN  24          1HE2      GLN  24  -7.044  11.225   4.355
  179   2HE2  GLN  24          2HE2      GLN  24  -6.777  12.839   3.904
  180    H    LEU  25           H        LEU  25  -7.845   8.335   0.498
  181    HA   LEU  25           HA       LEU  25 -10.127   8.480  -1.277
  182   1HB   LEU  25          2HB       LEU  25  -8.447   8.210  -3.048
  183   2HB   LEU  25          1HB       LEU  25  -7.881   9.354  -1.837
  184    HG   LEU  25           HG       LEU  25  -6.820   7.164  -0.765
  185   1HD1  LEU  25          1HD1      LEU  25  -6.715   5.339  -2.094
  186   2HD1  LEU  25          2HD1      LEU  25  -6.255   6.296  -3.499
  187   3HD1  LEU  25          3HD1      LEU  25  -7.957   6.109  -3.078
  188   1HD2  LEU  25          1HD2      LEU  25  -5.185   7.855  -3.071
  189   2HD2  LEU  25          2HD2      LEU  25  -4.914   8.233  -1.373
  190   3HD2  LEU  25          3HD2      LEU  25  -5.908   9.298  -2.363
  191    H    LEU  26           H        LEU  26  -8.436   5.859   0.271
  192    HA   LEU  26           HA       LEU  26  -9.376   3.781  -1.557
  193   1HB   LEU  26          2HB       LEU  26  -7.981   4.007   1.071
  194   2HB   LEU  26          1HB       LEU  26  -8.841   2.510   0.773
  195    HG   LEU  26           HG       LEU  26  -6.803   3.704  -1.126
  196   1HD1  LEU  26          1HD1      LEU  26  -6.274   2.504   1.307
  197   2HD1  LEU  26          2HD1      LEU  26  -5.159   2.571  -0.056
  198   3HD1  LEU  26          3HD1      LEU  26  -6.175   1.149   0.182
  199   1HD2  LEU  26          1HD2      LEU  26  -8.777   2.020  -1.806
  200   2HD2  LEU  26          2HD2      LEU  26  -7.643   0.837  -1.159
  201   3HD2  LEU  26          3HD2      LEU  26  -7.162   1.879  -2.497
  202    H    LYS  27           H        LYS  27 -10.229   4.648   1.829
  203    HA   LYS  27           HA       LYS  27 -12.587   3.115   2.067
  204   1HB   LYS  27          2HB       LYS  27 -11.124   4.904   3.560
  205   2HB   LYS  27          1HB       LYS  27 -12.620   5.798   3.289
  206   1HG   LYS  27          2HG       LYS  27 -13.294   3.083   3.922
  207   2HG   LYS  27          1HG       LYS  27 -12.160   3.675   5.136
  208   1HD   LYS  27          2HD       LYS  27 -13.608   5.281   5.908
  209   2HD   LYS  27          1HD       LYS  27 -14.351   5.520   4.327
  210   1HE   LYS  27          2HE       LYS  27 -16.077   4.391   5.416
  211   2HE   LYS  27          1HE       LYS  27 -15.183   3.007   4.757
  212   1HZ   LYS  27          1HZ       LYS  27 -14.896   4.198   7.462
  213   2HZ   LYS  27          2HZ       LYS  27 -13.833   3.038   6.823
  214   3HZ   LYS  27          3HZ       LYS  27 -15.464   2.645   7.088
  215    H    GLN  28           H        GLN  28 -12.183   6.454   0.858
  216    HA   GLN  28           HA       GLN  28 -14.968   6.961   0.371
  217   1HB   GLN  28          2HB       GLN  28 -12.859   8.498   0.488
  218   2HB   GLN  28          1HB       GLN  28 -12.703   8.133  -1.230
  219   1HG   GLN  28          2HG       GLN  28 -14.069   9.989  -1.376
  220   2HG   GLN  28          1HG       GLN  28 -15.307   8.745  -1.207
  221   1HE2  GLN  28          1HE2      GLN  28 -16.813   9.201   0.398
  222   2HE2  GLN  28          2HE2      GLN  28 -16.517  10.146   1.777
  223    H    GLU  29           H        GLU  29 -12.402   5.582  -1.700
  224    HA   GLU  29           HA       GLU  29 -13.779   5.511  -4.178
  225   1HB   GLU  29          2HB       GLU  29 -11.348   4.838  -3.447
  226   2HB   GLU  29          1HB       GLU  29 -12.049   3.242  -3.190
  227   1HG   GLU  29          2HG       GLU  29 -11.401   3.050  -5.406
  228   2HG   GLU  29          1HG       GLU  29 -13.037   3.673  -5.623
  229    H    GLY  30           H        GLY  30 -13.943   3.376  -1.364
  230   1HA   GLY  30          2HA       GLY  30 -15.622   1.882  -0.711
  231   2HA   GLY  30          1HA       GLY  30 -16.601   2.543  -2.020
  232    H    LYS  31           H        LYS  31 -13.448   1.248  -2.682
  233    HA   LYS  31           HA       LYS  31 -14.691  -0.932  -4.294
  234   1HB   LYS  31          2HB       LYS  31 -11.861   0.159  -4.226
  235   2HB   LYS  31          1HB       LYS  31 -12.570  -0.851  -5.486
  236   1HG   LYS  31          2HG       LYS  31 -13.524   1.934  -4.739
  237   2HG   LYS  31          1HG       LYS  31 -12.538   1.548  -6.143
  238   1HD   LYS  31          2HD       LYS  31 -15.311   0.452  -5.596
  239   2HD   LYS  31          1HD       LYS  31 -14.928   1.729  -6.750
  240   1HE   LYS  31          2HE       LYS  31 -13.245  -0.050  -7.735
  241   2HE   LYS  31          1HE       LYS  31 -14.307  -1.209  -6.913
  242   1HZ   LYS  31          1HZ       LYS  31 -16.213  -0.137  -7.970
  243   2HZ   LYS  31          2HZ       LYS  31 -15.134  -0.747  -9.131
  244   3HZ   LYS  31          3HZ       LYS  31 -15.176   0.918  -8.799
  245    H    GLU  32           H        GLU  32 -14.794  -2.879  -3.145
  246    HA   GLU  32           HA       GLU  32 -13.168  -3.509  -0.887
  247   1HB   GLU  32          2HB       GLU  32 -13.968  -5.845  -1.350
  248   2HB   GLU  32          1HB       GLU  32 -15.249  -4.636  -1.266
  249   1HG   GLU  32          2HG       GLU  32 -14.359  -4.692  -3.966
  250   2HG   GLU  32          1HG       GLU  32 -14.558  -6.369  -3.463
  251    H    GLY  33           H        GLY  33 -10.961  -3.088  -1.477
  252   1HA   GLY  33          2HA       GLY  33  -9.001  -4.576  -1.858
  253   2HA   GLY  33          1HA       GLY  33  -9.819  -5.104  -3.326
  254    H    GLY  34           H        GLY  34  -9.766  -1.694  -2.366
  255   1HA   GLY  34          2HA       GLY  34  -8.684  -0.934  -4.929
  256   2HA   GLY  34          1HA       GLY  34  -8.873   0.146  -3.542
  257    H    PHE  35           H        PHE  35  -6.683  -1.797  -5.335
  258    HA   PHE  35           HA       PHE  35  -4.550  -1.784  -3.301
  259   1HB   PHE  35          2HB       PHE  35  -4.992  -3.671  -4.835
  260   2HB   PHE  35          1HB       PHE  35  -4.679  -2.623  -6.216
  261    HD1  PHE  35           1HD      PHE  35  -2.367  -1.505  -6.373
  262    HD2  PHE  35           2HD      PHE  35  -3.228  -4.796  -3.754
  263    HE1  PHE  35           1HE      PHE  35   0.055  -2.016  -6.220
  264    HE2  PHE  35           2HE      PHE  35  -0.806  -5.304  -3.596
  265    HZ   PHE  35           HZ       PHE  35   0.836  -3.914  -4.831
  266    H    ILE  36           H        ILE  36  -3.101  -0.111  -3.100
  267    HA   ILE  36           HA       ILE  36  -2.499   1.560  -5.514
  268    HB   ILE  36           HB       ILE  36  -3.025   2.531  -2.683
  269   1HG1  ILE  36          2HG1      ILE  36  -4.707   2.690  -5.206
  270   2HG1  ILE  36          1HG1      ILE  36  -5.093   1.771  -3.752
  271   1HG2  ILE  36          1HG2      ILE  36  -2.456   3.979  -5.289
  272   2HG2  ILE  36          2HG2      ILE  36  -1.435   3.953  -3.852
  273   3HG2  ILE  36          3HG2      ILE  36  -2.993   4.776  -3.810
  274   1HD1  ILE  36          1HD1      ILE  36  -6.317   3.682  -3.319
  275   2HD1  ILE  36          2HD1      ILE  36  -5.212   4.720  -4.220
  276   3HD1  ILE  36          3HD1      ILE  36  -4.777   4.162  -2.605
  277    H    VAL  37           H        VAL  37  -0.410   2.817  -5.151
  278    HA   VAL  37           HA       VAL  37   1.391   1.686  -3.086
  279    HB   VAL  37           HB       VAL  37   1.886   1.526  -6.077
  280   1HG1  VAL  37          1HG1      VAL  37   3.551   0.638  -3.698
  281   2HG1  VAL  37          2HG1      VAL  37   3.955   1.926  -4.833
  282   3HG1  VAL  37          3HG1      VAL  37   3.916   0.250  -5.380
  283   1HG2  VAL  37          1HG2      VAL  37   1.196  -0.549  -3.982
  284   2HG2  VAL  37          2HG2      VAL  37   1.901  -0.971  -5.541
  285   3HG2  VAL  37          3HG2      VAL  37   0.323  -0.187  -5.469
  286    H    ARG  38           H        ARG  38   3.463   2.926  -2.994
  287    HA   ARG  38           HA       ARG  38   3.644   5.418  -4.556
  288   1HB   ARG  38          2HB       ARG  38   3.473   6.831  -2.506
  289   2HB   ARG  38          1HB       ARG  38   1.972   5.973  -2.855
  290   1HG   ARG  38          2HG       ARG  38   2.171   5.482  -0.605
  291   2HG   ARG  38          1HG       ARG  38   3.093   4.134  -1.272
  292   1HD   ARG  38          2HD       ARG  38   5.094   4.957  -0.507
  293   2HD   ARG  38          1HD       ARG  38   4.624   6.643  -0.806
  294    HE   ARG  38           HE       ARG  38   3.139   5.277   1.345
  295   1HH1  ARG  38          1HH2      ARG  38   6.302   5.958   1.428
  296   2HH1  ARG  38          2HH2      ARG  38   6.225   7.303   2.517
  297   1HH2  ARG  38          1HH1      ARG  38   2.777   7.613   2.312
  298   2HH2  ARG  38          2HH1      ARG  38   4.229   8.239   3.019
  299    H    ASP  39           H        ASP  39   5.663   6.573  -4.104
  300    HA   ASP  39           HA       ASP  39   7.842   4.754  -3.336
  301   1HB   ASP  39          2HB       ASP  39   7.890   6.299  -5.292
  302   2HB   ASP  39          1HB       ASP  39   7.818   7.669  -4.183
  303    H    SER  40           H        SER  40   9.522   5.473  -1.760
  304    HA   SER  40           HA       SER  40   8.284   6.907   0.561
  305   1HB   SER  40          2HB       SER  40   8.982   4.498   0.753
  306   2HB   SER  40          1HB       SER  40  10.640   4.998   0.433
  307    HG   SER  40           HG       SER  40   8.970   5.632   2.625
  308    H    SER  41           H        SER  41  10.935   7.175   1.843
  309    HA   SER  41           HA       SER  41  12.404   9.032   0.043
  310   1HB   SER  41          2HB       SER  41  10.408  10.054   1.451
  311   2HB   SER  41          1HB       SER  41  11.575   9.979   2.769
  312    HG   SER  41           HG       SER  41  11.406  11.886   1.110
  313    H    LYS  42           H        LYS  42  12.212   8.132   3.519
  314    HA   LYS  42           HA       LYS  42  14.950   8.396   4.148
  315   1HB   LYS  42          2HB       LYS  42  12.634   6.761   5.139
  316   2HB   LYS  42          1HB       LYS  42  14.233   6.481   5.829
  317   1HG   LYS  42          2HG       LYS  42  13.774   9.315   5.664
  318   2HG   LYS  42          1HG       LYS  42  12.402   8.559   6.474
  319   1HD   LYS  42          2HD       LYS  42  14.450   7.232   7.668
  320   2HD   LYS  42          1HD       LYS  42  15.226   8.786   7.352
  321   1HE   LYS  42          2HE       LYS  42  12.473   8.965   8.447
  322   2HE   LYS  42          1HE       LYS  42  13.698   8.319   9.558
  323   1HZ   LYS  42          1HZ       LYS  42  13.656  10.747   9.614
  324   2HZ   LYS  42          2HZ       LYS  42  13.969  10.803   7.945
  325   3HZ   LYS  42          3HZ       LYS  42  15.136  10.178   9.012
  326    H    ALA  43           H        ALA  43  13.367   5.220   3.690
  327    HA   ALA  43           HA       ALA  43  15.938   3.989   2.938
  328   1HB   ALA  43          1HB       ALA  43  13.424   3.226   4.045
  329   2HB   ALA  43          2HB       ALA  43  14.846   2.211   3.816
  330   3HB   ALA  43          3HB       ALA  43  13.625   2.316   2.548
  331    H    GLY  44           H        GLY  44  13.267   5.456   1.332
  332   1HA   GLY  44          2HA       GLY  44  12.860   5.744  -0.972
  333   2HA   GLY  44          1HA       GLY  44  14.398   4.922  -1.289
  334    H    LYS  45           H        LYS  45  11.939   3.534   0.767
  335    HA   LYS  45           HA       LYS  45  11.786   1.180  -0.991
  336   1HB   LYS  45          2HB       LYS  45  10.643   0.215   0.952
  337   2HB   LYS  45          1HB       LYS  45  12.115   1.039   1.465
  338   1HG   LYS  45          2HG       LYS  45   9.897   2.899   1.434
  339   2HG   LYS  45          1HG       LYS  45   9.490   1.491   2.411
  340   1HD   LYS  45          2HD       LYS  45  11.835   1.800   3.467
  341   2HD   LYS  45          1HD       LYS  45  11.786   3.414   2.755
  342   1HE   LYS  45          2HE       LYS  45  10.867   3.755   4.910
  343   2HE   LYS  45          1HE       LYS  45   9.423   3.561   3.896
  344   1HZ   LYS  45          1HZ       LYS  45   9.287   2.088   5.793
  345   2HZ   LYS  45          2HZ       LYS  45  10.800   1.410   5.420
  346   3HZ   LYS  45          3HZ       LYS  45   9.479   1.173   4.378
  347    H    TYR  46           H        TYR  46   9.375   0.210  -1.033
  348    HA   TYR  46           HA       TYR  46   7.579   2.433  -1.957
  349   1HB   TYR  46          2HB       TYR  46   7.567  -0.496  -2.759
  350   2HB   TYR  46          1HB       TYR  46   6.701   0.819  -3.544
  351    HD1  TYR  46           1HD      TYR  46   8.675  -1.121  -4.876
  352    HD2  TYR  46           2HD      TYR  46   9.191   2.778  -3.159
  353    HE1  TYR  46           1HE      TYR  46  10.628  -0.730  -6.348
  354    HE2  TYR  46           2HE      TYR  46  11.141   3.172  -4.633
  355    HH   TYR  46           HH       TYR  46  12.601   0.648  -6.457
  356    H    THR  47           H        THR  47   5.261   2.119  -1.526
  357    HA   THR  47           HA       THR  47   4.685   0.235   0.736
  358    HB   THR  47           HB       THR  47   3.859   3.133   0.353
  359    HG1  THR  47           1HG      THR  47   5.986   2.628   1.189
  360   1HG2  THR  47          1HG2      THR  47   3.112   2.357   2.911
  361   2HG2  THR  47          2HG2      THR  47   2.664   0.965   1.926
  362   3HG2  THR  47          3HG2      THR  47   2.017   2.560   1.543
  363    H    VAL  48           H        VAL  48   2.865  -0.998   0.399
  364    HA   VAL  48           HA       VAL  48   1.223  -0.377  -2.030
  365    HB   VAL  48           HB       VAL  48   1.565  -2.880  -0.351
  366   1HG1  VAL  48          1HG1      VAL  48  -0.542  -3.083  -1.391
  367   2HG1  VAL  48          2HG1      VAL  48   0.557  -3.903  -2.501
  368   3HG1  VAL  48          3HG1      VAL  48   0.005  -2.265  -2.855
  369   1HG2  VAL  48          1HG2      VAL  48   3.579  -2.080  -1.661
  370   2HG2  VAL  48          2HG2      VAL  48   2.615  -2.268  -3.126
  371   3HG2  VAL  48          3HG2      VAL  48   2.988  -3.674  -2.130
  372    H    SER  49           H        SER  49  -0.519   0.879  -1.426
  373    HA   SER  49           HA       SER  49  -1.872   0.453   1.176
  374   1HB   SER  49          2HB       SER  49  -1.886   2.467  -1.053
  375   2HB   SER  49          1HB       SER  49  -3.216   2.447   0.101
  376    HG   SER  49           HG       SER  49  -1.137   3.735   0.506
  377    H    VAL  50           H        VAL  50  -3.364  -1.252   1.149
  378    HA   VAL  50           HA       VAL  50  -5.206  -1.355  -1.223
  379    HB   VAL  50           HB       VAL  50  -5.229  -3.780  -0.947
  380   1HG1  VAL  50          1HG1      VAL  50  -3.159  -4.160  -1.881
  381   2HG1  VAL  50          2HG1      VAL  50  -2.319  -3.192  -0.672
  382   3HG1  VAL  50          3HG1      VAL  50  -3.188  -2.401  -1.986
  383   1HG2  VAL  50          1HG2      VAL  50  -3.877  -4.882   0.769
  384   2HG2  VAL  50          2HG2      VAL  50  -5.024  -3.791   1.537
  385   3HG2  VAL  50          3HG2      VAL  50  -3.331  -3.321   1.379
  386    H    PHE  51           H        PHE  51  -7.381  -1.128  -0.711
  387    HA   PHE  51           HA       PHE  51  -8.163  -1.649   2.142
  388   1HB   PHE  51          2HB       PHE  51  -8.698   0.546   2.311
  389   2HB   PHE  51          1HB       PHE  51  -8.017   0.794   0.710
  390    HD1  PHE  51           1HD      PHE  51  -9.525   0.295  -1.322
  391    HD2  PHE  51           2HD      PHE  51 -11.026   0.786   2.669
  392    HE1  PHE  51           1HE      PHE  51 -11.782   0.717  -2.228
  393    HE2  PHE  51           2HE      PHE  51 -13.295   1.202   1.760
  394    HZ   PHE  51           HZ       PHE  51 -13.672   1.169  -0.689
  395    H    ALA  52           H        ALA  52 -10.706  -1.647   2.232
  396    HA   ALA  52           HA       ALA  52 -12.132  -2.445  -0.156
  397   1HB   ALA  52          1HB       ALA  52 -12.486  -4.796   0.479
  398   2HB   ALA  52          2HB       ALA  52 -11.451  -4.575   1.890
  399   3HB   ALA  52          3HB       ALA  52 -10.766  -4.465   0.268
  400    H    LYS  53           H        LYS  53 -14.319  -3.632   0.713
  401    HA   LYS  53           HA       LYS  53 -15.227  -2.113   3.144
  402   1HB   LYS  53          2HB       LYS  53 -16.312  -2.410   0.347
  403   2HB   LYS  53          1HB       LYS  53 -17.384  -1.989   1.682
  404   1HG   LYS  53          2HG       LYS  53 -14.824  -0.466   1.285
  405   2HG   LYS  53          1HG       LYS  53 -16.238  -0.073   0.306
  406   1HD   LYS  53          2HD       LYS  53 -17.259  -0.290   2.892
  407   2HD   LYS  53          1HD       LYS  53 -15.710   0.522   3.111
  408   1HE   LYS  53          2HE       LYS  53 -17.313   2.264   2.713
  409   2HE   LYS  53          1HE       LYS  53 -16.428   2.072   1.187
  410   1HZ   LYS  53          1HZ       LYS  53 -18.824   2.034   0.808
  411   2HZ   LYS  53          2HZ       LYS  53 -18.989   0.729   1.883
  412   3HZ   LYS  53          3HZ       LYS  53 -18.133   0.533   0.428
  413    H    SER  54           H        SER  54 -14.450  -4.945   3.174
  414    HA   SER  54           HA       SER  54 -16.952  -6.099   4.158
  415   1HB   SER  54          2HB       SER  54 -17.381  -6.396   1.830
  416   2HB   SER  54          1HB       SER  54 -15.731  -6.931   1.521
  417    HG   SER  54           HG       SER  54 -17.668  -8.499   1.874
  418    H    THR  55           H        THR  55 -15.447  -6.314   6.011
  419    HA   THR  55           HA       THR  55 -14.450  -8.936   6.403
  420    HB   THR  55           HB       THR  55 -12.760  -8.410   4.729
  421    HG1  THR  55           1HG      THR  55 -12.010  -9.523   6.546
  422   1HG2  THR  55          1HG2      THR  55 -12.548  -5.869   6.305
  423   2HG2  THR  55          2HG2      THR  55 -12.640  -6.093   4.557
  424   3HG2  THR  55          3HG2      THR  55 -11.142  -6.454   5.414
  425    H    GLY  56           H        GLY  56 -11.980  -7.259   7.801
  426   1HA   GLY  56          2HA       GLY  56 -13.011  -7.260  10.420
  427   2HA   GLY  56          1HA       GLY  56 -11.689  -6.211   9.895
  428    H    ASP  57           H        ASP  57 -13.331  -4.920   7.844
  429    HA   ASP  57           HA       ASP  57 -15.259  -3.353   9.504
  430   1HB   ASP  57          2HB       ASP  57 -12.775  -2.526   8.793
  431   2HB   ASP  57          1HB       ASP  57 -13.688  -2.039   7.368
  432    HA   PRO  58           HA       PRO  58 -17.431  -5.054   5.823
  433   1HB   PRO  58          2HB       PRO  58 -19.810  -3.940   6.997
  434   2HB   PRO  58          1HB       PRO  58 -19.352  -5.638   6.845
  435   1HG   PRO  58          2HG       PRO  58 -19.380  -4.011   9.215
  436   2HG   PRO  58          1HG       PRO  58 -18.972  -5.724   9.072
  437   1HD   PRO  58          2HD       PRO  58 -17.186  -3.563   9.618
  438   2HD   PRO  58          1HD       PRO  58 -16.755  -5.266   9.324
  439    H    GLN  59           H        GLN  59 -17.307  -1.835   7.144
  440    HA   GLN  59           HA       GLN  59 -18.312  -0.769   4.526
  441   1HB   GLN  59          2HB       GLN  59 -19.074   1.176   5.940
  442   2HB   GLN  59          1HB       GLN  59 -19.868  -0.353   6.328
  443   1HG   GLN  59          2HG       GLN  59 -18.632  -0.644   8.299
  444   2HG   GLN  59          1HG       GLN  59 -17.363   0.466   7.778
  445   1HE2  GLN  59          1HE2      GLN  59 -19.322   0.453  10.211
  446   2HE2  GLN  59          2HE2      GLN  59 -19.961   2.025  10.205
  447    H    GLY  60           H        GLY  60 -15.410  -1.305   5.302
  448   1HA   GLY  60          2HA       GLY  60 -14.065   0.665   4.064
  449   2HA   GLY  60          1HA       GLY  60 -14.371   1.417   5.621
  450    H    VAL  61           H        VAL  61 -12.384  -0.799   3.899
  451    HA   VAL  61           HA       VAL  61 -10.841  -1.330   6.416
  452    HB   VAL  61           HB       VAL  61 -11.271  -3.189   4.054
  453   1HG1  VAL  61          1HG1      VAL  61 -10.321  -4.176   6.685
  454   2HG1  VAL  61          2HG1      VAL  61  -9.179  -3.185   5.779
  455   3HG1  VAL  61          3HG1      VAL  61  -9.836  -4.655   5.060
  456   1HG2  VAL  61          1HG2      VAL  61 -12.944  -4.265   5.227
  457   2HG2  VAL  61          2HG2      VAL  61 -13.214  -2.615   5.761
  458   3HG2  VAL  61          3HG2      VAL  61 -12.332  -3.736   6.792
  459    H    ILE  62           H        ILE  62  -8.644  -1.145   6.224
  460    HA   ILE  62           HA       ILE  62  -7.448  -0.698   3.536
  461    HB   ILE  62           HB       ILE  62  -6.616   1.226   5.610
  462   1HG1  ILE  62          2HG1      ILE  62  -9.460   1.207   4.551
  463   2HG1  ILE  62          1HG1      ILE  62  -8.974   1.062   6.230
  464   1HG2  ILE  62          1HG2      ILE  62  -6.855   0.992   2.737
  465   2HG2  ILE  62          2HG2      ILE  62  -5.939   2.166   3.680
  466   3HG2  ILE  62          3HG2      ILE  62  -7.627   2.480   3.285
  467   1HD1  ILE  62          1HD1      ILE  62  -9.004   3.279   6.439
  468   2HD1  ILE  62          2HD1      ILE  62  -9.481   3.434   4.748
  469   3HD1  ILE  62          3HD1      ILE  62  -7.772   3.417   5.186
  470    H    ARG  63           H        ARG  63  -5.079  -0.743   3.592
  471    HA   ARG  63           HA       ARG  63  -3.597  -1.433   5.990
  472   1HB   ARG  63          2HB       ARG  63  -5.111  -3.470   4.763
  473   2HB   ARG  63          1HB       ARG  63  -3.451  -3.763   4.251
  474   1HG   ARG  63          2HG       ARG  63  -2.733  -3.593   6.644
  475   2HG   ARG  63          1HG       ARG  63  -4.430  -3.455   7.104
  476   1HD   ARG  63          2HD       ARG  63  -4.407  -5.697   5.451
  477   2HD   ARG  63          1HD       ARG  63  -2.907  -5.849   6.388
  478    HE   ARG  63           HE       ARG  63  -4.257  -5.642   8.448
  479   1HH1  ARG  63          1HH2      ARG  63  -5.394  -7.896   6.626
  480   2HH1  ARG  63          2HH2      ARG  63  -7.091  -7.633   6.846
  481   1HH2  ARG  63          1HH1      ARG  63  -6.690  -4.483   8.241
  482   2HH2  ARG  63          2HH1      ARG  63  -7.825  -5.701   7.760
  483    H    HIS  64           H        HIS  64  -1.776  -0.254   5.393
  484    HA   HIS  64           HA       HIS  64  -0.894  -0.304   2.558
  485   1HB   HIS  64          2HB       HIS  64   0.461   1.227   4.760
  486   2HB   HIS  64          1HB       HIS  64   0.256   1.668   3.067
  487    HD1  HIS  64           1HD      HIS  64  -1.995   2.734   2.367
  488    HD2  HIS  64           2HD      HIS  64  -1.787   1.803   6.424
  489    HE1  HIS  64           1HE      HIS  64  -3.967   3.880   3.466
  490    H    TYR  65           H        TYR  65   0.293  -2.146   2.155
  491    HA   TYR  65           HA       TYR  65   2.179  -3.254   4.122
  492   1HB   TYR  65          2HB       TYR  65   1.973  -3.835   1.168
  493   2HB   TYR  65          1HB       TYR  65   2.514  -4.913   2.449
  494    HD1  TYR  65           1HD      TYR  65   0.376  -4.366   4.499
  495    HD2  TYR  65           2HD      TYR  65   0.114  -5.019   0.261
  496    HE1  TYR  65           1HE      TYR  65  -1.930  -5.219   4.775
  497    HE2  TYR  65           2HE      TYR  65  -2.193  -5.873   0.538
  498    HH   TYR  65           HH       TYR  65  -3.447  -6.955   3.210
  499    H    VAL  66           H        VAL  66   4.207  -2.385   4.342
  500    HA   VAL  66           HA       VAL  66   5.303  -0.845   2.018
  501    HB   VAL  66           HB       VAL  66   5.981  -0.607   4.965
  502   1HG1  VAL  66          1HG1      VAL  66   6.737   0.861   2.453
  503   2HG1  VAL  66          2HG1      VAL  66   7.761   0.349   3.794
  504   3HG1  VAL  66          3HG1      VAL  66   6.688   1.736   3.984
  505   1HG2  VAL  66          1HG2      VAL  66   3.648   0.281   3.505
  506   2HG2  VAL  66          2HG2      VAL  66   4.588   1.682   4.024
  507   3HG2  VAL  66          3HG2      VAL  66   4.029   0.504   5.212
  508    H    VAL  67           H        VAL  67   7.747  -0.870   1.939
  509    HA   VAL  67           HA       VAL  67   8.751  -3.588   2.694
  510    HB   VAL  67           HB       VAL  67   9.442  -1.727   0.402
  511   1HG1  VAL  67          1HG1      VAL  67  10.439  -4.280  -0.117
  512   2HG1  VAL  67          2HG1      VAL  67  10.825  -4.012   1.583
  513   3HG1  VAL  67          3HG1      VAL  67  11.386  -2.871   0.361
  514   1HG2  VAL  67          1HG2      VAL  67   7.513  -3.920   0.789
  515   2HG2  VAL  67          2HG2      VAL  67   8.538  -4.124  -0.630
  516   3HG2  VAL  67          3HG2      VAL  67   7.558  -2.669  -0.453
  517    H    CYS  68           H        CYS  68  10.389  -3.577   4.156
  518    HA   CYS  68           HA       CYS  68  11.716  -1.036   4.859
  519   1HB   CYS  68          2HB       CYS  68  10.791  -2.897   6.426
  520   2HB   CYS  68          1HB       CYS  68  12.244  -3.792   5.984
  521    HG   CYS  68           HG       CYS  68  12.152  -1.444   7.902
  522    H    SER  69           H        SER  69  14.070  -0.823   4.716
  523    HA   SER  69           HA       SER  69  15.352  -2.825   2.888
  524   1HB   SER  69          2HB       SER  69  16.487  -0.351   2.305
  525   2HB   SER  69          1HB       SER  69  15.255  -1.174   1.350
  526    HG   SER  69           HG       SER  69  14.073   0.490   1.847
  527    H    THR  70           H        THR  70  17.276  -3.553   3.618
  528    HA   THR  70           HA       THR  70  18.549  -2.206   5.950
  529    HB   THR  70           HB       THR  70  17.943  -4.649   5.950
  530    HG1  THR  70           1HG      THR  70  19.851  -5.260   6.864
  531   1HG2  THR  70          1HG2      THR  70  20.251  -5.250   4.181
  532   2HG2  THR  70          2HG2      THR  70  18.775  -4.697   3.395
  533   3HG2  THR  70          3HG2      THR  70  18.747  -6.138   4.411
  534    HA   PRO  71           HA       PRO  71  21.747  -0.486   3.491
  535   1HB   PRO  71          2HB       PRO  71  23.893  -1.217   5.263
  536   2HB   PRO  71          1HB       PRO  71  23.079   0.344   5.116
  537   1HG   PRO  71          2HG       PRO  71  22.874  -1.522   7.266
  538   2HG   PRO  71          1HG       PRO  71  21.994  -0.004   7.071
  539   1HD   PRO  71          2HD       PRO  71  20.989  -2.714   6.806
  540   2HD   PRO  71          1HD       PRO  71  20.076  -1.189   6.732
  541    H    GLN  72           H        GLN  72  21.555  -3.804   3.854
  542    HA   GLN  72           HA       GLN  72  24.100  -4.362   2.431
  543   1HB   GLN  72          2HB       GLN  72  23.393  -5.780   4.306
  544   2HB   GLN  72          1HB       GLN  72  21.853  -6.094   3.517
  545   1HG   GLN  72          2HG       GLN  72  23.505  -7.958   3.247
  546   2HG   GLN  72          1HG       GLN  72  22.959  -7.290   1.712
  547   1HE2  GLN  72          1HE2      GLN  72  25.686  -7.202   4.033
  548   2HE2  GLN  72          2HE2      GLN  72  26.843  -6.692   2.900
  549    H    SER  73           H        SER  73  21.708  -2.847   1.265
  550    HA   SER  73           HA       SER  73  20.628  -2.722  -0.831
  551   1HB   SER  73          2HB       SER  73  23.099  -3.968  -1.170
  552   2HB   SER  73          1HB       SER  73  21.977  -5.071  -1.960
  553    HG   SER  73           HG       SER  73  22.635  -2.422  -2.556
  554    H    GLN  74           H        GLN  74  19.275  -4.083   1.176
  555    HA   GLN  74           HA       GLN  74  17.944  -6.288  -0.348
  556   1HB   GLN  74          2HB       GLN  74  18.181  -6.502   2.604
  557   2HB   GLN  74          1HB       GLN  74  18.300  -7.762   1.383
  558   1HG   GLN  74          2HG       GLN  74  20.526  -6.640   0.718
  559   2HG   GLN  74          1HG       GLN  74  20.419  -5.804   2.266
  560   1HE2  GLN  74          1HE2      GLN  74  21.050  -8.899   0.734
  561   2HE2  GLN  74          2HE2      GLN  74  21.433  -9.746   2.155
  562    H    TYR  75           H        TYR  75  15.736  -6.796   0.701
  563    HA   TYR  75           HA       TYR  75  14.516  -4.446   2.083
  564   1HB   TYR  75          2HB       TYR  75  13.442  -5.643  -0.482
  565   2HB   TYR  75          1HB       TYR  75  12.838  -4.216   0.350
  566    HD1  TYR  75           1HD      TYR  75  15.739  -5.601  -1.499
  567    HD2  TYR  75           2HD      TYR  75  13.838  -2.078   0.039
  568    HE1  TYR  75           1HE      TYR  75  17.342  -4.199  -2.752
  569    HE2  TYR  75           2HE      TYR  75  15.437  -0.670  -1.216
  570    HH   TYR  75           HH       TYR  75  18.265  -1.932  -2.660
  571    H    TYR  76           H        TYR  76  12.323  -4.931   2.908
  572    HA   TYR  76           HA       TYR  76  11.035  -7.482   2.723
  573   1HB   TYR  76          2HB       TYR  76  11.719  -8.416   4.932
  574   2HB   TYR  76          1HB       TYR  76  13.098  -8.254   3.855
  575    HD1  TYR  76           1HD      TYR  76  11.314  -6.685   6.701
  576    HD2  TYR  76           2HD      TYR  76  14.927  -6.782   4.392
  577    HE1  TYR  76           1HE      TYR  76  12.429  -5.284   8.404
  578    HE2  TYR  76           2HE      TYR  76  16.048  -5.377   6.094
  579    HH   TYR  76           HH       TYR  76  14.475  -3.611   8.349
  580    H    LEU  77           H        LEU  77   9.229  -7.660   4.267
  581    HA   LEU  77           HA       LEU  77   8.399  -5.010   5.396
  582   1HB   LEU  77          2HB       LEU  77   7.061  -6.709   3.786
  583   2HB   LEU  77          1HB       LEU  77   6.660  -7.464   5.328
  584    HG   LEU  77           HG       LEU  77   6.386  -4.519   5.283
  585   1HD1  LEU  77          1HD1      LEU  77   5.579  -5.386   2.980
  586   2HD1  LEU  77          2HD1      LEU  77   4.454  -4.406   3.920
  587   3HD1  LEU  77          3HD1      LEU  77   4.274  -6.160   3.880
  588   1HD2  LEU  77          1HD2      LEU  77   5.571  -5.549   7.224
  589   2HD2  LEU  77          2HD2      LEU  77   4.905  -6.918   6.334
  590   3HD2  LEU  77          3HD2      LEU  77   4.100  -5.350   6.269
  591    H    ALA  78           H        ALA  78   9.844  -7.904   6.118
  592    HA   ALA  78           HA       ALA  78   9.756  -7.493   9.021
  593   1HB   ALA  78          1HB       ALA  78   8.058  -9.029   9.216
  594   2HB   ALA  78          2HB       ALA  78   9.277 -10.226   8.783
  595   3HB   ALA  78          3HB       ALA  78   8.232  -9.542   7.538
  596    H    GLU  79           H        GLU  79  11.934  -7.700   9.512
  597    HA   GLU  79           HA       GLU  79  13.984  -8.378   7.766
  598   1HB   GLU  79          2HB       GLU  79  13.595  -8.381  10.729
  599   2HB   GLU  79          1HB       GLU  79  15.081  -9.102  10.106
  600   1HG   GLU  79          2HG       GLU  79  15.405  -6.996   8.736
  601   2HG   GLU  79          1HG       GLU  79  14.072  -6.288   9.650
  602    H    LYS  80           H        LYS  80  11.788 -10.555   9.296
  603    HA   LYS  80           HA       LYS  80  13.052 -12.993   9.588
  604   1HB   LYS  80          2HB       LYS  80  10.437 -11.974   8.988
  605   2HB   LYS  80          1HB       LYS  80  10.706 -13.416   8.012
  606   1HG   LYS  80          2HG       LYS  80  11.299 -13.336  10.978
  607   2HG   LYS  80          1HG       LYS  80   9.725 -13.814  10.340
  608   1HD   LYS  80          2HD       LYS  80  10.595 -15.900  10.207
  609   2HD   LYS  80          1HD       LYS  80  11.474 -15.301   8.799
  610   1HE   LYS  80          2HE       LYS  80  13.391 -15.763   9.923
  611   2HE   LYS  80          1HE       LYS  80  12.974 -14.444  11.037
  612   1HZ   LYS  80          1HZ       LYS  80  13.182 -16.501  12.262
  613   2HZ   LYS  80          2HZ       LYS  80  12.067 -17.269  11.237
  614   3HZ   LYS  80          3HZ       LYS  80  11.559 -16.011  12.259
  615    H    HIS  81           H        HIS  81  12.210 -11.418   6.513
  616    HA   HIS  81           HA       HIS  81  14.226 -13.049   5.100
  617   1HB   HIS  81          2HB       HIS  81  12.391 -13.695   3.406
  618   2HB   HIS  81          1HB       HIS  81  12.374 -14.548   4.949
  619    HD1  HIS  81           1HD      HIS  81  10.765 -11.439   3.412
  620    HD2  HIS  81           2HD      HIS  81   9.922 -14.413   6.210
  621    HE1  HIS  81           1HE      HIS  81   8.390 -11.037   4.193
  622    H    LEU  82           H        LEU  82  15.074 -11.832   3.393
  623    HA   LEU  82           HA       LEU  82  13.476  -9.537   2.400
  624   1HB   LEU  82          2HB       LEU  82  15.305  -8.005   2.933
  625   2HB   LEU  82          1HB       LEU  82  14.839  -8.871   4.393
  626    HG   LEU  82           HG       LEU  82  17.077  -9.802   2.608
  627   1HD1  LEU  82          1HD1      LEU  82  18.533  -8.328   3.548
  628   2HD1  LEU  82          2HD1      LEU  82  17.793  -8.474   5.140
  629   3HD1  LEU  82          3HD1      LEU  82  17.093  -7.389   3.939
  630   1HD2  LEU  82          1HD2      LEU  82  16.898 -11.563   4.039
  631   2HD2  LEU  82          2HD2      LEU  82  15.843 -10.665   5.132
  632   3HD2  LEU  82          3HD2      LEU  82  17.594 -10.490   5.252
  633    H    PHE  83           H        PHE  83  13.981  -8.966   0.268
  634    HA   PHE  83           HA       PHE  83  15.992 -10.715  -1.094
  635   1HB   PHE  83          2HB       PHE  83  13.316  -9.543  -1.864
  636   2HB   PHE  83          1HB       PHE  83  14.430 -10.142  -3.098
  637    HD1  PHE  83           1HD      PHE  83  15.604 -12.487  -2.356
  638    HD2  PHE  83           2HD      PHE  83  11.734 -11.102  -1.115
  639    HE1  PHE  83           1HE      PHE  83  14.923 -14.821  -1.870
  640    HE2  PHE  83           2HE      PHE  83  11.052 -13.434  -0.631
  641    HZ   PHE  83           HZ       PHE  83  12.647 -15.294  -1.008
  642    H    SER  84           H        SER  84  15.494  -8.792  -3.525
  643    HA   SER  84           HA       SER  84  17.362  -6.660  -2.527
  644   1HB   SER  84          2HB       SER  84  17.181  -8.059  -5.213
  645   2HB   SER  84          1HB       SER  84  18.345  -6.803  -4.800
  646    HG   SER  84           HG       SER  84  18.088  -9.423  -3.779
  647    H    THR  85           H        THR  85  14.202  -6.961  -3.458
  648    HA   THR  85           HA       THR  85  13.991  -4.133  -4.169
  649    HB   THR  85           HB       THR  85  13.057  -6.032  -6.310
  650    HG1  THR  85           1HG      THR  85  15.000  -6.257  -7.096
  651   1HG2  THR  85          1HG2      THR  85  13.035  -3.243  -5.889
  652   2HG2  THR  85          2HG2      THR  85  12.566  -4.106  -7.352
  653   3HG2  THR  85          3HG2      THR  85  14.222  -3.534  -7.159
  654    H    ILE  86           H        ILE  86  11.673  -3.482  -4.449
  655    HA   ILE  86           HA       ILE  86   9.917  -4.921  -2.669
  656    HB   ILE  86           HB       ILE  86   9.758  -2.585  -4.542
  657   1HG1  ILE  86          2HG1      ILE  86   8.832  -1.816  -2.094
  658   2HG1  ILE  86          1HG1      ILE  86   9.915  -3.132  -1.647
  659   1HG2  ILE  86          1HG2      ILE  86   7.575  -3.633  -4.831
  660   2HG2  ILE  86          2HG2      ILE  86   7.392  -2.228  -3.780
  661   3HG2  ILE  86          3HG2      ILE  86   7.414  -3.850  -3.089
  662   1HD1  ILE  86          1HD1      ILE  86  11.570  -1.598  -1.798
  663   2HD1  ILE  86          2HD1      ILE  86  10.554  -0.468  -2.694
  664   3HD1  ILE  86          3HD1      ILE  86  11.387  -1.769  -3.544
  665    HA   PRO  87           HA       PRO  87   7.505  -6.114  -6.755
  666   1HB   PRO  87          2HB       PRO  87   9.492  -6.228  -8.836
  667   2HB   PRO  87          1HB       PRO  87   8.041  -5.221  -8.770
  668   1HG   PRO  87          2HG       PRO  87  10.794  -4.420  -8.417
  669   2HG   PRO  87          1HG       PRO  87   9.351  -3.404  -8.463
  670   1HD   PRO  87          2HD       PRO  87  10.956  -3.988  -6.186
  671   2HD   PRO  87          1HD       PRO  87   9.395  -3.134  -6.201
  672    H    GLU  88           H        GLU  88  10.983  -6.866  -6.533
  673    HA   GLU  88           HA       GLU  88  10.893  -9.609  -7.297
  674   1HB   GLU  88          2HB       GLU  88  12.855  -7.976  -6.819
  675   2HB   GLU  88          1HB       GLU  88  12.651  -8.441  -5.131
  676   1HG   GLU  88          2HG       GLU  88  14.157 -10.064  -5.735
  677   2HG   GLU  88          1HG       GLU  88  12.680 -10.890  -6.233
  678    H    LEU  89           H        LEU  89  10.954  -8.232  -3.997
  679    HA   LEU  89           HA       LEU  89  10.449 -10.499  -2.450
  680   1HB   LEU  89          2HB       LEU  89  10.289  -7.630  -2.262
  681   2HB   LEU  89          1HB       LEU  89   8.870  -8.311  -1.468
  682    HG   LEU  89           HG       LEU  89  11.686  -9.267  -0.920
  683   1HD1  LEU  89          1HD1      LEU  89  11.767  -7.831   0.970
  684   2HD1  LEU  89          2HD1      LEU  89  10.060  -7.417   0.829
  685   3HD1  LEU  89          3HD1      LEU  89  11.217  -6.806  -0.354
  686   1HD2  LEU  89          1HD2      LEU  89   9.058  -9.572   0.569
  687   2HD2  LEU  89          2HD2      LEU  89  10.613 -10.213   1.099
  688   3HD2  LEU  89          3HD2      LEU  89   9.857 -10.835  -0.368
  689    H    ILE  90           H        ILE  90   7.923  -8.292  -3.751
  690    HA   ILE  90           HA       ILE  90   5.662  -9.801  -2.937
  691    HB   ILE  90           HB       ILE  90   6.108  -8.033  -5.367
  692   1HG1  ILE  90          2HG1      ILE  90   4.752  -7.139  -2.855
  693   2HG1  ILE  90          1HG1      ILE  90   6.510  -7.268  -2.841
  694   1HG2  ILE  90          1HG2      ILE  90   3.677  -9.258  -4.120
  695   2HG2  ILE  90          2HG2      ILE  90   4.037  -8.970  -5.823
  696   3HG2  ILE  90          3HG2      ILE  90   3.547  -7.630  -4.785
  697   1HD1  ILE  90          1HD1      ILE  90   5.843  -5.007  -3.512
  698   2HD1  ILE  90          2HD1      ILE  90   4.859  -5.668  -4.818
  699   3HD1  ILE  90          3HD1      ILE  90   6.614  -5.834  -4.865
  700    H    ASN  91           H        ASN  91   7.528  -9.948  -5.980
  701    HA   ASN  91           HA       ASN  91   5.922 -11.901  -7.311
  702   1HB   ASN  91          2HB       ASN  91   7.963 -10.343  -8.001
  703   2HB   ASN  91          1HB       ASN  91   8.901 -11.789  -7.625
  704   1HD2  ASN  91          1HD2      ASN  91   8.580 -10.706 -10.320
  705   2HD2  ASN  91          2HD2      ASN  91   7.750 -11.872 -11.232
  706    H    TYR  92           H        TYR  92   8.678 -12.232  -5.081
  707    HA   TYR  92           HA       TYR  92   9.275 -14.950  -5.267
  708   1HB   TYR  92          2HB       TYR  92   9.274 -12.862  -3.148
  709   2HB   TYR  92          1HB       TYR  92   9.472 -14.527  -2.605
  710    HD1  TYR  92           1HD      TYR  92  11.181 -15.967  -3.988
  711    HD2  TYR  92           2HD      TYR  92  11.156 -11.676  -3.873
  712    HE1  TYR  92           1HE      TYR  92  13.548 -15.937  -4.722
  713    HE2  TYR  92           2HE      TYR  92  13.524 -11.645  -4.605
  714    HH   TYR  92           HH       TYR  92  15.487 -13.168  -4.547
  715    H    HIS  93           H        HIS  93   6.552 -13.460  -3.509
  716    HA   HIS  93           HA       HIS  93   5.515 -16.206  -2.907
  717   1HB   HIS  93          2HB       HIS  93   5.542 -13.564  -1.575
  718   2HB   HIS  93          1HB       HIS  93   4.015 -14.437  -1.448
  719    HD1  HIS  93           1HD      HIS  93   7.013 -14.076   0.361
  720    HD2  HIS  93           2HD      HIS  93   4.759 -17.401  -0.751
  721    HE1  HIS  93           1HE      HIS  93   7.687 -15.953   1.922
  722    H    GLN  94           H        GLN  94   4.038 -12.983  -3.457
  723    HA   GLN  94           HA       GLN  94   2.626 -13.722  -5.855
  724   1HB   GLN  94          2HB       GLN  94   1.578 -14.594  -3.270
  725   2HB   GLN  94          1HB       GLN  94   0.417 -13.594  -4.139
  726   1HG   GLN  94          2HG       GLN  94   0.079 -15.163  -5.747
  727   2HG   GLN  94          1HG       GLN  94   1.789 -15.588  -5.824
  728   1HE2  GLN  94          1HE2      GLN  94  -1.163 -16.884  -5.003
  729   2HE2  GLN  94          2HE2      GLN  94  -0.656 -18.039  -3.869
  730    H    HIS  95           H        HIS  95   1.328 -12.059  -2.979
  731    HA   HIS  95           HA       HIS  95   1.719  -9.438  -4.369
  732   1HB   HIS  95          2HB       HIS  95  -0.639  -8.893  -3.742
  733   2HB   HIS  95          1HB       HIS  95  -0.535 -10.255  -4.856
  734    HD1  HIS  95           1HD      HIS  95  -1.233 -12.569  -3.985
  735    HD2  HIS  95           2HD      HIS  95  -1.381  -9.608  -1.056
  736    HE1  HIS  95           1HE      HIS  95  -2.439 -13.582  -2.003
  737    H    ASN  96           H        ASN  96   0.911 -11.126  -1.330
  738    HA   ASN  96           HA       ASN  96   2.187  -8.851   0.153
  739   1HB   ASN  96          2HB       ASN  96  -0.273  -8.816   0.327
  740   2HB   ASN  96          1HB       ASN  96  -0.264 -10.491   0.880
  741   1HD2  ASN  96          1HD2      ASN  96  -0.421 -10.648   3.115
  742   2HD2  ASN  96          2HD2      ASN  96   0.190  -9.516   4.222
  743    H    SER  97           H        SER  97   1.056 -12.231   0.612
  744    HA   SER  97           HA       SER  97   3.738 -12.983   1.627
  745   1HB   SER  97          2HB       SER  97   1.260 -12.598   3.234
  746   2HB   SER  97          1HB       SER  97   2.241 -14.008   3.625
  747    HG   SER  97           HG       SER  97   2.888 -12.137   4.787
  748    H    ALA  98           H        ALA  98   0.494 -14.431   2.008
  749    HA   ALA  98           HA       ALA  98   0.898 -16.379  -0.128
  750   1HB   ALA  98          1HB       ALA  98   1.787 -16.853   2.644
  751   2HB   ALA  98          2HB       ALA  98   2.267 -17.673   1.158
  752   3HB   ALA  98          3HB       ALA  98   0.780 -18.141   1.983
  753    H    GLY  99           H        GLY  99  -1.178 -16.696  -0.819
  754   1HA   GLY  99          2HA       GLY  99  -3.280 -17.853   0.511
  755   2HA   GLY  99          1HA       GLY  99  -3.446 -16.154   0.951
  756    H    LEU 100           H        LEU 100  -5.026 -18.053  -0.887
  757    HA   LEU 100           HA       LEU 100  -6.184 -17.886  -2.940
  758   1HB   LEU 100          2HB       LEU 100  -5.951 -15.348  -1.645
  759   2HB   LEU 100          1HB       LEU 100  -5.812 -15.075  -3.381
  760    HG   LEU 100           HG       LEU 100  -7.870 -16.643  -3.579
  761   1HD1  LEU 100          1HD1      LEU 100  -8.269 -17.578  -1.513
  762   2HD1  LEU 100          2HD1      LEU 100  -9.263 -16.130  -1.343
  763   3HD1  LEU 100          3HD1      LEU 100  -7.645 -16.177  -0.642
  764   1HD2  LEU 100          1HD2      LEU 100  -9.392 -14.736  -3.217
  765   2HD2  LEU 100          2HD2      LEU 100  -7.907 -14.202  -4.006
  766   3HD2  LEU 100          3HD2      LEU 100  -8.145 -13.911  -2.282
  767    H    ILE 101           H        ILE 101  -5.834 -16.372  -5.192
  768    HA   ILE 101           HA       ILE 101  -2.951 -16.673  -5.946
  769    HB   ILE 101           HB       ILE 101  -3.768 -17.746  -8.053
  770   1HG1  ILE 101          2HG1      ILE 101  -6.448 -17.962  -6.669
  771   2HG1  ILE 101          1HG1      ILE 101  -6.089 -16.650  -7.792
  772   1HG2  ILE 101          1HG2      ILE 101  -3.261 -18.940  -5.739
  773   2HG2  ILE 101          2HG2      ILE 101  -3.903 -19.856  -7.102
  774   3HG2  ILE 101          3HG2      ILE 101  -4.980 -19.320  -5.812
  775   1HD1  ILE 101          1HD1      ILE 101  -7.187 -18.873  -8.685
  776   2HD1  ILE 101          2HD1      ILE 101  -5.533 -19.481  -8.621
  777   3HD1  ILE 101          3HD1      ILE 101  -5.920 -18.082  -9.623
  778    H    SER 102           H        SER 102  -4.657 -14.291  -5.351
  779    HA   SER 102           HA       SER 102  -4.830 -13.024  -8.057
  780   1HB   SER 102          2HB       SER 102  -6.179 -11.331  -6.712
  781   2HB   SER 102          1HB       SER 102  -6.870 -12.950  -6.783
  782    HG   SER 102           HG       SER 102  -6.875 -12.251  -4.656
  783    H    ARG 103           H        ARG 103  -3.256 -11.559  -8.589
  784    HA   ARG 103           HA       ARG 103  -1.148 -10.863  -6.698
  785   1HB   ARG 103          2HB       ARG 103  -1.852 -10.033  -9.529
  786   2HB   ARG 103          1HB       ARG 103  -0.374  -9.529  -8.710
  787   1HG   ARG 103          2HG       ARG 103  -1.164 -12.435  -8.989
  788   2HG   ARG 103          1HG       ARG 103  -0.172 -11.602 -10.188
  789   1HD   ARG 103          2HD       ARG 103   0.715 -11.238  -7.383
  790   2HD   ARG 103          1HD       ARG 103   0.877 -12.887  -8.021
  791    HE   ARG 103           HE       ARG 103   2.289 -12.022  -9.798
  792   1HH1  ARG 103          1HH2      ARG 103   1.117  -9.332 -10.190
  793   2HH1  ARG 103          2HH2      ARG 103   2.303  -8.290  -9.479
  794   1HH2  ARG 103          1HH1      ARG 103   3.871 -10.836  -7.721
  795   2HH2  ARG 103          2HH1      ARG 103   3.863  -9.141  -8.081
  796    H    LEU 104           H        LEU 104  -2.946  -8.575  -8.764
  797    HA   LEU 104           HA       LEU 104  -2.941  -6.628  -6.508
  798   1HB   LEU 104          2HB       LEU 104  -1.992  -6.114  -8.788
  799   2HB   LEU 104          1HB       LEU 104  -3.621  -6.277  -9.446
  800    HG   LEU 104           HG       LEU 104  -3.321  -4.485  -7.094
  801   1HD1  LEU 104          1HD1      LEU 104  -2.623  -2.612  -8.641
  802   2HD1  LEU 104          2HD1      LEU 104  -2.232  -3.840  -9.845
  803   3HD1  LEU 104          3HD1      LEU 104  -1.359  -3.798  -8.313
  804   1HD2  LEU 104          1HD2      LEU 104  -5.230  -3.552  -7.946
  805   2HD2  LEU 104          2HD2      LEU 104  -5.340  -5.084  -8.812
  806   3HD2  LEU 104          3HD2      LEU 104  -4.663  -3.666  -9.612
  807    H    LYS 105           H        LYS 105  -4.983  -5.248  -6.344
  808    HA   LYS 105           HA       LYS 105  -7.394  -6.992  -6.671
  809   1HB   LYS 105          2HB       LYS 105  -6.627  -4.810  -4.716
  810   2HB   LYS 105          1HB       LYS 105  -8.237  -5.532  -4.771
  811   1HG   LYS 105          2HG       LYS 105  -7.153  -7.786  -4.478
  812   2HG   LYS 105          1HG       LYS 105  -5.619  -6.954  -4.219
  813   1HD   LYS 105          2HD       LYS 105  -7.144  -5.584  -2.473
  814   2HD   LYS 105          1HD       LYS 105  -8.005  -7.123  -2.449
  815   1HE   LYS 105          2HE       LYS 105  -5.562  -8.131  -2.215
  816   2HE   LYS 105          1HE       LYS 105  -5.201  -6.515  -1.575
  817   1HZ   LYS 105          1HZ       LYS 105  -7.295  -8.400  -0.642
  818   2HZ   LYS 105          2HZ       LYS 105  -7.246  -6.764  -0.181
  819   3HZ   LYS 105          3HZ       LYS 105  -5.973  -7.809   0.241
  820    H    TYR 106           H        TYR 106  -7.600  -3.512  -5.963
  821    HA   TYR 106           HA       TYR 106  -8.695  -3.138  -8.735
  822   1HB   TYR 106          2HB       TYR 106 -10.504  -3.208  -7.129
  823   2HB   TYR 106          1HB       TYR 106  -9.656  -2.100  -6.054
  824    HD1  TYR 106           1HD      TYR 106 -10.118   0.183  -6.183
  825    HD2  TYR 106           2HD      TYR 106 -10.887  -2.309  -9.591
  826    HE1  TYR 106           1HE      TYR 106 -11.053   2.133  -7.396
  827    HE2  TYR 106           2HE      TYR 106 -11.827  -0.362 -10.802
  828    HH   TYR 106           HH       TYR 106 -12.809   1.802 -10.325
  829    HA   PRO 107           HA       PRO 107  -5.533   0.032  -8.897
  830   1HB   PRO 107          2HB       PRO 107  -6.841   1.174 -11.185
  831   2HB   PRO 107          1HB       PRO 107  -5.393   0.162 -11.148
  832   1HG   PRO 107          2HG       PRO 107  -7.992  -0.551 -12.098
  833   2HG   PRO 107          1HG       PRO 107  -6.558  -1.577 -12.002
  834   1HD   PRO 107          2HD       PRO 107  -8.940  -1.675 -10.359
  835   2HD   PRO 107          1HD       PRO 107  -7.531  -2.758 -10.316
  836    H    VAL 108           H        VAL 108  -5.544   1.875  -7.742
  837    HA   VAL 108           HA       VAL 108  -7.800   3.805  -7.951
  838    HB   VAL 108           HB       VAL 108  -6.672   2.537  -5.428
  839   1HG1  VAL 108          1HG1      VAL 108  -8.633   4.835  -5.715
  840   2HG1  VAL 108          2HG1      VAL 108  -6.988   4.959  -5.092
  841   3HG1  VAL 108          3HG1      VAL 108  -8.201   4.043  -4.200
  842   1HG2  VAL 108          1HG2      VAL 108  -8.999   1.846  -5.070
  843   2HG2  VAL 108          2HG2      VAL 108  -8.419   1.255  -6.626
  844   3HG2  VAL 108          3HG2      VAL 108  -9.480   2.661  -6.556
  845    H    SER 109           H        SER 109  -6.961   5.934  -7.968
  846    HA   SER 109           HA       SER 109  -4.018   6.197  -7.546
  847   1HB   SER 109          2HB       SER 109  -6.129   7.674  -9.111
  848   2HB   SER 109          1HB       SER 109  -4.570   8.428  -8.778
  849    HG   SER 109           HG       SER 109  -3.725   7.202 -10.249
  850    H    GLN 110           H        GLN 110  -6.573   8.653  -7.308
  851    HA   GLN 110           HA       GLN 110  -5.892   9.077  -4.460
  852   1HB   GLN 110          2HB       GLN 110  -5.978  11.316  -6.489
  853   2HB   GLN 110          1HB       GLN 110  -5.287  11.352  -4.868
  854   1HG   GLN 110          2HG       GLN 110  -3.674   9.525  -5.705
  855   2HG   GLN 110          1HG       GLN 110  -4.214   9.963  -7.325
  856   1HE2  GLN 110          1HE2      GLN 110  -1.503  10.384  -6.510
  857   2HE2  GLN 110          2HE2      GLN 110  -1.221  12.055  -6.428
  858    H    GLN 111           H        GLN 111  -7.413  11.798  -5.144
  859    HA   GLN 111           HA       GLN 111  -9.985  10.911  -4.204
  860   1HB   GLN 111          2HB       GLN 111 -10.547  13.320  -4.560
  861   2HB   GLN 111          1HB       GLN 111  -9.029  13.101  -3.683
  862   1HG   GLN 111          2HG       GLN 111  -7.729  13.769  -5.491
  863   2HG   GLN 111          1HG       GLN 111  -8.951  13.307  -6.676
  864   1HE2  GLN 111          1HE2      GLN 111 -10.605  14.854  -7.201
  865   2HE2  GLN 111          2HE2      GLN 111 -10.590  16.444  -6.606
  866    H    ASN 112           H        ASN 112  -9.862   9.309  -6.302
  867    HA   ASN 112           HA       ASN 112 -11.153  10.621  -8.623
  868   1HB   ASN 112          2HB       ASN 112  -9.076   9.064  -8.675
  869   2HB   ASN 112          1HB       ASN 112 -10.231   7.760  -8.399
  870   1HD2  ASN 112          1HD2      ASN 112  -8.571   8.807 -10.887
  871   2HD2  ASN 112          2HD2      ASN 112  -9.728   8.784 -12.130
  872    H    LYS 113           H        LYS 113 -11.538   7.848  -6.415
  873    HA   LYS 113           HA       LYS 113 -13.457   6.609  -5.809
  874   1HB   LYS 113          2HB       LYS 113 -14.970   9.122  -6.537
  875   2HB   LYS 113          1HB       LYS 113 -15.283   8.003  -5.212
  876   1HG   LYS 113          2HG       LYS 113 -12.880   9.849  -5.434
  877   2HG   LYS 113          1HG       LYS 113 -14.268  10.091  -4.376
  878   1HD   LYS 113          2HD       LYS 113 -13.605   8.463  -2.904
  879   2HD   LYS 113          1HD       LYS 113 -12.885   7.464  -4.164
  880   1HE   LYS 113          2HE       LYS 113 -11.036   8.302  -2.881
  881   2HE   LYS 113          1HE       LYS 113 -11.072   9.303  -4.343
  882   1HZ   LYS 113          1HZ       LYS 113 -11.008  10.823  -2.572
  883   2HZ   LYS 113          2HZ       LYS 113 -12.143   9.953  -1.659
  884   3HZ   LYS 113          3HZ       LYS 113 -12.635  10.796  -3.050
  885    H    ASN 114           H        ASN 114 -15.911   6.247  -6.705
  886    HA   ASN 114           HA       ASN 114 -16.086   6.446  -9.641
  887   1HB   ASN 114          2HB       ASN 114 -14.914   4.215  -8.293
  888   2HB   ASN 114          1HB       ASN 114 -16.434   3.688  -9.013
  889   1HD2  ASN 114          1HD2      ASN 114 -13.573   5.700  -9.929
  890   2HD2  ASN 114          2HD2      ASN 114 -13.507   5.132 -11.527
  891    H    ALA 115           H        ALA 115 -17.416   4.676  -6.819
  892    HA   ALA 115           HA       ALA 115 -19.658   4.303  -6.167
  893   1HB   ALA 115          1HB       ALA 115 -20.410   6.777  -7.677
  894   2HB   ALA 115          2HB       ALA 115 -19.222   6.929  -6.383
  895   3HB   ALA 115          3HB       ALA 115 -20.831   6.302  -6.031
  896    HA   PRO 116           HA       PRO 116 -20.567   2.610 -10.415
  897   1HB   PRO 116          2HB       PRO 116 -21.459   0.245  -9.037
  898   2HB   PRO 116          1HB       PRO 116 -20.035   0.435 -10.065
  899   1HG   PRO 116          2HG       PRO 116 -20.121   0.137  -7.209
  900   2HG   PRO 116          1HG       PRO 116 -18.700   0.318  -8.241
  901   1HD   PRO 116          2HD       PRO 116 -19.807   2.249  -6.411
  902   2HD   PRO 116          1HD       PRO 116 -18.392   2.442  -7.476
  903    H    SER 117           H        SER 117 -22.476   1.908  -7.453
  904    HA   SER 117           HA       SER 117 -24.801   2.065  -7.054
  905   1HB   SER 117          2HB       SER 117 -24.064   4.440  -7.472
  906   2HB   SER 117          1HB       SER 117 -24.534   4.237  -9.158
  907    HG   SER 117           HG       SER 117 -26.637   3.945  -8.518
  908    H    THR 118           H        THR 118 -24.303  -0.034  -8.733
  909    HA   THR 118           HA       THR 118 -25.778   0.191 -11.255
  910    HB   THR 118           HB       THR 118 -24.742  -2.203  -9.698
  911    HG1  THR 118           1HG      THR 118 -22.956  -1.155 -10.165
  912   1HG2  THR 118          1HG2      THR 118 -26.024  -3.219 -11.308
  913   2HG2  THR 118          2HG2      THR 118 -24.590  -2.914 -12.287
  914   3HG2  THR 118          3HG2      THR 118 -25.970  -1.821 -12.381
  Start of MODEL   11
    1    H    THR   1           1H       THR   1  21.992  -8.531  -9.708
    2    HA   THR   1           HA       THR   1  20.098 -10.303  -8.243
    3    HB   THR   1           HB       THR   1  19.702  -7.994  -7.118
    4    HG1  THR   1           1HG      THR   1  20.911  -6.487  -7.896
    5   1HG2  THR   1          1HG2      THR   1  21.057  -8.675  -5.394
    6   2HG2  THR   1          2HG2      THR   1  22.436  -8.965  -6.455
    7   3HG2  THR   1          3HG2      THR   1  21.127 -10.143  -6.370
    8    H    GLU   2           H        GLU   2  17.934  -8.866  -8.197
    9    HA   GLU   2           HA       GLU   2  17.420  -8.003 -11.025
   10   1HB   GLU   2          2HB       GLU   2  16.035  -9.708  -9.037
   11   2HB   GLU   2          1HB       GLU   2  14.985  -8.633  -9.961
   12   1HG   GLU   2          2HG       GLU   2  15.360  -9.739 -11.925
   13   2HG   GLU   2          1HG       GLU   2  17.051 -10.058 -11.539
   14    H    ALA   3           H        ALA   3  16.478  -5.988 -11.325
   15    HA   ALA   3           HA       ALA   3  15.456  -4.514  -8.934
   16   1HB   ALA   3          1HB       ALA   3  17.991  -4.194  -9.867
   17   2HB   ALA   3          2HB       ALA   3  17.073  -2.894  -9.107
   18   3HB   ALA   3          3HB       ALA   3  17.142  -3.015 -10.866
   19    H    GLU   4           H        GLU   4  15.083  -2.065 -10.280
   20    HA   GLU   4           HA       GLU   4  13.735  -2.397 -12.827
   21   1HB   GLU   4          2HB       GLU   4  11.425  -2.069 -11.839
   22   2HB   GLU   4          1HB       GLU   4  12.155  -3.630 -11.466
   23   1HG   GLU   4          2HG       GLU   4  12.246  -3.183  -9.246
   24   2HG   GLU   4          1HG       GLU   4  12.838  -1.543  -9.514
   25    H    ASP   5           H        ASP   5  12.791  -0.351 -13.549
   26    HA   ASP   5           HA       ASP   5  12.793   2.005 -11.848
   27   1HB   ASP   5          2HB       ASP   5  14.733   3.081 -13.061
   28   2HB   ASP   5          1HB       ASP   5  15.193   1.718 -12.044
   29    H    SER   6           H        SER   6  10.951   0.787 -13.709
   30    HA   SER   6           HA       SER   6  11.006   2.483 -16.140
   31   1HB   SER   6          2HB       SER   6   9.657   0.035 -15.141
   32   2HB   SER   6          1HB       SER   6   8.708   1.030 -16.243
   33    HG   SER   6           HG       SER   6   9.864   0.127 -17.741
   34    H    ILE   7           H        ILE   7   8.455   3.113 -16.643
   35    HA   ILE   7           HA       ILE   7   7.834   5.174 -14.647
   36    HB   ILE   7           HB       ILE   7   6.571   4.312 -17.273
   37   1HG1  ILE   7          2HG1      ILE   7   8.336   6.685 -16.598
   38   2HG1  ILE   7          1HG1      ILE   7   8.915   5.203 -17.359
   39   1HG2  ILE   7          1HG2      ILE   7   5.766   6.847 -17.001
   40   2HG2  ILE   7          2HG2      ILE   7   5.884   6.440 -15.288
   41   3HG2  ILE   7          3HG2      ILE   7   4.823   5.508 -16.345
   42   1HD1  ILE   7          1HD1      ILE   7   6.614   6.756 -18.536
   43   2HD1  ILE   7          2HD1      ILE   7   7.669   5.584 -19.327
   44   3HD1  ILE   7          3HD1      ILE   7   8.285   7.182 -18.908
   45    H    GLU   8           H        GLU   8   5.475   3.068 -16.293
   46    HA   GLU   8           HA       GLU   8   3.576   1.950 -15.438
   47   1HB   GLU   8          2HB       GLU   8   5.585   1.558 -13.194
   48   2HB   GLU   8          1HB       GLU   8   4.120   0.601 -13.418
   49   1HG   GLU   8          2HG       GLU   8   5.072   0.208 -15.833
   50   2HG   GLU   8          1HG       GLU   8   6.610   0.666 -15.101
   51    H    MET   9           H        MET   9   2.109   3.677 -15.080
   52    HA   MET   9           HA       MET   9   1.742   4.440 -12.263
   53   1HB   MET   9          2HB       MET   9   1.521   6.889 -13.144
   54   2HB   MET   9          1HB       MET   9   3.132   6.230 -12.888
   55   1HG   MET   9          2HG       MET   9   3.276   7.215 -15.025
   56   2HG   MET   9          1HG       MET   9   3.008   5.514 -15.387
   57   1HE   MET   9          1HE       MET   9   0.442   4.597 -16.448
   58   2HE   MET   9          2HE       MET   9   2.020   5.021 -17.107
   59   3HE   MET   9          3HE       MET   9   0.560   5.635 -17.876
   60    H    TYR  10           H        TYR  10   0.145   2.762 -13.905
   61    HA   TYR  10           HA       TYR  10  -1.993   3.921 -15.311
   62   1HB   TYR  10          2HB       TYR  10  -1.840   1.545 -13.435
   63   2HB   TYR  10          1HB       TYR  10  -3.223   1.860 -14.482
   64    HD1  TYR  10           1HD      TYR  10  -2.928   1.895 -16.970
   65    HD2  TYR  10           2HD      TYR  10   0.213   0.670 -14.308
   66    HE1  TYR  10           1HE      TYR  10  -1.736   0.831 -18.867
   67    HE2  TYR  10           2HE      TYR  10   1.405  -0.394 -16.205
   68    HH   TYR  10           HH       TYR  10   0.487  -1.394 -18.623
   69    H    GLU  11           H        GLU  11  -2.406   2.789 -11.939
   70    HA   GLU  11           HA       GLU  11  -3.719   5.360 -11.220
   71   1HB   GLU  11          2HB       GLU  11  -5.210   3.349 -12.256
   72   2HB   GLU  11          1HB       GLU  11  -5.203   2.873 -10.562
   73   1HG   GLU  11          2HG       GLU  11  -7.084   4.285 -10.739
   74   2HG   GLU  11          1HG       GLU  11  -5.830   5.322 -10.062
   75    H    TRP  12           H        TRP  12  -3.140   2.012 -10.082
   76    HA   TRP  12           HA       TRP  12  -3.204   2.481  -7.317
   77   1HB   TRP  12          2HB       TRP  12  -1.786   0.424  -7.237
   78   2HB   TRP  12          1HB       TRP  12  -3.137   0.276  -8.359
   79    HD1  TRP  12           HD       TRP  12  -2.601  -0.107 -10.858
   80    HE1  TRP  12           1HE      TRP  12  -0.422  -0.363 -12.214
   81    HE3  TRP  12           3HE      TRP  12   0.806   1.289  -7.321
   82    HZ2  TRP  12           2HZ      TRP  12   2.394  -0.019 -11.845
   83    HZ3  TRP  12           3HZ      TRP  12   3.227   1.316  -7.848
   84    HH2  TRP  12           HH       TRP  12   4.025   0.665 -10.104
   85    H    TYR  13           H        TYR  13  -0.762   3.455  -9.610
   86    HA   TYR  13           HA       TYR  13   1.369   3.726  -7.608
   87   1HB   TYR  13          2HB       TYR  13   1.728   3.177 -10.012
   88   2HB   TYR  13          1HB       TYR  13   1.100   4.767 -10.444
   89    HD1  TYR  13           1HD      TYR  13   2.656   6.458 -10.803
   90    HD2  TYR  13           2HD      TYR  13   3.613   3.275  -8.080
   91    HE1  TYR  13           1HE      TYR  13   4.900   7.448 -10.434
   92    HE2  TYR  13           2HE      TYR  13   5.857   4.265  -7.712
   93    HH   TYR  13           HH       TYR  13   7.390   6.031  -9.431
   94    H    SER  14           H        SER  14   1.661   5.495  -6.326
   95    HA   SER  14           HA       SER  14   0.390   8.086  -7.147
   96   1HB   SER  14          2HB       SER  14   0.629   7.181  -4.289
   97   2HB   SER  14          1HB       SER  14  -0.504   8.332  -4.993
   98    HG   SER  14           HG       SER  14  -1.473   6.561  -6.084
   99    H    LYS  15           H        LYS  15   1.844   9.729  -7.156
  100    HA   LYS  15           HA       LYS  15   4.593   9.288  -6.398
  101   1HB   LYS  15          2HB       LYS  15   4.968  11.326  -7.499
  102   2HB   LYS  15          1HB       LYS  15   3.535  10.693  -8.298
  103   1HG   LYS  15          2HG       LYS  15   3.656  12.854  -6.178
  104   2HG   LYS  15          1HG       LYS  15   3.125  13.016  -7.848
  105   1HD   LYS  15          2HD       LYS  15   1.142  11.782  -7.461
  106   2HD   LYS  15          1HD       LYS  15   1.738  11.142  -5.935
  107   1HE   LYS  15          2HE       LYS  15   1.620  14.100  -6.069
  108   2HE   LYS  15          1HE       LYS  15   0.051  13.265  -6.055
  109   1HZ   LYS  15          1HZ       LYS  15   0.845  13.564  -3.795
  110   2HZ   LYS  15          2HZ       LYS  15   2.307  12.786  -4.175
  111   3HZ   LYS  15          3HZ       LYS  15   0.848  11.915  -4.193
  112    H    HIS  16           H        HIS  16   4.908   9.052  -4.205
  113    HA   HIS  16           HA       HIS  16   5.170   9.676  -1.956
  114   1HB   HIS  16          2HB       HIS  16   4.836  12.394  -3.263
  115   2HB   HIS  16          1HB       HIS  16   5.494  12.119  -1.653
  116    HD1  HIS  16           1HD      HIS  16   7.914  11.354  -1.479
  117    HD2  HIS  16           2HD      HIS  16   6.522  11.381  -5.408
  118    HE1  HIS  16           1HE      HIS  16   9.933  10.961  -2.957
  119    H    MET  17           H        MET  17   2.641   8.780  -2.462
  120    HA   MET  17           HA       MET  17   0.611  10.736  -1.649
  121   1HB   MET  17          2HB       MET  17   0.151   8.868  -3.189
  122   2HB   MET  17          1HB       MET  17   0.604   7.711  -1.938
  123   1HG   MET  17          2HG       MET  17  -1.229   8.647  -0.498
  124   2HG   MET  17          1HG       MET  17  -1.733   9.642  -1.865
  125   1HE   MET  17          1HE       MET  17  -0.337   5.810  -2.210
  126   2HE   MET  17          2HE       MET  17  -1.759   5.104  -1.447
  127   3HE   MET  17          3HE       MET  17  -0.807   6.305  -0.578
  128    H    THR  18           H        THR  18  -0.541  10.626   0.392
  129    HA   THR  18           HA       THR  18   1.178   9.812   2.651
  130    HB   THR  18           HB       THR  18  -1.550  11.113   2.684
  131    HG1  THR  18           1HG      THR  18   1.011  12.267   2.296
  132   1HG2  THR  18          1HG2      THR  18  -0.768  10.474   4.863
  133   2HG2  THR  18          2HG2      THR  18  -0.512  12.213   4.712
  134   3HG2  THR  18          3HG2      THR  18   0.846  11.101   4.529
  135    H    ARG  19           H        ARG  19   0.700   8.155   4.070
  136    HA   ARG  19           HA       ARG  19  -0.790   5.890   3.396
  137   1HB   ARG  19          2HB       ARG  19  -0.561   5.341   5.765
  138   2HB   ARG  19          1HB       ARG  19   0.886   6.209   5.252
  139   1HG   ARG  19          2HG       ARG  19  -0.230   8.344   6.092
  140   2HG   ARG  19          1HG       ARG  19  -1.470   7.318   6.816
  141   1HD   ARG  19          2HD       ARG  19   0.795   6.077   7.723
  142   2HD   ARG  19          1HD       ARG  19   1.329   7.769   7.677
  143    HE   ARG  19           HE       ARG  19  -0.909   6.711   9.306
  144   1HH1  ARG  19          1HH1      ARG  19   1.604   8.741   9.573
  145   2HH1  ARG  19          2HH1      ARG  19   0.719  10.141  10.084
  146   1HH2  ARG  19          1HH2      ARG  19  -2.380   8.791   9.311
  147   2HH2  ARG  19          2HH2      ARG  19  -1.536  10.169   9.934
  148    H    SER  20           H        SER  20  -1.834   8.736   5.211
  149    HA   SER  20           HA       SER  20  -4.480   7.782   5.832
  150   1HB   SER  20          2HB       SER  20  -4.047   9.519   7.213
  151   2HB   SER  20          1HB       SER  20  -2.741  10.087   6.182
  152    HG   SER  20           HG       SER  20  -4.171  11.289   5.033
  153    H    GLN  21           H        GLN  21  -3.114   9.807   3.228
  154    HA   GLN  21           HA       GLN  21  -5.567  10.520   1.961
  155   1HB   GLN  21          2HB       GLN  21  -2.713  10.100   1.050
  156   2HB   GLN  21          1HB       GLN  21  -3.966  10.636  -0.072
  157   1HG   GLN  21          2HG       GLN  21  -3.846  12.101   2.503
  158   2HG   GLN  21          1HG       GLN  21  -2.475  12.344   1.421
  159   1HE2  GLN  21          1HE2      GLN  21  -5.877  11.730   0.473
  160   2HE2  GLN  21          2HE2      GLN  21  -6.083  13.209  -0.331
  161    H    ALA  22           H        ALA  22  -3.436   7.682   1.569
  162    HA   ALA  22           HA       ALA  22  -4.914   6.432  -0.533
  163   1HB   ALA  22          1HB       ALA  22  -2.583   5.951   0.735
  164   2HB   ALA  22          2HB       ALA  22  -3.430   4.689  -0.159
  165   3HB   ALA  22          3HB       ALA  22  -3.600   4.794   1.593
  166    H    GLU  23           H        GLU  23  -5.107   6.129   3.012
  167    HA   GLU  23           HA       GLU  23  -7.166   4.209   3.207
  168   1HB   GLU  23          2HB       GLU  23  -6.403   6.637   4.849
  169   2HB   GLU  23          1HB       GLU  23  -7.648   5.506   5.378
  170   1HG   GLU  23          2HG       GLU  23  -5.990   3.652   5.196
  171   2HG   GLU  23          1HG       GLU  23  -4.756   4.841   4.785
  172    H    GLN  24           H        GLN  24  -7.568   7.783   3.231
  173    HA   GLN  24           HA       GLN  24 -10.415   7.672   3.122
  174   1HB   GLN  24          2HB       GLN  24 -10.193  10.078   2.518
  175   2HB   GLN  24          1HB       GLN  24  -9.168   9.631   3.879
  176   1HG   GLN  24          2HG       GLN  24  -7.258   9.366   2.277
  177   2HG   GLN  24          1HG       GLN  24  -8.303   9.981   0.996
  178   1HE2  GLN  24          1HE2      GLN  24  -6.605  10.880   3.978
  179   2HE2  GLN  24          2HE2      GLN  24  -6.787  12.556   3.781
  180    H    LEU  25           H        LEU  25  -8.036   8.184   0.432
  181    HA   LEU  25           HA       LEU  25 -10.157   8.255  -1.533
  182   1HB   LEU  25          2HB       LEU  25  -8.317   8.161  -3.138
  183   2HB   LEU  25          1HB       LEU  25  -7.874   9.231  -1.813
  184    HG   LEU  25           HG       LEU  25  -6.857   7.018  -0.782
  185   1HD1  LEU  25          1HD1      LEU  25  -7.789   6.089  -3.267
  186   2HD1  LEU  25          2HD1      LEU  25  -6.732   5.235  -2.146
  187   3HD1  LEU  25          3HD1      LEU  25  -6.038   6.210  -3.441
  188   1HD2  LEU  25          1HD2      LEU  25  -5.856   9.219  -2.216
  189   2HD2  LEU  25          2HD2      LEU  25  -5.075   7.817  -2.944
  190   3HD2  LEU  25          3HD2      LEU  25  -4.918   8.113  -1.217
  191    H    LEU  26           H        LEU  26  -8.520   5.668   0.135
  192    HA   LEU  26           HA       LEU  26  -9.223   3.592  -1.807
  193   1HB   LEU  26          2HB       LEU  26  -8.039   3.826   0.912
  194   2HB   LEU  26          1HB       LEU  26  -8.908   2.333   0.599
  195    HG   LEU  26           HG       LEU  26  -6.797   3.425  -1.274
  196   1HD1  LEU  26          1HD1      LEU  26  -6.142   1.024   0.298
  197   2HD1  LEU  26          2HD1      LEU  26  -6.294   2.484   1.274
  198   3HD1  LEU  26          3HD1      LEU  26  -5.150   2.436  -0.064
  199   1HD2  LEU  26          1HD2      LEU  26  -8.723   1.615  -1.801
  200   2HD2  LEU  26          2HD2      LEU  26  -7.528   0.541  -1.075
  201   3HD2  LEU  26          3HD2      LEU  26  -7.106   1.497  -2.494
  202    H    LYS  27           H        LYS  27 -10.397   4.360   1.508
  203    HA   LYS  27           HA       LYS  27 -12.798   2.853   1.425
  204   1HB   LYS  27          2HB       LYS  27 -11.474   4.639   3.110
  205   2HB   LYS  27          1HB       LYS  27 -12.998   5.454   2.758
  206   1HG   LYS  27          2HG       LYS  27 -13.608   2.712   3.228
  207   2HG   LYS  27          1HG       LYS  27 -12.526   3.232   4.520
  208   1HD   LYS  27          2HD       LYS  27 -13.996   4.871   5.277
  209   2HD   LYS  27          1HD       LYS  27 -14.807   5.008   3.717
  210   1HE   LYS  27          2HE       LYS  27 -16.423   3.745   4.761
  211   2HE   LYS  27          1HE       LYS  27 -15.345   2.398   4.343
  212   1HZ   LYS  27          1HZ       LYS  27 -14.137   2.879   6.454
  213   2HZ   LYS  27          2HZ       LYS  27 -15.718   2.296   6.676
  214   3HZ   LYS  27          3HZ       LYS  27 -15.385   3.950   6.873
  215    H    GLN  28           H        GLN  28 -12.093   6.142   0.300
  216    HA   GLN  28           HA       GLN  28 -14.701   7.011  -0.376
  217   1HB   GLN  28          2HB       GLN  28 -12.641   8.382  -0.351
  218   2HB   GLN  28          1HB       GLN  28 -12.055   7.522  -1.775
  219   1HG   GLN  28          2HG       GLN  28 -13.045   9.269  -2.876
  220   2HG   GLN  28          1HG       GLN  28 -14.494   8.287  -2.669
  221   1HE2  GLN  28          1HE2      GLN  28 -12.613  10.824  -0.922
  222   2HE2  GLN  28          2HE2      GLN  28 -13.975  11.556  -0.221
  223    H    GLU  29           H        GLU  29 -12.320   5.345  -2.524
  224    HA   GLU  29           HA       GLU  29 -14.079   5.127  -4.779
  225   1HB   GLU  29          2HB       GLU  29 -11.462   4.579  -4.254
  226   2HB   GLU  29          1HB       GLU  29 -12.118   2.942  -4.263
  227   1HG   GLU  29          2HG       GLU  29 -12.010   4.961  -6.486
  228   2HG   GLU  29          1HG       GLU  29 -11.561   3.260  -6.511
  229    H    GLY  30           H        GLY  30 -13.498   2.979  -2.002
  230   1HA   GLY  30          2HA       GLY  30 -15.096   1.575  -0.973
  231   2HA   GLY  30          1HA       GLY  30 -16.191   1.934  -2.298
  232    H    LYS  31           H        LYS  31 -13.054   0.892  -3.275
  233    HA   LYS  31           HA       LYS  31 -14.191  -1.584  -4.387
  234   1HB   LYS  31          2HB       LYS  31 -11.358  -0.492  -4.368
  235   2HB   LYS  31          1HB       LYS  31 -11.994  -1.724  -5.457
  236   1HG   LYS  31          2HG       LYS  31 -12.734   1.209  -5.339
  237   2HG   LYS  31          1HG       LYS  31 -12.030   0.329  -6.691
  238   1HD   LYS  31          2HD       LYS  31 -14.831   0.021  -5.575
  239   2HD   LYS  31          1HD       LYS  31 -14.383   0.654  -7.158
  240   1HE   LYS  31          2HE       LYS  31 -13.152  -1.825  -7.158
  241   2HE   LYS  31          1HE       LYS  31 -14.672  -2.142  -6.298
  242   1HZ   LYS  31          1HZ       LYS  31 -14.520  -0.566  -8.807
  243   2HZ   LYS  31          2HZ       LYS  31 -15.915  -1.149  -8.033
  244   3HZ   LYS  31          3HZ       LYS  31 -14.841  -2.230  -8.782
  245    H    GLU  32           H        GLU  32 -14.232  -3.470  -3.172
  246    HA   GLU  32           HA       GLU  32 -12.784  -3.712  -0.684
  247   1HB   GLU  32          2HB       GLU  32 -13.576  -6.111  -0.855
  248   2HB   GLU  32          1HB       GLU  32 -14.843  -4.887  -0.930
  249   1HG   GLU  32          2HG       GLU  32 -15.395  -5.431  -3.070
  250   2HG   GLU  32          1HG       GLU  32 -13.705  -5.553  -3.562
  251    H    GLY  33           H        GLY  33 -10.562  -3.524  -1.057
  252   1HA   GLY  33          2HA       GLY  33  -8.617  -5.049  -1.171
  253   2HA   GLY  33          1HA       GLY  33  -9.350  -5.728  -2.623
  254    H    GLY  34           H        GLY  34  -9.511  -2.273  -2.178
  255   1HA   GLY  34          2HA       GLY  34  -8.351  -1.644  -4.660
  256   2HA   GLY  34          1HA       GLY  34  -8.416  -0.520  -3.299
  257    H    PHE  35           H        PHE  35  -6.210  -0.909  -5.222
  258    HA   PHE  35           HA       PHE  35  -4.081  -1.637  -3.243
  259   1HB   PHE  35          2HB       PHE  35  -4.553  -3.479  -4.823
  260   2HB   PHE  35          1HB       PHE  35  -4.278  -2.384  -6.178
  261    HD1  PHE  35           1HD      PHE  35  -2.002  -1.275  -6.410
  262    HD2  PHE  35           2HD      PHE  35  -2.742  -4.557  -3.740
  263    HE1  PHE  35           1HE      PHE  35   0.435  -1.738  -6.303
  264    HE2  PHE  35           2HE      PHE  35  -0.307  -5.020  -3.632
  265    HZ   PHE  35           HZ       PHE  35   1.282  -3.609  -4.912
  266    H    ILE  36           H        ILE  36  -2.660   0.052  -3.017
  267    HA   ILE  36           HA       ILE  36  -2.116   1.784  -5.400
  268    HB   ILE  36           HB       ILE  36  -2.629   2.646  -2.534
  269   1HG1  ILE  36          2HG1      ILE  36  -4.269   3.091  -5.048
  270   2HG1  ILE  36          1HG1      ILE  36  -4.660   1.920  -3.786
  271   1HG2  ILE  36          1HG2      ILE  36  -2.002   4.212  -5.055
  272   2HG2  ILE  36          2HG2      ILE  36  -1.012   4.113  -3.599
  273   3HG2  ILE  36          3HG2      ILE  36  -2.567   4.943  -3.553
  274   1HD1  ILE  36          1HD1      ILE  36  -4.597   3.875  -2.144
  275   2HD1  ILE  36          2HD1      ILE  36  -5.946   3.863  -3.279
  276   3HD1  ILE  36          3HD1      ILE  36  -4.571   4.932  -3.556
  277    H    VAL  37           H        VAL  37  -0.028   3.014  -5.095
  278    HA   VAL  37           HA       VAL  37   1.825   1.891  -3.073
  279    HB   VAL  37           HB       VAL  37   2.257   1.744  -6.073
  280   1HG1  VAL  37          1HG1      VAL  37   4.323   0.541  -5.477
  281   2HG1  VAL  37          2HG1      VAL  37   3.973   0.775  -3.765
  282   3HG1  VAL  37          3HG1      VAL  37   4.333   2.165  -4.789
  283   1HG2  VAL  37          1HG2      VAL  37   2.292  -0.756  -5.543
  284   2HG2  VAL  37          2HG2      VAL  37   0.713   0.023  -5.437
  285   3HG2  VAL  37          3HG2      VAL  37   1.619  -0.337  -3.968
  286    H    ARG  38           H        ARG  38   3.549   3.326  -2.614
  287    HA   ARG  38           HA       ARG  38   3.826   5.753  -4.321
  288   1HB   ARG  38          2HB       ARG  38   3.614   7.166  -2.282
  289   2HB   ARG  38          1HB       ARG  38   2.137   6.265  -2.615
  290   1HG   ARG  38          2HG       ARG  38   2.357   5.791  -0.367
  291   2HG   ARG  38          1HG       ARG  38   3.326   4.472  -1.024
  292   1HD   ARG  38          2HD       ARG  38   5.357   5.507  -0.463
  293   2HD   ARG  38          1HD       ARG  38   4.624   7.123  -0.403
  294    HE   ARG  38           HE       ARG  38   3.722   5.072   1.560
  295   1HH1  ARG  38          1HH1      ARG  38   3.617   8.292   1.088
  296   2HH1  ARG  38          2HH1      ARG  38   4.385   8.762   2.568
  297   1HH2  ARG  38          1HH2      ARG  38   5.442   5.552   3.348
  298   2HH2  ARG  38          2HH2      ARG  38   5.416   7.211   3.849
  299    H    ASP  39           H        ASP  39   5.858   6.869  -3.967
  300    HA   ASP  39           HA       ASP  39   8.055   5.096  -3.240
  301   1HB   ASP  39          2HB       ASP  39   7.811   7.024  -5.014
  302   2HB   ASP  39          1HB       ASP  39   8.277   8.066  -3.669
  303    H    SER  40           H        SER  40   9.705   5.689  -1.604
  304    HA   SER  40           HA       SER  40   8.458   6.948   0.811
  305   1HB   SER  40          2HB       SER  40   9.156   4.544   0.859
  306   2HB   SER  40          1HB       SER  40  10.811   5.049   0.526
  307    HG   SER  40           HG       SER  40   9.301   5.238   2.841
  308    H    SER  41           H        SER  41  11.077   7.161   2.128
  309    HA   SER  41           HA       SER  41  12.550   9.142   0.464
  310   1HB   SER  41          2HB       SER  41  10.932   9.636   2.944
  311   2HB   SER  41          1HB       SER  41  12.364  10.617   2.649
  312    HG   SER  41           HG       SER  41  11.277  11.648   1.185
  313    H    LYS  42           H        LYS  42  12.368   8.004   3.867
  314    HA   LYS  42           HA       LYS  42  15.101   8.240   4.515
  315   1HB   LYS  42          2HB       LYS  42  13.034   6.186   5.370
  316   2HB   LYS  42          1HB       LYS  42  14.532   6.526   6.238
  317   1HG   LYS  42          2HG       LYS  42  13.764   8.518   7.060
  318   2HG   LYS  42          1HG       LYS  42  12.844   8.883   5.600
  319   1HD   LYS  42          2HD       LYS  42  11.046   8.383   6.913
  320   2HD   LYS  42          1HD       LYS  42  11.472   6.718   6.520
  321   1HE   LYS  42          2HE       LYS  42  12.203   6.281   8.641
  322   2HE   LYS  42          1HE       LYS  42  12.975   7.872   8.798
  323   1HZ   LYS  42          1HZ       LYS  42  10.767   8.870   8.978
  324   2HZ   LYS  42          2HZ       LYS  42  11.033   7.745  10.223
  325   3HZ   LYS  42          3HZ       LYS  42  10.053   7.335   8.897
  326    H    ALA  43           H        ALA  43  13.547   5.097   3.778
  327    HA   ALA  43           HA       ALA  43  16.143   3.959   2.955
  328   1HB   ALA  43          1HB       ALA  43  13.947   2.233   2.407
  329   2HB   ALA  43          2HB       ALA  43  13.562   3.083   3.902
  330   3HB   ALA  43          3HB       ALA  43  15.054   2.151   3.777
  331    H    GLY  44           H        GLY  44  13.437   5.492   1.461
  332   1HA   GLY  44          2HA       GLY  44  13.049   5.970  -0.817
  333   2HA   GLY  44          1HA       GLY  44  14.593   5.185  -1.193
  334    H    LYS  45           H        LYS  45  12.178   3.597   0.754
  335    HA   LYS  45           HA       LYS  45  12.019   1.406  -1.201
  336   1HB   LYS  45          2HB       LYS  45  10.959   0.245   0.668
  337   2HB   LYS  45          1HB       LYS  45  12.397   1.087   1.243
  338   1HG   LYS  45          2HG       LYS  45  10.489   3.025   1.559
  339   2HG   LYS  45          1HG       LYS  45   9.551   1.567   1.878
  340   1HD   LYS  45          2HD       LYS  45  10.641   1.145   3.826
  341   2HD   LYS  45          1HD       LYS  45  12.208   1.597   3.156
  342   1HE   LYS  45          2HE       LYS  45  11.746   3.954   3.480
  343   2HE   LYS  45          1HE       LYS  45  10.068   3.606   3.942
  344   1HZ   LYS  45          1HZ       LYS  45  12.382   2.400   5.346
  345   2HZ   LYS  45          2HZ       LYS  45  10.762   2.459   5.855
  346   3HZ   LYS  45          3HZ       LYS  45  11.702   3.874   5.836
  347    H    TYR  46           H        TYR  46   9.553   0.408  -1.103
  348    HA   TYR  46           HA       TYR  46   7.762   2.667  -1.945
  349   1HB   TYR  46          2HB       TYR  46   7.661  -0.252  -2.765
  350   2HB   TYR  46          1HB       TYR  46   6.797   1.086  -3.509
  351    HD1  TYR  46           1HD      TYR  46   8.677  -0.899  -4.913
  352    HD2  TYR  46           2HD      TYR  46   9.335   2.990  -3.221
  353    HE1  TYR  46           1HE      TYR  46  10.579  -0.544  -6.461
  354    HE2  TYR  46           2HE      TYR  46  11.235   3.347  -4.769
  355    HH   TYR  46           HH       TYR  46  12.741   0.938  -6.407
  356    H    THR  47           H        THR  47   5.440   2.337  -1.476
  357    HA   THR  47           HA       THR  47   4.921   0.471   0.812
  358    HB   THR  47           HB       THR  47   4.102   3.372   0.441
  359    HG1  THR  47           1HG      THR  47   5.503   3.752   2.030
  360   1HG2  THR  47          1HG2      THR  47   2.957   1.210   2.076
  361   2HG2  THR  47          2HG2      THR  47   2.272   2.777   1.646
  362   3HG2  THR  47          3HG2      THR  47   3.388   2.647   3.005
  363    H    VAL  48           H        VAL  48   3.125  -0.799   0.465
  364    HA   VAL  48           HA       VAL  48   1.434  -0.157  -1.917
  365    HB   VAL  48           HB       VAL  48   1.808  -2.657  -0.240
  366   1HG1  VAL  48          1HG1      VAL  48   0.656  -3.749  -2.204
  367   2HG1  VAL  48          2HG1      VAL  48   0.244  -2.134  -2.780
  368   3HG1  VAL  48          3HG1      VAL  48  -0.388  -2.708  -1.236
  369   1HG2  VAL  48          1HG2      VAL  48   3.100  -1.546  -2.687
  370   2HG2  VAL  48          2HG2      VAL  48   2.780  -3.280  -2.665
  371   3HG2  VAL  48          3HG2      VAL  48   3.788  -2.554  -1.414
  372    H    SER  49           H        SER  49  -0.364   1.023  -1.372
  373    HA   SER  49           HA       SER  49  -1.663   0.625   1.274
  374   1HB   SER  49          2HB       SER  49  -1.583   2.678  -0.893
  375   2HB   SER  49          1HB       SER  49  -3.036   2.609   0.099
  376    HG   SER  49           HG       SER  49  -0.996   3.900   0.753
  377    H    VAL  50           H        VAL  50  -3.147  -1.076   1.249
  378    HA   VAL  50           HA       VAL  50  -5.008  -1.172  -1.106
  379    HB   VAL  50           HB       VAL  50  -5.032  -3.640  -0.729
  380   1HG1  VAL  50          1HG1      VAL  50  -3.498  -3.311  -2.381
  381   2HG1  VAL  50          2HG1      VAL  50  -2.340  -3.767  -1.132
  382   3HG1  VAL  50          3HG1      VAL  50  -2.641  -2.063  -1.476
  383   1HG2  VAL  50          1HG2      VAL  50  -4.352  -3.333   1.746
  384   2HG2  VAL  50          2HG2      VAL  50  -2.702  -3.199   1.144
  385   3HG2  VAL  50          3HG2      VAL  50  -3.624  -4.677   0.870
  386    H    PHE  51           H        PHE  51  -7.238  -1.343  -0.588
  387    HA   PHE  51           HA       PHE  51  -7.905  -1.752   2.308
  388   1HB   PHE  51          2HB       PHE  51  -8.465   0.430   2.455
  389   2HB   PHE  51          1HB       PHE  51  -7.999   0.667   0.776
  390    HD1  PHE  51           1HD      PHE  51 -10.751   0.476   3.102
  391    HD2  PHE  51           2HD      PHE  51  -9.707   0.111  -1.049
  392    HE1  PHE  51           1HE      PHE  51 -13.132   0.740   2.480
  393    HE2  PHE  51           2HE      PHE  51 -12.088   0.387  -1.667
  394    HZ   PHE  51           HZ       PHE  51 -13.802   0.696   0.096
  395    H    ALA  52           H        ALA  52 -10.336  -2.098   2.581
  396    HA   ALA  52           HA       ALA  52 -11.875  -2.938   0.251
  397   1HB   ALA  52          1HB       ALA  52 -10.195  -4.806   0.782
  398   2HB   ALA  52          2HB       ALA  52 -11.891  -5.280   0.675
  399   3HB   ALA  52          3HB       ALA  52 -11.132  -5.072   2.253
  400    H    LYS  53           H        LYS  53 -14.046  -3.829   0.962
  401    HA   LYS  53           HA       LYS  53 -14.802  -2.762   3.669
  402   1HB   LYS  53          2HB       LYS  53 -15.978  -2.578   0.910
  403   2HB   LYS  53          1HB       LYS  53 -17.044  -2.471   2.310
  404   1HG   LYS  53          2HG       LYS  53 -15.465  -0.691   3.219
  405   2HG   LYS  53          1HG       LYS  53 -14.699  -0.686   1.633
  406   1HD   LYS  53          2HD       LYS  53 -16.331   1.065   1.601
  407   2HD   LYS  53          1HD       LYS  53 -17.003  -0.261   0.653
  408   1HE   LYS  53          2HE       LYS  53 -18.246  -1.017   2.716
  409   2HE   LYS  53          1HE       LYS  53 -17.698   0.470   3.516
  410   1HZ   LYS  53          1HZ       LYS  53 -19.860   0.762   2.417
  411   2HZ   LYS  53          2HZ       LYS  53 -19.152   0.362   0.925
  412   3HZ   LYS  53          3HZ       LYS  53 -18.670   1.768   1.748
  413    H    SER  54           H        SER  54 -14.070  -5.424   3.656
  414    HA   SER  54           HA       SER  54 -16.550  -6.788   4.327
  415   1HB   SER  54          2HB       SER  54 -15.872  -6.710   1.635
  416   2HB   SER  54          1HB       SER  54 -15.273  -8.284   2.151
  417    HG   SER  54           HG       SER  54 -17.859  -7.308   1.975
  418    H    THR  55           H        THR  55 -14.872  -6.780   6.194
  419    HA   THR  55           HA       THR  55 -13.881  -9.411   6.644
  420    HB   THR  55           HB       THR  55 -12.231  -8.997   4.941
  421    HG1  THR  55           1HG      THR  55 -11.102  -9.900   6.503
  422   1HG2  THR  55          1HG2      THR  55 -10.805  -6.985   4.946
  423   2HG2  THR  55          2HG2      THR  55 -11.682  -6.371   6.346
  424   3HG2  THR  55          3HG2      THR  55 -12.509  -6.557   4.801
  425    H    GLY  56           H        GLY  56 -11.402  -7.504   7.850
  426   1HA   GLY  56          2HA       GLY  56 -12.255  -7.539  10.531
  427   2HA   GLY  56          1HA       GLY  56 -11.082  -6.376   9.897
  428    H    ASP  57           H        ASP  57 -12.857  -5.219   7.964
  429    HA   ASP  57           HA       ASP  57 -14.936  -3.904   9.661
  430   1HB   ASP  57          2HB       ASP  57 -12.562  -2.783   9.035
  431   2HB   ASP  57          1HB       ASP  57 -13.472  -2.376   7.583
  432    HA   PRO  58           HA       PRO  58 -16.958  -5.666   5.944
  433   1HB   PRO  58          2HB       PRO  58 -19.414  -4.692   7.084
  434   2HB   PRO  58          1HB       PRO  58 -18.857  -6.361   6.938
  435   1HG   PRO  58          2HG       PRO  58 -19.010  -4.739   9.308
  436   2HG   PRO  58          1HG       PRO  58 -18.505  -6.426   9.171
  437   1HD   PRO  58          2HD       PRO  58 -16.850  -4.172   9.745
  438   2HD   PRO  58          1HD       PRO  58 -16.321  -5.848   9.451
  439    H    GLN  59           H        GLN  59 -17.019  -2.449   7.261
  440    HA   GLN  59           HA       GLN  59 -18.047  -1.436   4.631
  441   1HB   GLN  59          2HB       GLN  59 -18.926   0.470   6.049
  442   2HB   GLN  59          1HB       GLN  59 -19.665  -1.098   6.381
  443   1HG   GLN  59          2HG       GLN  59 -18.381  -1.406   8.356
  444   2HG   GLN  59          1HG       GLN  59 -17.271  -0.103   7.929
  445   1HE2  GLN  59          1HE2      GLN  59 -20.750  -0.643   8.710
  446   2HE2  GLN  59          2HE2      GLN  59 -20.975   0.873   9.438
  447    H    GLY  60           H        GLY  60 -15.135  -1.804   5.431
  448   1HA   GLY  60          2HA       GLY  60 -13.888   0.242   4.231
  449   2HA   GLY  60          1HA       GLY  60 -14.271   0.978   5.778
  450    H    VAL  61           H        VAL  61 -12.083  -1.065   4.104
  451    HA   VAL  61           HA       VAL  61 -10.537  -1.443   6.641
  452    HB   VAL  61           HB       VAL  61 -10.879  -3.434   4.372
  453   1HG1  VAL  61          1HG1      VAL  61  -9.248  -4.680   5.331
  454   2HG1  VAL  61          2HG1      VAL  61  -9.820  -4.337   6.964
  455   3HG1  VAL  61          3HG1      VAL  61  -8.776  -3.183   6.134
  456   1HG2  VAL  61          1HG2      VAL  61 -12.869  -3.002   5.937
  457   2HG2  VAL  61          2HG2      VAL  61 -11.874  -3.723   7.202
  458   3HG2  VAL  61          3HG2      VAL  61 -12.322  -4.666   5.782
  459    H    ILE  62           H        ILE  62  -8.415  -0.995   6.453
  460    HA   ILE  62           HA       ILE  62  -7.212  -0.685   3.746
  461    HB   ILE  62           HB       ILE  62  -6.642   1.471   5.692
  462   1HG1  ILE  62          2HG1      ILE  62  -9.397   1.081   4.477
  463   2HG1  ILE  62          1HG1      ILE  62  -9.011   1.133   6.187
  464   1HG2  ILE  62          1HG2      ILE  62  -6.559   0.982   2.878
  465   2HG2  ILE  62          2HG2      ILE  62  -6.003   2.410   3.746
  466   3HG2  ILE  62          3HG2      ILE  62  -7.661   2.331   3.152
  467   1HD1  ILE  62          1HD1      ILE  62  -9.622   3.303   4.448
  468   2HD1  ILE  62          2HD1      ILE  62  -7.967   3.494   5.028
  469   3HD1  ILE  62          3HD1      ILE  62  -9.293   3.337   6.180
  470    H    ARG  63           H        ARG  63  -4.867  -0.545   3.803
  471    HA   ARG  63           HA       ARG  63  -3.326  -0.845   6.233
  472   1HB   ARG  63          2HB       ARG  63  -4.718  -3.104   5.420
  473   2HB   ARG  63          1HB       ARG  63  -3.122  -3.357   4.716
  474   1HG   ARG  63          2HG       ARG  63  -2.216  -3.806   6.733
  475   2HG   ARG  63          1HG       ARG  63  -2.918  -2.352   7.439
  476   1HD   ARG  63          2HD       ARG  63  -3.884  -4.206   8.635
  477   2HD   ARG  63          1HD       ARG  63  -5.142  -3.652   7.512
  478    HE   ARG  63           HE       ARG  63  -3.298  -5.920   6.851
  479   1HH1  ARG  63          1HH2      ARG  63  -5.819  -6.830   8.023
  480   2HH1  ARG  63          2HH2      ARG  63  -6.866  -6.991   6.653
  481   1HH2  ARG  63          1HH1      ARG  63  -4.880  -5.052   4.573
  482   2HH2  ARG  63          2HH1      ARG  63  -6.334  -5.986   4.699
  483    H    HIS  64           H        HIS  64  -1.409   0.096   5.600
  484    HA   HIS  64           HA       HIS  64  -0.660  -0.017   2.722
  485   1HB   HIS  64          2HB       HIS  64   0.724   1.596   4.854
  486   2HB   HIS  64          1HB       HIS  64   0.545   1.960   3.140
  487    HD1  HIS  64           1HD      HIS  64  -2.286   2.017   2.527
  488    HD2  HIS  64           2HD      HIS  64  -0.961   3.236   6.286
  489    HE1  HIS  64           1HE      HIS  64  -4.122   3.460   3.499
  490    H    TYR  65           H        TYR  65   0.509  -1.872   2.345
  491    HA   TYR  65           HA       TYR  65   2.433  -2.940   4.294
  492   1HB   TYR  65          2HB       TYR  65   2.129  -3.586   1.360
  493   2HB   TYR  65          1HB       TYR  65   2.730  -4.635   2.637
  494    HD1  TYR  65           1HD      TYR  65   0.284  -4.900   0.568
  495    HD2  TYR  65           2HD      TYR  65   0.630  -3.962   4.746
  496    HE1  TYR  65           1HE      TYR  65  -2.004  -5.764   0.953
  497    HE2  TYR  65           2HE      TYR  65  -1.659  -4.825   5.129
  498    HH   TYR  65           HH       TYR  65  -3.873  -5.237   2.844
  499    H    VAL  66           H        VAL  66   4.456  -2.067   4.459
  500    HA   VAL  66           HA       VAL  66   5.536  -0.599   2.085
  501    HB   VAL  66           HB       VAL  66   6.294  -0.368   5.014
  502   1HG1  VAL  66          1HG1      VAL  66   6.977   1.178   2.506
  503   2HG1  VAL  66          2HG1      VAL  66   8.081   0.436   3.664
  504   3HG1  VAL  66          3HG1      VAL  66   7.172   1.880   4.112
  505   1HG2  VAL  66          1HG2      VAL  66   4.952   1.953   3.988
  506   2HG2  VAL  66          2HG2      VAL  66   4.449   0.900   5.311
  507   3HG2  VAL  66          3HG2      VAL  66   3.943   0.545   3.660
  508    H    VAL  67           H        VAL  67   7.977  -0.706   1.923
  509    HA   VAL  67           HA       VAL  67   8.922  -3.440   2.711
  510    HB   VAL  67           HB       VAL  67   9.535  -1.714   0.294
  511   1HG1  VAL  67          1HG1      VAL  67  11.470  -2.914   0.373
  512   2HG1  VAL  67          2HG1      VAL  67  10.465  -4.207  -0.282
  513   3HG1  VAL  67          3HG1      VAL  67  10.793  -4.134   1.450
  514   1HG2  VAL  67          1HG2      VAL  67   8.328  -4.422   0.072
  515   2HG2  VAL  67          2HG2      VAL  67   8.000  -2.964  -0.865
  516   3HG2  VAL  67          3HG2      VAL  67   7.284  -3.164   0.735
  517    H    CYS  68           H        CYS  68  10.695  -3.457   4.002
  518    HA   CYS  68           HA       CYS  68  12.117  -0.932   4.568
  519   1HB   CYS  68          2HB       CYS  68  11.321  -2.555   6.322
  520   2HB   CYS  68          1HB       CYS  68  12.454  -3.741   5.675
  521    HG   CYS  68           HG       CYS  68  14.427  -2.314   6.488
  522    H    SER  69           H        SER  69  14.560  -0.954   4.469
  523    HA   SER  69           HA       SER  69  15.610  -2.926   2.476
  524   1HB   SER  69          2HB       SER  69  16.830  -0.677   1.666
  525   2HB   SER  69          1HB       SER  69  15.252  -1.162   1.047
  526    HG   SER  69           HG       SER  69  14.286   0.271   2.386
  527    H    THR  70           H        THR  70  17.554  -3.731   3.056
  528    HA   THR  70           HA       THR  70  19.038  -2.460   5.311
  529    HB   THR  70           HB       THR  70  18.288  -4.848   5.419
  530    HG1  THR  70           1HG      THR  70  20.251  -5.616   6.115
  531   1HG2  THR  70          1HG2      THR  70  20.346  -5.746   3.514
  532   2HG2  THR  70          2HG2      THR  70  18.966  -4.942   2.771
  533   3HG2  THR  70          3HG2      THR  70  18.718  -6.360   3.789
  534    HA   PRO  71           HA       PRO  71  22.190  -1.015   2.623
  535   1HB   PRO  71          2HB       PRO  71  24.388  -1.856   4.277
  536   2HB   PRO  71          1HB       PRO  71  23.668  -0.248   4.151
  537   1HG   PRO  71          2HG       PRO  71  23.483  -2.056   6.347
  538   2HG   PRO  71          1HG       PRO  71  22.676  -0.495   6.170
  539   1HD   PRO  71          2HD       PRO  71  21.518  -3.159   6.009
  540   2HD   PRO  71          1HD       PRO  71  20.682  -1.587   5.989
  541    H    GLN  72           H        GLN  72  21.765  -4.295   3.021
  542    HA   GLN  72           HA       GLN  72  24.196  -5.048   1.483
  543   1HB   GLN  72          2HB       GLN  72  23.505  -6.386   3.425
  544   2HB   GLN  72          1HB       GLN  72  21.907  -6.614   2.726
  545   1HG   GLN  72          2HG       GLN  72  23.413  -8.585   2.398
  546   2HG   GLN  72          1HG       GLN  72  22.843  -7.900   0.881
  547   1HE2  GLN  72          1HE2      GLN  72  24.775  -8.746  -0.241
  548   2HE2  GLN  72          2HE2      GLN  72  26.286  -8.003  -0.038
  549    H    SER  73           H        SER  73  21.824  -3.403   0.439
  550    HA   SER  73           HA       SER  73  20.639  -3.238  -1.597
  551   1HB   SER  73          2HB       SER  73  23.007  -4.619  -2.065
  552   2HB   SER  73          1HB       SER  73  21.787  -5.689  -2.747
  553    HG   SER  73           HG       SER  73  22.666  -3.236  -3.591
  554    H    GLN  74           H        GLN  74  19.350  -4.505   0.524
  555    HA   GLN  74           HA       GLN  74  17.777  -6.627  -0.885
  556   1HB   GLN  74          2HB       GLN  74  18.169  -6.841   2.047
  557   2HB   GLN  74          1HB       GLN  74  18.159  -8.110   0.829
  558   1HG   GLN  74          2HG       GLN  74  20.412  -7.094   0.054
  559   2HG   GLN  74          1HG       GLN  74  20.424  -6.281   1.617
  560   1HE2  GLN  74          1HE2      GLN  74  20.360  -7.730   3.581
  561   2HE2  GLN  74          2HE2      GLN  74  20.952  -9.316   3.462
  562    H    TYR  75           H        TYR  75  15.595  -6.947   0.225
  563    HA   TYR  75           HA       TYR  75  14.634  -4.547   1.726
  564   1HB   TYR  75          2HB       TYR  75  13.329  -5.585  -0.798
  565   2HB   TYR  75          1HB       TYR  75  12.906  -4.130   0.089
  566    HD1  TYR  75           1HD      TYR  75  15.564  -5.725  -1.948
  567    HD2  TYR  75           2HD      TYR  75  14.063  -2.081  -0.255
  568    HE1  TYR  75           1HE      TYR  75  17.205  -4.442  -3.275
  569    HE2  TYR  75           2HE      TYR  75  15.702  -0.791  -1.585
  570    HH   TYR  75           HH       TYR  75  18.325  -2.260  -3.205
  571    H    TYR  76           H        TYR  76  12.493  -4.888   2.700
  572    HA   TYR  76           HA       TYR  76  10.986  -7.327   2.497
  573   1HB   TYR  76          2HB       TYR  76  11.714  -8.362   4.658
  574   2HB   TYR  76          1HB       TYR  76  13.028  -8.296   3.493
  575    HD1  TYR  76           1HD      TYR  76  11.579  -6.649   6.478
  576    HD2  TYR  76           2HD      TYR  76  14.999  -6.971   3.912
  577    HE1  TYR  76           1HE      TYR  76  12.914  -5.362   8.112
  578    HE2  TYR  76           2HE      TYR  76  16.340  -5.680   5.543
  579    HH   TYR  76           HH       TYR  76  14.955  -4.617   8.646
  580    H    LEU  77           H        LEU  77   9.293  -7.454   4.189
  581    HA   LEU  77           HA       LEU  77   8.686  -4.781   5.404
  582   1HB   LEU  77          2HB       LEU  77   7.144  -6.360   3.867
  583   2HB   LEU  77          1HB       LEU  77   6.825  -7.149   5.412
  584    HG   LEU  77           HG       LEU  77   6.677  -4.181   5.406
  585   1HD1  LEU  77          1HD1      LEU  77   4.374  -5.793   4.294
  586   2HD1  LEU  77          2HD1      LEU  77   5.562  -5.027   3.239
  587   3HD1  LEU  77          3HD1      LEU  77   4.570  -4.041   4.313
  588   1HD2  LEU  77          1HD2      LEU  77   4.604  -6.093   6.437
  589   2HD2  LEU  77          2HD2      LEU  77   5.121  -4.546   7.105
  590   3HD2  LEU  77          3HD2      LEU  77   6.150  -5.968   7.277
  591    H    ALA  78           H        ALA  78  10.010  -7.768   5.981
  592    HA   ALA  78           HA       ALA  78  10.171  -7.402   8.882
  593   1HB   ALA  78          1HB       ALA  78   9.366  -9.828   9.154
  594   2HB   ALA  78          2HB       ALA  78   8.785  -9.725   7.492
  595   3HB   ALA  78          3HB       ALA  78   8.109  -8.666   8.730
  596    H    GLU  79           H        GLU  79  12.353  -7.774   9.206
  597    HA   GLU  79           HA       GLU  79  14.215  -8.556   7.301
  598   1HB   GLU  79          2HB       GLU  79  14.046  -8.569  10.280
  599   2HB   GLU  79          1HB       GLU  79  15.420  -9.402   9.553
  600   1HG   GLU  79          2HG       GLU  79  15.790  -7.306   8.156
  601   2HG   GLU  79          1HG       GLU  79  14.618  -6.508   9.206
  602    H    LYS  80           H        LYS  80  12.000 -10.614   8.969
  603    HA   LYS  80           HA       LYS  80  13.157 -13.130   9.106
  604   1HB   LYS  80          2HB       LYS  80  10.506 -11.979   8.506
  605   2HB   LYS  80          1HB       LYS  80  10.710 -13.647   7.974
  606   1HG   LYS  80          2HG       LYS  80  10.673 -14.433  10.096
  607   2HG   LYS  80          1HG       LYS  80  11.802 -13.197  10.651
  608   1HD   LYS  80          2HD       LYS  80   9.872 -12.627  11.831
  609   2HD   LYS  80          1HD       LYS  80   9.734 -11.595  10.408
  610   1HE   LYS  80          2HE       LYS  80   8.426 -13.612   9.367
  611   2HE   LYS  80          1HE       LYS  80   8.221 -14.119  11.056
  612   1HZ   LYS  80          1HZ       LYS  80   7.664 -11.369  10.087
  613   2HZ   LYS  80          2HZ       LYS  80   7.297 -12.017  11.614
  614   3HZ   LYS  80          3HZ       LYS  80   6.469 -12.563  10.235
  615    H    HIS  81           H        HIS  81  12.069 -11.446   6.165
  616    HA   HIS  81           HA       HIS  81  13.790 -13.216   4.519
  617   1HB   HIS  81          2HB       HIS  81  10.782 -12.932   4.207
  618   2HB   HIS  81          1HB       HIS  81  11.833 -13.720   3.030
  619    HD1  HIS  81           1HD      HIS  81   9.933 -14.370   6.074
  620    HD2  HIS  81           2HD      HIS  81  13.269 -16.050   4.222
  621    HE1  HIS  81           1HE      HIS  81  10.256 -16.656   7.117
  622    H    LEU  82           H        LEU  82  14.581 -12.031   2.734
  623    HA   LEU  82           HA       LEU  82  13.160  -9.542   1.987
  624   1HB   LEU  82          2HB       LEU  82  15.157  -8.205   2.441
  625   2HB   LEU  82          1HB       LEU  82  14.713  -9.090   3.897
  626    HG   LEU  82           HG       LEU  82  16.715 -10.158   1.921
  627   1HD1  LEU  82          1HD1      LEU  82  17.737  -8.978   4.422
  628   2HD1  LEU  82          2HD1      LEU  82  17.075  -7.802   3.288
  629   3HD1  LEU  82          3HD1      LEU  82  18.380  -8.875   2.785
  630   1HD2  LEU  82          1HD2      LEU  82  15.592 -10.978   4.509
  631   2HD2  LEU  82          2HD2      LEU  82  17.356 -10.977   4.499
  632   3HD2  LEU  82          3HD2      LEU  82  16.469 -11.938   3.316
  633    H    PHE  83           H        PHE  83  13.617  -8.856  -0.124
  634    HA   PHE  83           HA       PHE  83  15.364 -10.680  -1.739
  635   1HB   PHE  83          2HB       PHE  83  12.723  -9.309  -2.186
  636   2HB   PHE  83          1HB       PHE  83  13.727  -9.732  -3.577
  637    HD1  PHE  83           1HD      PHE  83  13.481 -11.854  -4.505
  638    HD2  PHE  83           2HD      PHE  83  12.501 -11.247  -0.368
  639    HE1  PHE  83           1HE      PHE  83  12.732 -14.211  -4.338
  640    HE2  PHE  83           2HE      PHE  83  11.752 -13.606  -0.199
  641    HZ   PHE  83           HZ       PHE  83  11.867 -15.088  -2.185
  642    H    SER  84           H        SER  84  15.373  -9.000  -4.064
  643    HA   SER  84           HA       SER  84  17.152  -6.821  -3.061
  644   1HB   SER  84          2HB       SER  84  18.125  -8.469  -4.567
  645   2HB   SER  84          1HB       SER  84  16.832  -8.219  -5.737
  646    HG   SER  84           HG       SER  84  17.983  -6.643  -6.490
  647    H    THR  85           H        THR  85  13.968  -6.965  -3.775
  648    HA   THR  85           HA       THR  85  13.828  -4.140  -4.512
  649    HB   THR  85           HB       THR  85  12.653  -6.055  -6.527
  650    HG1  THR  85           1HG      THR  85  14.515  -6.203  -7.562
  651   1HG2  THR  85          1HG2      THR  85  13.741  -3.598  -7.549
  652   2HG2  THR  85          2HG2      THR  85  12.717  -3.249  -6.157
  653   3HG2  THR  85          3HG2      THR  85  12.063  -4.140  -7.531
  654    H    ILE  86           H        ILE  86  11.544  -3.370  -4.553
  655    HA   ILE  86           HA       ILE  86   9.881  -4.678  -2.607
  656    HB   ILE  86           HB       ILE  86   9.644  -2.406  -4.552
  657   1HG1  ILE  86          2HG1      ILE  86   8.959  -1.526  -2.055
  658   2HG1  ILE  86          1HG1      ILE  86  10.052  -2.852  -1.667
  659   1HG2  ILE  86          1HG2      ILE  86   7.399  -2.853  -4.702
  660   2HG2  ILE  86          2HG2      ILE  86   7.367  -2.111  -3.104
  661   3HG2  ILE  86          3HG2      ILE  86   7.403  -3.866  -3.258
  662   1HD1  ILE  86          1HD1      ILE  86  11.760  -1.447  -2.090
  663   2HD1  ILE  86          2HD1      ILE  86  10.669  -0.232  -2.753
  664   3HD1  ILE  86          3HD1      ILE  86  11.295  -1.514  -3.790
  665    HA   PRO  87           HA       PRO  87   7.041  -5.860  -6.420
  666   1HB   PRO  87          2HB       PRO  87   8.845  -6.202  -8.639
  667   2HB   PRO  87          1HB       PRO  87   7.470  -5.101  -8.512
  668   1HG   PRO  87          2HG       PRO  87  10.294  -4.474  -8.389
  669   2HG   PRO  87          1HG       PRO  87   8.919  -3.366  -8.410
  670   1HD   PRO  87          2HD       PRO  87  10.621  -3.897  -6.206
  671   2HD   PRO  87          1HD       PRO  87   9.091  -2.993  -6.167
  672    H    GLU  88           H        GLU  88  10.448  -6.846  -6.251
  673    HA   GLU  88           HA       GLU  88  10.075  -9.615  -6.932
  674   1HB   GLU  88          2HB       GLU  88  12.214  -8.202  -6.773
  675   2HB   GLU  88          1HB       GLU  88  12.118  -8.438  -5.027
  676   1HG   GLU  88          2HG       GLU  88  13.556 -10.165  -5.894
  677   2HG   GLU  88          1HG       GLU  88  12.025 -10.929  -5.465
  678    H    LEU  89           H        LEU  89  10.154  -7.878  -3.811
  679    HA   LEU  89           HA       LEU  89   9.755 -10.117  -2.084
  680   1HB   LEU  89          2HB       LEU  89   9.578  -7.179  -2.046
  681   2HB   LEU  89          1HB       LEU  89   8.481  -7.952  -0.904
  682    HG   LEU  89           HG       LEU  89  11.201  -9.104  -0.973
  683   1HD1  LEU  89          1HD1      LEU  89  11.061  -6.327  -1.051
  684   2HD1  LEU  89          2HD1      LEU  89  12.411  -7.273  -0.428
  685   3HD1  LEU  89          3HD1      LEU  89  11.166  -6.683   0.673
  686   1HD2  LEU  89          1HD2      LEU  89   9.507  -8.054   1.312
  687   2HD2  LEU  89          2HD2      LEU  89  10.846  -9.196   1.417
  688   3HD2  LEU  89          3HD2      LEU  89   9.338  -9.674   0.638
  689    H    ILE  90           H        ILE  90   7.331  -7.788  -3.340
  690    HA   ILE  90           HA       ILE  90   4.991  -8.973  -2.345
  691    HB   ILE  90           HB       ILE  90   5.500  -7.630  -5.022
  692   1HG1  ILE  90          2HG1      ILE  90   6.268  -6.246  -3.162
  693   2HG1  ILE  90          1HG1      ILE  90   4.761  -5.581  -3.786
  694   1HG2  ILE  90          1HG2      ILE  90   3.124  -7.026  -4.937
  695   2HG2  ILE  90          2HG2      ILE  90   2.944  -7.886  -3.409
  696   3HG2  ILE  90          3HG2      ILE  90   3.303  -8.780  -4.887
  697   1HD1  ILE  90          1HD1      ILE  90   3.605  -7.030  -1.979
  698   2HD1  ILE  90          2HD1      ILE  90   4.448  -5.576  -1.445
  699   3HD1  ILE  90          3HD1      ILE  90   5.207  -7.156  -1.253
  700    H    ASN  91           H        ASN  91   6.599  -9.665  -5.477
  701    HA   ASN  91           HA       ASN  91   4.766 -11.716  -6.304
  702   1HB   ASN  91          2HB       ASN  91   6.676 -10.325  -7.505
  703   2HB   ASN  91          1HB       ASN  91   7.672 -11.708  -7.052
  704   1HD2  ASN  91          1HD2      ASN  91   7.782 -13.164  -8.761
  705   2HD2  ASN  91          2HD2      ASN  91   6.495 -13.553  -9.798
  706    H    TYR  92           H        TYR  92   7.829 -11.818  -4.496
  707    HA   TYR  92           HA       TYR  92   8.122 -14.657  -4.375
  708   1HB   TYR  92          2HB       TYR  92  10.039 -13.781  -3.549
  709   2HB   TYR  92          1HB       TYR  92   9.257 -12.236  -3.236
  710    HD1  TYR  92           1HD      TYR  92   9.594 -15.693  -1.839
  711    HD2  TYR  92           2HD      TYR  92   8.855 -11.541  -1.035
  712    HE1  TYR  92           1HE      TYR  92   9.649 -16.154   0.596
  713    HE2  TYR  92           2HE      TYR  92   8.907 -12.000   1.398
  714    HH   TYR  92           HH       TYR  92  10.026 -14.980   2.681
  715    H    HIS  93           H        HIS  93   5.859 -12.559  -2.798
  716    HA   HIS  93           HA       HIS  93   5.184 -14.711  -0.822
  717   1HB   HIS  93          2HB       HIS  93   5.900 -12.387  -0.068
  718   2HB   HIS  93          1HB       HIS  93   4.412 -11.780  -0.798
  719    HD1  HIS  93           1HD      HIS  93   2.177 -12.368   0.361
  720    HD2  HIS  93           2HD      HIS  93   5.513 -13.963   2.288
  721    HE1  HIS  93           1HE      HIS  93   1.371 -13.212   2.609
  722    H    GLN  94           H        GLN  94   3.779 -12.375  -3.125
  723    HA   GLN  94           HA       GLN  94   1.100 -13.598  -2.858
  724   1HB   GLN  94          2HB       GLN  94   1.957 -11.077  -3.229
  725   2HB   GLN  94          1HB       GLN  94   1.785 -11.551  -4.919
  726   1HG   GLN  94          2HG       GLN  94  -0.461 -11.415  -4.799
  727   2HG   GLN  94          1HG       GLN  94  -0.499 -12.453  -3.374
  728   1HE2  GLN  94          1HE2      GLN  94  -1.762 -11.303  -1.879
  729   2HE2  GLN  94          2HE2      GLN  94  -1.492  -9.687  -1.438
  730    H    HIS  95           H        HIS  95   3.584 -13.176  -5.397
  731    HA   HIS  95           HA       HIS  95   3.993 -14.412  -7.364
  732   1HB   HIS  95          2HB       HIS  95   2.097 -16.428  -6.110
  733   2HB   HIS  95          1HB       HIS  95   3.367 -16.751  -7.285
  734    HD1  HIS  95           1HD      HIS  95   2.784 -16.151  -3.649
  735    HD2  HIS  95           2HD      HIS  95   6.033 -16.685  -6.206
  736    HE1  HIS  95           1HE      HIS  95   4.797 -16.568  -2.172
  737    H    ASN  96           H        ASN  96   1.448 -16.289  -8.058
  738    HA   ASN  96           HA       ASN  96  -0.426 -16.050  -9.475
  739   1HB   ASN  96          2HB       ASN  96  -0.929 -14.672  -7.311
  740   2HB   ASN  96          1HB       ASN  96  -0.656 -13.266  -8.341
  741   1HD2  ASN  96          1HD2      ASN  96  -2.675 -16.220  -8.065
  742   2HD2  ASN  96          2HD2      ASN  96  -3.965 -15.613  -8.985
  743    H    SER  97           H        SER  97   1.682 -15.770 -11.013
  744    HA   SER  97           HA       SER  97   0.987 -13.597 -12.874
  745   1HB   SER  97          2HB       SER  97   2.557 -12.729 -11.016
  746   2HB   SER  97          1HB       SER  97   3.794 -13.741 -11.756
  747    HG   SER  97           HG       SER  97   3.518 -11.437 -12.481
  748    H    ALA  98           H        ALA  98   1.529 -14.204 -14.970
  749    HA   ALA  98           HA       ALA  98   3.678 -16.094 -15.554
  750   1HB   ALA  98          1HB       ALA  98   1.018 -17.168 -16.318
  751   2HB   ALA  98          2HB       ALA  98   1.389 -17.204 -14.594
  752   3HB   ALA  98          3HB       ALA  98   2.449 -18.023 -15.742
  753    H    GLY  99           H        GLY  99   0.597 -14.704 -16.721
  754   1HA   GLY  99          2HA       GLY  99   1.872 -14.378 -19.406
  755   2HA   GLY  99          1HA       GLY  99   0.133 -14.518 -19.152
  756    H    LEU 100           H        LEU 100  -0.864 -12.595 -19.432
  757    HA   LEU 100           HA       LEU 100   0.446 -10.061 -19.520
  758   1HB   LEU 100          2HB       LEU 100  -2.254 -11.199 -19.634
  759   2HB   LEU 100          1HB       LEU 100  -2.233  -9.588 -18.919
  760    HG   LEU 100           HG       LEU 100  -2.514  -9.471 -21.371
  761   1HD1  LEU 100          1HD1      LEU 100  -0.946  -7.899 -19.869
  762   2HD1  LEU 100          2HD1      LEU 100  -1.113  -7.659 -21.609
  763   3HD1  LEU 100          3HD1      LEU 100   0.284  -8.521 -20.968
  764   1HD2  LEU 100          1HD2      LEU 100   0.295 -10.502 -21.687
  765   2HD2  LEU 100          2HD2      LEU 100  -0.993 -10.407 -22.887
  766   3HD2  LEU 100          3HD2      LEU 100  -1.051 -11.638 -21.625
  767    H    ILE 101           H        ILE 101   0.465  -8.341 -17.972
  768    HA   ILE 101           HA       ILE 101   0.706  -9.165 -15.193
  769    HB   ILE 101           HB       ILE 101   2.105  -7.443 -16.274
  770   1HG1  ILE 101          2HG1      ILE 101   1.346  -5.506 -14.550
  771   2HG1  ILE 101          1HG1      ILE 101   0.431  -6.857 -13.882
  772   1HG2  ILE 101          1HG2      ILE 101   1.082  -6.045 -17.719
  773   2HG2  ILE 101          2HG2      ILE 101   0.466  -5.172 -16.316
  774   3HG2  ILE 101          3HG2      ILE 101  -0.510  -6.434 -17.067
  775   1HD1  ILE 101          1HD1      ILE 101   2.430  -7.163 -12.764
  776   2HD1  ILE 101          2HD1      ILE 101   3.389  -6.485 -14.079
  777   3HD1  ILE 101          3HD1      ILE 101   2.752  -8.124 -14.207
  778    H    SER 102           H        SER 102  -1.718  -9.981 -15.348
  779    HA   SER 102           HA       SER 102  -3.672  -7.784 -14.893
  780   1HB   SER 102          2HB       SER 102  -3.669 -10.609 -15.754
  781   2HB   SER 102          1HB       SER 102  -5.023 -10.167 -14.717
  782    HG   SER 102           HG       SER 102  -5.687  -8.719 -16.184
  783    H    ARG 103           H        ARG 103  -1.534  -8.562 -12.900
  784    HA   ARG 103           HA       ARG 103  -2.902  -9.951 -10.722
  785   1HB   ARG 103          2HB       ARG 103  -0.323  -9.525 -11.458
  786   2HB   ARG 103          1HB       ARG 103  -0.503  -8.263 -10.238
  787   1HG   ARG 103          2HG       ARG 103  -1.556 -10.134  -8.775
  788   2HG   ARG 103          1HG       ARG 103  -0.802 -11.245  -9.918
  789   1HD   ARG 103          2HD       ARG 103   0.743 -10.881  -8.058
  790   2HD   ARG 103          1HD       ARG 103   1.398 -10.061  -9.490
  791    HE   ARG 103           HE       ARG 103   0.560  -7.938  -8.589
  792   1HH1  ARG 103          1HH2      ARG 103  -1.419  -9.733  -6.837
  793   2HH1  ARG 103          2HH2      ARG 103  -0.882  -9.249  -5.264
  794   1HH2  ARG 103          1HH1      ARG 103   2.002  -7.717  -6.429
  795   2HH2  ARG 103          2HH1      ARG 103   1.055  -8.107  -5.033
  796    H    LEU 104           H        LEU 104  -1.832  -8.073  -8.660
  797    HA   LEU 104           HA       LEU 104  -2.624  -6.258  -7.374
  798   1HB   LEU 104          2HB       LEU 104  -1.840  -5.270  -9.679
  799   2HB   LEU 104          1HB       LEU 104  -3.567  -5.047  -9.966
  800    HG   LEU 104           HG       LEU 104  -2.846  -4.160  -7.295
  801   1HD1  LEU 104          1HD1      LEU 104  -1.645  -2.063  -8.344
  802   2HD1  LEU 104          2HD1      LEU 104  -1.207  -3.200  -9.620
  803   3HD1  LEU 104          3HD1      LEU 104  -0.709  -3.508  -7.957
  804   1HD2  LEU 104          1HD2      LEU 104  -4.901  -3.518  -8.469
  805   2HD2  LEU 104          2HD2      LEU 104  -3.956  -2.762  -9.751
  806   3HD2  LEU 104          3HD2      LEU 104  -3.940  -2.080  -8.125
  807    H    LYS 105           H        LYS 105  -4.750  -4.884  -7.057
  808    HA   LYS 105           HA       LYS 105  -7.070  -6.713  -7.563
  809   1HB   LYS 105          2HB       LYS 105  -6.274  -4.824  -5.351
  810   2HB   LYS 105          1HB       LYS 105  -7.937  -5.391  -5.507
  811   1HG   LYS 105          2HG       LYS 105  -6.684  -7.754  -5.732
  812   2HG   LYS 105          1HG       LYS 105  -5.480  -6.905  -4.762
  813   1HD   LYS 105          2HD       LYS 105  -7.000  -6.522  -2.994
  814   2HD   LYS 105          1HD       LYS 105  -8.401  -6.855  -4.013
  815   1HE   LYS 105          2HE       LYS 105  -6.432  -9.074  -3.739
  816   2HE   LYS 105          1HE       LYS 105  -7.410  -8.697  -2.306
  817   1HZ   LYS 105          1HZ       LYS 105  -9.396  -8.775  -3.656
  818   2HZ   LYS 105          2HZ       LYS 105  -8.553 -10.242  -3.809
  819   3HZ   LYS 105          3HZ       LYS 105  -8.482  -9.087  -5.051
  820    H    TYR 106           H        TYR 106  -7.036  -3.276  -6.564
  821    HA   TYR 106           HA       TYR 106  -8.534  -2.645  -9.091
  822   1HB   TYR 106          2HB       TYR 106 -10.027  -2.857  -7.144
  823   2HB   TYR 106          1HB       TYR 106  -9.044  -1.693  -6.259
  824    HD1  TYR 106           1HD      TYR 106  -8.893   0.665  -7.024
  825    HD2  TYR 106           2HD      TYR 106 -11.606  -2.135  -8.817
  826    HE1  TYR 106           1HE      TYR 106 -10.150   2.544  -8.045
  827    HE2  TYR 106           2HE      TYR 106 -12.866  -0.260  -9.838
  828    HH   TYR 106           HH       TYR 106 -11.698   2.780 -10.161
  829    HA   PRO 107           HA       PRO 107  -5.016   0.221  -9.147
  830   1HB   PRO 107          2HB       PRO 107  -5.974   1.136 -11.691
  831   2HB   PRO 107          1HB       PRO 107  -4.585   0.098 -11.357
  832   1HG   PRO 107          2HG       PRO 107  -7.070  -0.650 -12.560
  833   2HG   PRO 107          1HG       PRO 107  -5.702  -1.696 -12.170
  834   1HD   PRO 107          2HD       PRO 107  -8.279  -1.546 -10.846
  835   2HD   PRO 107          1HD       PRO 107  -6.930  -2.658 -10.509
  836    H    VAL 108           H        VAL 108  -5.671   1.777  -7.627
  837    HA   VAL 108           HA       VAL 108  -7.528   3.903  -8.630
  838    HB   VAL 108           HB       VAL 108  -8.370   2.384  -6.790
  839   1HG1  VAL 108          1HG1      VAL 108  -7.414   2.725  -4.530
  840   2HG1  VAL 108          2HG1      VAL 108  -6.152   3.732  -5.235
  841   3HG1  VAL 108          3HG1      VAL 108  -6.238   2.019  -5.639
  842   1HG2  VAL 108          1HG2      VAL 108  -9.141   4.759  -7.126
  843   2HG2  VAL 108          2HG2      VAL 108  -7.955   5.255  -5.919
  844   3HG2  VAL 108          3HG2      VAL 108  -9.284   4.190  -5.463
  845    H    SER 109           H        SER 109  -6.789   6.086  -8.184
  846    HA   SER 109           HA       SER 109  -3.902   6.240  -7.459
  847   1HB   SER 109          2HB       SER 109  -5.841   8.127  -8.827
  848   2HB   SER 109          1HB       SER 109  -4.151   8.519  -8.506
  849    HG   SER 109           HG       SER 109  -3.562   6.747  -9.786
  850    H    GLN 110           H        GLN 110  -6.659   8.473  -7.019
  851    HA   GLN 110           HA       GLN 110  -6.505   8.458  -4.147
  852   1HB   GLN 110          2HB       GLN 110  -5.410  10.744  -4.014
  853   2HB   GLN 110          1HB       GLN 110  -4.347   9.463  -4.591
  854   1HG   GLN 110          2HG       GLN 110  -4.601  10.145  -6.870
  855   2HG   GLN 110          1HG       GLN 110  -5.925  11.238  -6.464
  856   1HE2  GLN 110          1HE2      GLN 110  -2.638  10.757  -5.037
  857   2HE2  GLN 110          2HE2      GLN 110  -2.195  12.392  -5.143
  858    H    GLN 111           H        GLN 111  -7.062  11.416  -4.043
  859    HA   GLN 111           HA       GLN 111  -9.836  11.487  -4.075
  860   1HB   GLN 111          2HB       GLN 111  -9.515  13.944  -4.221
  861   2HB   GLN 111          1HB       GLN 111  -8.345  13.191  -3.132
  862   1HG   GLN 111          2HG       GLN 111  -6.678  14.085  -4.347
  863   2HG   GLN 111          1HG       GLN 111  -7.200  13.125  -5.731
  864   1HE2  GLN 111          1HE2      GLN 111  -6.315  16.136  -5.282
  865   2HE2  GLN 111          2HE2      GLN 111  -7.476  16.992  -6.177
  866    H    ASN 112           H        ASN 112 -10.797  10.506  -5.852
  867    HA   ASN 112           HA       ASN 112 -11.467  12.040  -8.139
  868   1HB   ASN 112          2HB       ASN 112  -8.900  10.644  -8.203
  869   2HB   ASN 112          1HB       ASN 112  -9.959  10.100  -9.504
  870   1HD2  ASN 112          1HD2      ASN 112 -11.326  12.364 -10.262
  871   2HD2  ASN 112          2HD2      ASN 112 -10.253  13.581 -10.759
  872    H    LYS 113           H        LYS 113 -10.683   8.727  -7.090
  873    HA   LYS 113           HA       LYS 113 -11.917   6.714  -7.234
  874   1HB   LYS 113          2HB       LYS 113 -14.245   8.646  -7.052
  875   2HB   LYS 113          1HB       LYS 113 -14.160   7.004  -6.416
  876   1HG   LYS 113          2HG       LYS 113 -12.471   9.346  -5.475
  877   2HG   LYS 113          1HG       LYS 113 -13.850   8.666  -4.616
  878   1HD   LYS 113          2HD       LYS 113 -12.505   7.142  -3.669
  879   2HD   LYS 113          1HD       LYS 113 -12.100   6.505  -5.258
  880   1HE   LYS 113          2HE       LYS 113 -10.645   8.954  -4.878
  881   2HE   LYS 113          1HE       LYS 113 -10.388   7.916  -3.465
  882   1HZ   LYS 113          1HZ       LYS 113 -10.220   6.977  -6.277
  883   2HZ   LYS 113          2HZ       LYS 113  -9.842   6.087  -4.880
  884   3HZ   LYS 113          3HZ       LYS 113  -8.874   7.405  -5.341
  885    H    ASN 114           H        ASN 114 -11.306   6.510  -9.603
  886    HA   ASN 114           HA       ASN 114 -13.615   6.043 -11.257
  887   1HB   ASN 114          2HB       ASN 114 -12.577   8.702 -11.138
  888   2HB   ASN 114          1HB       ASN 114 -12.232   8.052 -12.736
  889   1HD2  ASN 114          1HD2      ASN 114 -13.876   8.991 -14.012
  890   2HD2  ASN 114          2HD2      ASN 114 -15.535   8.845 -13.678
  891    H    ALA 115           H        ALA 115 -12.501   6.193 -13.768
  892    HA   ALA 115           HA       ALA 115  -9.780   5.412 -14.064
  893   1HB   ALA 115          1HB       ALA 115 -10.793   2.846 -14.409
  894   2HB   ALA 115          2HB       ALA 115 -11.641   3.423 -12.974
  895   3HB   ALA 115          3HB       ALA 115  -9.878   3.402 -13.007
  896    HA   PRO 116           HA       PRO 116 -10.792   5.463 -18.339
  897   1HB   PRO 116          2HB       PRO 116  -9.623   2.931 -19.053
  898   2HB   PRO 116          1HB       PRO 116  -8.933   4.545 -19.251
  899   1HG   PRO 116          2HG       PRO 116  -8.154   2.513 -17.376
  900   2HG   PRO 116          1HG       PRO 116  -7.464   4.125 -17.583
  901   1HD   PRO 116          2HD       PRO 116  -9.095   3.173 -15.406
  902   2HD   PRO 116          1HD       PRO 116  -8.424   4.808 -15.631
  903    H    SER 117           H        SER 117 -11.654   2.624 -16.489
  904    HA   SER 117           HA       SER 117 -13.225   1.185 -18.373
  905   1HB   SER 117          2HB       SER 117 -12.479   0.569 -16.011
  906   2HB   SER 117          1HB       SER 117 -13.803   1.571 -15.423
  907    HG   SER 117           HG       SER 117 -15.210   0.133 -16.120
  908    H    THR 118           H        THR 118 -15.044   1.842 -19.441
  909    HA   THR 118           HA       THR 118 -17.110   3.425 -18.051
  910    HB   THR 118           HB       THR 118 -15.635   4.459 -20.497
  911    HG1  THR 118           1HG      THR 118 -15.673   5.390 -17.818
  912   1HG2  THR 118          1HG2      THR 118 -18.095   5.282 -19.029
  913   2HG2  THR 118          2HG2      THR 118 -17.708   5.425 -20.743
  914   3HG2  THR 118          3HG2      THR 118 -17.021   6.564 -19.586
  Start of MODEL   12
    1    H    THR   1           1H       THR   1  18.080  -7.071  -9.113
    2    HA   THR   1           HA       THR   1  17.634  -7.236 -12.054
    3    HB   THR   1           HB       THR   1  17.087  -9.298  -9.914
    4    HG1  THR   1           1HG      THR   1  19.116  -9.777  -9.900
    5   1HG2  THR   1          1HG2      THR   1  16.684 -10.738 -11.679
    6   2HG2  THR   1          2HG2      THR   1  17.757  -9.864 -12.773
    7   3HG2  THR   1          3HG2      THR   1  16.159  -9.217 -12.400
    8    H    GLU   2           H        GLU   2  15.417  -7.175 -12.615
    9    HA   GLU   2           HA       GLU   2  13.171  -6.473 -12.392
   10   1HB   GLU   2          2HB       GLU   2  13.777  -8.593 -10.659
   11   2HB   GLU   2          1HB       GLU   2  12.874  -7.454  -9.661
   12   1HG   GLU   2          2HG       GLU   2  11.888  -8.148 -12.417
   13   2HG   GLU   2          1HG       GLU   2  11.555  -9.228 -11.063
   14    H    ALA   3           H        ALA   3  13.520  -4.188 -12.271
   15    HA   ALA   3           HA       ALA   3  13.346  -3.058  -9.497
   16   1HB   ALA   3          1HB       ALA   3  15.246  -2.595 -11.733
   17   2HB   ALA   3          2HB       ALA   3  15.498  -2.435  -9.994
   18   3HB   ALA   3          3HB       ALA   3  14.690  -1.149 -10.891
   19    H    GLU   4           H        GLU   4  12.998  -0.420 -10.136
   20    HA   GLU   4           HA       GLU   4  11.129   0.059 -12.297
   21   1HB   GLU   4          2HB       GLU   4   9.128   0.288 -10.771
   22   2HB   GLU   4          1HB       GLU   4   9.705  -1.369 -10.943
   23   1HG   GLU   4          2HG       GLU   4  10.243  -1.514  -8.752
   24   2HG   GLU   4          1HG       GLU   4  11.051   0.053  -8.769
   25    H    ASP   5           H        ASP   5  10.380   2.297 -12.271
   26    HA   ASP   5           HA       ASP   5  11.071   4.089 -10.081
   27   1HB   ASP   5          2HB       ASP   5  13.048   3.358 -11.996
   28   2HB   ASP   5          1HB       ASP   5  12.617   5.041 -12.292
   29    H    SER   6           H        SER   6  11.004   4.383 -13.650
   30    HA   SER   6           HA       SER   6   8.620   6.184 -13.365
   31   1HB   SER   6          2HB       SER   6  11.011   6.448 -15.216
   32   2HB   SER   6          1HB       SER   6   9.652   7.565 -15.130
   33    HG   SER   6           HG       SER   6  10.276   8.160 -13.105
   34    H    ILE   7           H        ILE   7   7.936   3.665 -13.845
   35    HA   ILE   7           HA       ILE   7   7.426   3.564 -16.795
   36    HB   ILE   7           HB       ILE   7   8.242   1.294 -14.949
   37   1HG1  ILE   7          2HG1      ILE   7  10.103   1.393 -16.931
   38   2HG1  ILE   7          1HG1      ILE   7   9.704   3.106 -16.789
   39   1HG2  ILE   7          1HG2      ILE   7   8.375   0.031 -17.143
   40   2HG2  ILE   7          2HG2      ILE   7   7.528   1.385 -17.891
   41   3HG2  ILE   7          3HG2      ILE   7   6.739   0.443 -16.627
   42   1HD1  ILE   7          1HD1      ILE   7  10.988   1.287 -14.803
   43   2HD1  ILE   7          2HD1      ILE   7   9.910   2.536 -14.180
   44   3HD1  ILE   7          3HD1      ILE   7  11.315   2.985 -15.147
   45    H    GLU   8           H        GLU   8   6.555   1.537 -13.973
   46    HA   GLU   8           HA       GLU   8   3.837   1.179 -14.843
   47   1HB   GLU   8          2HB       GLU   8   5.332   0.733 -12.248
   48   2HB   GLU   8          1HB       GLU   8   3.656   0.236 -12.480
   49   1HG   GLU   8          2HG       GLU   8   4.378  -1.093 -14.475
   50   2HG   GLU   8          1HG       GLU   8   6.051  -0.683 -14.095
   51    H    MET   9           H        MET   9   2.084   2.505 -14.471
   52    HA   MET   9           HA       MET   9   1.867   4.198 -12.135
   53   1HB   MET   9          2HB       MET   9   1.854   6.315 -13.642
   54   2HB   MET   9          1HB       MET   9   3.414   5.616 -13.218
   55   1HG   MET   9          2HG       MET   9   3.594   5.977 -15.539
   56   2HG   MET   9          1HG       MET   9   3.174   4.271 -15.432
   57   1HE   MET   9          1HE       MET   9   1.967   3.464 -17.184
   58   2HE   MET   9          2HE       MET   9   0.272   3.833 -17.494
   59   3HE   MET   9          3HE       MET   9   0.768   3.280 -15.897
   60    H    TYR  10           H        TYR  10   0.233   2.210 -13.530
   61    HA   TYR  10           HA       TYR  10  -1.833   3.292 -15.137
   62   1HB   TYR  10          2HB       TYR  10  -1.761   1.066 -13.079
   63   2HB   TYR  10          1HB       TYR  10  -3.116   1.322 -14.179
   64    HD1  TYR  10           1HD      TYR  10   0.116  -0.169 -13.779
   65    HD2  TYR  10           2HD      TYR  10  -2.592   1.416 -16.712
   66    HE1  TYR  10           1HE      TYR  10   1.327  -1.398 -15.561
   67    HE2  TYR  10           2HE      TYR  10  -1.381   0.188 -18.494
   68    HH   TYR  10           HH       TYR  10   1.477  -0.837 -18.403
   69    H    GLU  11           H        GLU  11  -2.366   2.403 -11.717
   70    HA   GLU  11           HA       GLU  11  -3.582   5.063 -11.181
   71   1HB   GLU  11          2HB       GLU  11  -5.162   3.120 -12.167
   72   2HB   GLU  11          1HB       GLU  11  -5.189   2.652 -10.470
   73   1HG   GLU  11          2HG       GLU  11  -6.999   4.138 -10.649
   74   2HG   GLU  11          1HG       GLU  11  -5.702   5.141 -10.005
   75    H    TRP  12           H        TRP  12  -3.019   1.768  -9.905
   76    HA   TRP  12           HA       TRP  12  -3.167   2.396  -7.147
   77   1HB   TRP  12          2HB       TRP  12  -1.872   0.282  -6.904
   78   2HB   TRP  12          1HB       TRP  12  -3.184   0.129  -8.069
   79    HD1  TRP  12           HD       TRP  12  -2.573  -0.319 -10.560
   80    HE1  TRP  12           1HE      TRP  12  -0.361  -0.829 -11.783
   81    HE3  TRP  12           3HE      TRP  12   0.760   0.837  -6.870
   82    HZ2  TRP  12           2HZ      TRP  12   2.451  -0.756 -11.262
   83    HZ3  TRP  12           3HZ      TRP  12   3.197   0.608  -7.258
   84    HH2  TRP  12           HH       TRP  12   4.045  -0.187  -9.448
   85    H    TYR  13           H        TYR  13  -0.703   3.228  -9.443
   86    HA   TYR  13           HA       TYR  13   1.449   3.462  -7.454
   87   1HB   TYR  13          2HB       TYR  13   1.612   2.894  -9.954
   88   2HB   TYR  13          1HB       TYR  13   1.320   4.609 -10.251
   89    HD1  TYR  13           1HD      TYR  13   3.278   5.770 -10.728
   90    HD2  TYR  13           2HD      TYR  13   3.355   2.665  -7.761
   91    HE1  TYR  13           1HE      TYR  13   5.667   6.256 -10.279
   92    HE2  TYR  13           2HE      TYR  13   5.743   3.150  -7.313
   93    HH   TYR  13           HH       TYR  13   7.690   4.193  -8.666
   94    H    SER  14           H        SER  14   2.217   5.420  -6.571
   95    HA   SER  14           HA       SER  14   0.911   7.971  -7.343
   96   1HB   SER  14          2HB       SER  14   0.921   7.111  -4.459
   97   2HB   SER  14          1HB       SER  14  -0.086   8.324  -5.242
   98    HG   SER  14           HG       SER  14  -1.413   6.628  -5.116
   99    H    LYS  15           H        LYS  15   2.434   9.555  -7.274
  100    HA   LYS  15           HA       LYS  15   5.094   8.999  -6.171
  101   1HB   LYS  15          2HB       LYS  15   3.803  10.736  -8.115
  102   2HB   LYS  15          1HB       LYS  15   4.937  11.636  -7.110
  103   1HG   LYS  15          2HG       LYS  15   5.925  10.581  -9.211
  104   2HG   LYS  15          1HG       LYS  15   6.755  10.199  -7.704
  105   1HD   LYS  15          2HD       LYS  15   4.585   8.321  -8.289
  106   2HD   LYS  15          1HD       LYS  15   5.814   8.346  -9.553
  107   1HE   LYS  15          2HE       LYS  15   7.258   7.205  -8.234
  108   2HE   LYS  15          1HE       LYS  15   7.066   8.392  -6.931
  109   1HZ   LYS  15          1HZ       LYS  15   4.840   6.558  -7.461
  110   2HZ   LYS  15          2HZ       LYS  15   5.355   7.240  -5.993
  111   3HZ   LYS  15          3HZ       LYS  15   6.200   5.932  -6.665
  112    H    HIS  16           H        HIS  16   5.161   9.160  -3.961
  113    HA   HIS  16           HA       HIS  16   5.133  10.159  -1.834
  114   1HB   HIS  16          2HB       HIS  16   5.267  12.467  -3.773
  115   2HB   HIS  16          1HB       HIS  16   5.261  12.745  -2.032
  116    HD1  HIS  16           1HD      HIS  16   7.771  13.627  -2.360
  117    HD2  HIS  16           2HD      HIS  16   7.194   9.566  -3.102
  118    HE1  HIS  16           1HE      HIS  16  10.071  12.566  -2.360
  119    H    MET  17           H        MET  17   2.668   9.207  -2.462
  120    HA   MET  17           HA       MET  17   0.631  11.317  -2.297
  121   1HB   MET  17          2HB       MET  17  -0.887   9.508  -2.523
  122   2HB   MET  17          1HB       MET  17   0.527   8.989  -3.435
  123   1HG   MET  17          2HG       MET  17   1.310   7.717  -1.439
  124   2HG   MET  17          1HG       MET  17  -0.166   8.183  -0.593
  125   1HE   MET  17          1HE       MET  17   1.051   4.972  -1.774
  126   2HE   MET  17          2HE       MET  17  -0.563   4.433  -1.317
  127   3HE   MET  17          3HE       MET  17   0.270   5.632  -0.331
  128    H    THR  18           H        THR  18  -1.146  10.281  -0.389
  129    HA   THR  18           HA       THR  18   0.441  10.549   2.147
  130    HB   THR  18           HB       THR  18  -2.413  11.435   1.798
  131    HG1  THR  18           1HG      THR  18  -0.082  12.922   1.165
  132   1HG2  THR  18          1HG2      THR  18  -1.038  11.319   4.017
  133   2HG2  THR  18          2HG2      THR  18  -1.991  12.762   3.676
  134   3HG2  THR  18          3HG2      THR  18  -0.249  12.769   3.398
  135    H    ARG  19           H        ARG  19   0.200   8.867   3.536
  136    HA   ARG  19           HA       ARG  19  -1.150   6.469   3.100
  137   1HB   ARG  19          2HB       ARG  19  -0.813   6.125   5.489
  138   2HB   ARG  19          1HB       ARG  19   0.544   7.068   4.873
  139   1HG   ARG  19          2HG       ARG  19  -0.717   9.162   5.586
  140   2HG   ARG  19          1HG       ARG  19  -1.866   8.102   6.408
  141   1HD   ARG  19          2HD       ARG  19   0.523   7.113   7.340
  142   2HD   ARG  19          1HD       ARG  19   0.884   8.845   7.194
  143    HE   ARG  19           HE       ARG  19  -1.363   9.161   8.445
  144   1HH1  ARG  19          1HH2      ARG  19   1.280   7.822   9.735
  145   2HH1  ARG  19          2HH2      ARG  19   0.490   6.804  10.893
  146   1HH2  ARG  19          1HH1      ARG  19  -2.663   7.233   9.516
  147   2HH2  ARG  19          2HH1      ARG  19  -1.742   6.471  10.769
  148    H    SER  20           H        SER  20  -2.360   9.385   4.679
  149    HA   SER  20           HA       SER  20  -4.904   8.289   5.484
  150   1HB   SER  20          2HB       SER  20  -4.579  10.171   6.694
  151   2HB   SER  20          1HB       SER  20  -3.338  10.734   5.584
  152    HG   SER  20           HG       SER  20  -6.009  11.384   5.759
  153    H    GLN  21           H        GLN  21  -3.770  10.157   2.670
  154    HA   GLN  21           HA       GLN  21  -6.322  10.547   1.434
  155   1HB   GLN  21          2HB       GLN  21  -3.459  10.367   0.487
  156   2HB   GLN  21          1HB       GLN  21  -4.779  10.664  -0.645
  157   1HG   GLN  21          2HG       GLN  21  -4.482  12.321   1.855
  158   2HG   GLN  21          1HG       GLN  21  -3.592  12.723   0.388
  159   1HE2  GLN  21          1HE2      GLN  21  -6.282  13.680   1.944
  160   2HE2  GLN  21          2HE2      GLN  21  -7.299  14.034   0.633
  161    H    ALA  22           H        ALA  22  -3.917   7.932   1.233
  162    HA   ALA  22           HA       ALA  22  -5.239   6.353  -0.744
  163   1HB   ALA  22          1HB       ALA  22  -2.887   6.260   0.583
  164   2HB   ALA  22          2HB       ALA  22  -3.558   4.849  -0.233
  165   3HB   ALA  22          3HB       ALA  22  -3.778   5.050   1.505
  166    H    GLU  23           H        GLU  23  -5.421   6.299   2.820
  167    HA   GLU  23           HA       GLU  23  -7.283   4.176   3.101
  168   1HB   GLU  23          2HB       GLU  23  -6.743   6.707   4.680
  169   2HB   GLU  23          1HB       GLU  23  -7.820   5.439   5.260
  170   1HG   GLU  23          2HG       GLU  23  -5.572   4.018   4.513
  171   2HG   GLU  23          1HG       GLU  23  -4.887   5.502   5.170
  172    H    GLN  24           H        GLN  24  -7.952   7.708   2.911
  173    HA   GLN  24           HA       GLN  24 -10.791   7.371   2.923
  174   1HB   GLN  24          2HB       GLN  24 -10.796   9.736   2.203
  175   2HB   GLN  24          1HB       GLN  24  -9.647   9.464   3.509
  176   1HG   GLN  24          2HG       GLN  24  -7.818   9.319   1.843
  177   2HG   GLN  24          1HG       GLN  24  -8.980   9.652   0.559
  178   1HE2  GLN  24          1HE2      GLN  24  -7.762  11.078   3.637
  179   2HE2  GLN  24          2HE2      GLN  24  -7.977  12.689   3.145
  180    H    LEU  25           H        LEU  25  -8.519   7.861   0.139
  181    HA   LEU  25           HA       LEU  25 -10.687   7.663  -1.762
  182   1HB   LEU  25          2HB       LEU  25  -8.878   7.501  -3.415
  183   2HB   LEU  25          1HB       LEU  25  -8.508   8.747  -2.229
  184    HG   LEU  25           HG       LEU  25  -7.303   6.730  -0.992
  185   1HD1  LEU  25          1HD1      LEU  25  -8.175   5.470  -3.320
  186   2HD1  LEU  25          2HD1      LEU  25  -6.939   4.870  -2.216
  187   3HD1  LEU  25          3HD1      LEU  25  -6.473   5.807  -3.634
  188   1HD2  LEU  25          1HD2      LEU  25  -6.509   8.903  -2.530
  189   2HD2  LEU  25          2HD2      LEU  25  -5.668   7.553  -3.288
  190   3HD2  LEU  25          3HD2      LEU  25  -5.432   7.888  -1.576
  191    H    LEU  26           H        LEU  26  -8.723   5.317  -0.052
  192    HA   LEU  26           HA       LEU  26  -9.344   3.053  -1.762
  193   1HB   LEU  26          2HB       LEU  26  -8.224   3.594   0.950
  194   2HB   LEU  26          1HB       LEU  26  -8.924   2.005   0.710
  195    HG   LEU  26           HG       LEU  26  -6.853   3.219  -1.137
  196   1HD1  LEU  26          1HD1      LEU  26  -5.180   2.322   0.129
  197   2HD1  LEU  26          2HD1      LEU  26  -6.135   0.904   0.560
  198   3HD1  LEU  26          3HD1      LEU  26  -6.362   2.419   1.433
  199   1HD2  LEU  26          1HD2      LEU  26  -7.436   0.291  -0.882
  200   2HD2  LEU  26          2HD2      LEU  26  -6.888   1.203  -2.288
  201   3HD2  LEU  26          3HD2      LEU  26  -8.575   1.290  -1.784
  202    H    LYS  27           H        LYS  27 -10.563   4.019   1.474
  203    HA   LYS  27           HA       LYS  27 -12.847   2.334   1.557
  204   1HB   LYS  27          2HB       LYS  27 -11.631   4.272   3.106
  205   2HB   LYS  27          1HB       LYS  27 -13.161   5.037   2.679
  206   1HG   LYS  27          2HG       LYS  27 -14.207   2.731   3.343
  207   2HG   LYS  27          1HG       LYS  27 -12.687   2.490   4.207
  208   1HD   LYS  27          2HD       LYS  27 -13.100   4.815   5.232
  209   2HD   LYS  27          1HD       LYS  27 -14.750   4.654   4.629
  210   1HE   LYS  27          2HE       LYS  27 -13.599   2.366   6.194
  211   2HE   LYS  27          1HE       LYS  27 -14.139   3.808   7.075
  212   1HZ   LYS  27          1HZ       LYS  27 -15.753   2.408   5.012
  213   2HZ   LYS  27          2HZ       LYS  27 -16.254   3.703   5.990
  214   3HZ   LYS  27          3HZ       LYS  27 -15.945   2.182   6.681
  215    H    GLN  28           H        GLN  28 -12.448   5.610   0.219
  216    HA   GLN  28           HA       GLN  28 -15.153   6.134  -0.473
  217   1HB   GLN  28          2HB       GLN  28 -13.168   7.694  -0.461
  218   2HB   GLN  28          1HB       GLN  28 -12.661   6.966  -1.985
  219   1HG   GLN  28          2HG       GLN  28 -14.578   7.762  -3.128
  220   2HG   GLN  28          1HG       GLN  28 -15.435   8.098  -1.626
  221   1HE2  GLN  28          1HE2      GLN  28 -13.876   9.675  -0.134
  222   2HE2  GLN  28          2HE2      GLN  28 -13.347  11.055  -0.970
  223    H    GLU  29           H        GLU  29 -12.580   4.562  -2.461
  224    HA   GLU  29           HA       GLU  29 -14.203   4.195  -4.798
  225   1HB   GLU  29          2HB       GLU  29 -11.592   3.788  -4.111
  226   2HB   GLU  29          1HB       GLU  29 -12.174   2.124  -4.129
  227   1HG   GLU  29          2HG       GLU  29 -12.110   4.131  -6.371
  228   2HG   GLU  29          1HG       GLU  29 -11.465   2.496  -6.342
  229    H    GLY  30           H        GLY  30 -13.650   2.125  -1.944
  230   1HA   GLY  30          2HA       GLY  30 -15.275   0.707  -0.954
  231   2HA   GLY  30          1HA       GLY  30 -16.283   0.956  -2.372
  232    H    LYS  31           H        LYS  31 -13.023   0.034  -3.026
  233    HA   LYS  31           HA       LYS  31 -13.950  -2.541  -4.127
  234   1HB   LYS  31          2HB       LYS  31 -11.193  -1.283  -3.989
  235   2HB   LYS  31          1HB       LYS  31 -11.699  -2.578  -5.072
  236   1HG   LYS  31          2HG       LYS  31 -12.599   0.311  -5.085
  237   2HG   LYS  31          1HG       LYS  31 -11.782  -0.573  -6.370
  238   1HD   LYS  31          2HD       LYS  31 -14.609  -1.036  -5.375
  239   2HD   LYS  31          1HD       LYS  31 -14.140  -0.366  -6.938
  240   1HE   LYS  31          2HE       LYS  31 -12.745  -2.727  -6.953
  241   2HE   LYS  31          1HE       LYS  31 -14.209  -3.189  -6.063
  242   1HZ   LYS  31          1HZ       LYS  31 -15.562  -2.213  -7.777
  243   2HZ   LYS  31          2HZ       LYS  31 -14.501  -3.333  -8.492
  244   3HZ   LYS  31          3HZ       LYS  31 -14.191  -1.667  -8.616
  245    H    GLU  32           H        GLU  32 -13.730  -4.493  -3.038
  246    HA   GLU  32           HA       GLU  32 -12.458  -4.525  -0.403
  247   1HB   GLU  32          2HB       GLU  32 -13.104  -6.953  -0.496
  248   2HB   GLU  32          1HB       GLU  32 -14.444  -5.831  -0.722
  249   1HG   GLU  32          2HG       GLU  32 -13.125  -6.509  -3.248
  250   2HG   GLU  32          1HG       GLU  32 -13.772  -7.929  -2.428
  251    H    GLY  33           H        GLY  33 -10.251  -4.109  -0.838
  252   1HA   GLY  33          2HA       GLY  33  -8.193  -5.533  -0.847
  253   2HA   GLY  33          1HA       GLY  33  -8.846  -6.265  -2.311
  254    H    GLY  34           H        GLY  34  -9.169  -2.812  -1.760
  255   1HA   GLY  34          2HA       GLY  34  -8.019  -2.116  -4.262
  256   2HA   GLY  34          1HA       GLY  34  -8.236  -0.991  -2.916
  257    H    PHE  35           H        PHE  35  -5.909  -1.105  -4.674
  258    HA   PHE  35           HA       PHE  35  -3.850  -1.562  -2.580
  259   1HB   PHE  35          2HB       PHE  35  -3.932  -3.657  -3.685
  260   2HB   PHE  35          1HB       PHE  35  -4.150  -2.907  -5.264
  261    HD1  PHE  35           1HD      PHE  35  -2.222  -1.576  -6.264
  262    HD2  PHE  35           2HD      PHE  35  -1.760  -4.127  -2.837
  263    HE1  PHE  35           1HE      PHE  35   0.229  -1.629  -6.635
  264    HE2  PHE  35           2HE      PHE  35   0.693  -4.179  -3.210
  265    HZ   PHE  35           HZ       PHE  35   1.687  -2.929  -5.107
  266    H    ILE  36           H        ILE  36  -2.455   0.136  -2.572
  267    HA   ILE  36           HA       ILE  36  -1.906   1.597  -5.126
  268    HB   ILE  36           HB       ILE  36  -2.630   2.741  -2.406
  269   1HG1  ILE  36          2HG1      ILE  36  -4.023   2.944  -5.094
  270   2HG1  ILE  36          1HG1      ILE  36  -4.529   1.887  -3.775
  271   1HG2  ILE  36          1HG2      ILE  36  -0.889   4.085  -3.522
  272   2HG2  ILE  36          2HG2      ILE  36  -2.429   4.943  -3.515
  273   3HG2  ILE  36          3HG2      ILE  36  -1.870   4.148  -4.985
  274   1HD1  ILE  36          1HD1      ILE  36  -5.821   3.656  -3.166
  275   2HD1  ILE  36          2HD1      ILE  36  -4.840   4.810  -4.069
  276   3HD1  ILE  36          3HD1      ILE  36  -4.325   4.276  -2.469
  277    H    VAL  37           H        VAL  37   0.198   2.822  -4.967
  278    HA   VAL  37           HA       VAL  37   1.937   1.948  -2.711
  279    HB   VAL  37           HB       VAL  37   2.590   1.629  -5.653
  280   1HG1  VAL  37          1HG1      VAL  37   4.610   1.995  -4.426
  281   2HG1  VAL  37          2HG1      VAL  37   4.489   0.249  -4.636
  282   3HG1  VAL  37          3HG1      VAL  37   4.064   0.982  -3.090
  283   1HG2  VAL  37          1HG2      VAL  37   1.809  -0.391  -3.525
  284   2HG2  VAL  37          2HG2      VAL  37   2.461  -0.821  -5.106
  285   3HG2  VAL  37          3HG2      VAL  37   0.904  -0.000  -4.987
  286    H    ARG  38           H        ARG  38   3.684   3.366  -2.297
  287    HA   ARG  38           HA       ARG  38   4.097   5.678  -4.118
  288   1HB   ARG  38          2HB       ARG  38   3.716   7.251  -2.225
  289   2HB   ARG  38          1HB       ARG  38   2.267   6.322  -2.603
  290   1HG   ARG  38          2HG       ARG  38   2.264   5.949  -0.345
  291   2HG   ARG  38          1HG       ARG  38   3.404   4.674  -0.779
  292   1HD   ARG  38          2HD       ARG  38   4.535   5.852   0.940
  293   2HD   ARG  38          1HD       ARG  38   5.212   6.564  -0.536
  294    HE   ARG  38           HE       ARG  38   3.011   8.131  -0.117
  295   1HH1  ARG  38          1HH1      ARG  38   6.123   7.989   1.040
  296   2HH1  ARG  38          2HH1      ARG  38   5.849   8.957   2.449
  297   1HH2  ARG  38          1HH2      ARG  38   2.400   8.981   2.089
  298   2HH2  ARG  38          2HH2      ARG  38   3.742   9.519   3.043
  299    H    ASP  39           H        ASP  39   6.127   6.757  -3.711
  300    HA   ASP  39           HA       ASP  39   8.208   5.028  -2.632
  301   1HB   ASP  39          2HB       ASP  39   8.374   6.553  -4.621
  302   2HB   ASP  39          1HB       ASP  39   8.303   7.928  -3.517
  303    H    SER  40           H        SER  40   9.596   5.521  -0.831
  304    HA   SER  40           HA       SER  40   8.275   7.139   1.299
  305   1HB   SER  40          2HB       SER  40   9.069   4.629   1.378
  306   2HB   SER  40          1HB       SER  40  10.659   5.336   1.647
  307    HG   SER  40           HG       SER  40   8.308   5.894   3.146
  308    H    SER  41           H        SER  41  10.956   7.225   2.720
  309    HA   SER  41           HA       SER  41  12.526   9.088   1.020
  310   1HB   SER  41          2HB       SER  41  10.843  10.521   1.984
  311   2HB   SER  41          1HB       SER  41  11.055   9.795   3.575
  312    HG   SER  41           HG       SER  41  12.305  11.879   2.575
  313    H    LYS  42           H        LYS  42  12.137   7.792   4.345
  314    HA   LYS  42           HA       LYS  42  14.821   8.117   5.212
  315   1HB   LYS  42          2HB       LYS  42  12.755   5.981   5.838
  316   2HB   LYS  42          1HB       LYS  42  14.184   6.313   6.817
  317   1HG   LYS  42          2HG       LYS  42  13.321   8.748   6.907
  318   2HG   LYS  42          1HG       LYS  42  11.788   8.083   6.342
  319   1HD   LYS  42          2HD       LYS  42  11.440   7.869   8.608
  320   2HD   LYS  42          1HD       LYS  42  12.269   6.339   8.321
  321   1HE   LYS  42          2HE       LYS  42  14.078   6.981   9.540
  322   2HE   LYS  42          1HE       LYS  42  14.121   8.581   8.775
  323   1HZ   LYS  42          1HZ       LYS  42  12.366   9.336  10.152
  324   2HZ   LYS  42          2HZ       LYS  42  13.488   8.589  11.186
  325   3HZ   LYS  42          3HZ       LYS  42  12.059   7.780  10.751
  326    H    ALA  43           H        ALA  43  13.386   4.990   4.232
  327    HA   ALA  43           HA       ALA  43  16.062   3.951   3.515
  328   1HB   ALA  43          1HB       ALA  43  13.569   2.961   4.455
  329   2HB   ALA  43          2HB       ALA  43  15.037   2.035   4.148
  330   3HB   ALA  43          3HB       ALA  43  13.834   2.229   2.873
  331    H    GLY  44           H        GLY  44  13.418   5.484   1.959
  332   1HA   GLY  44          2HA       GLY  44  13.138   6.022  -0.328
  333   2HA   GLY  44          1HA       GLY  44  14.642   5.150  -0.673
  334    H    LYS  45           H        LYS  45  12.155   3.674   1.243
  335    HA   LYS  45           HA       LYS  45  11.871   1.516  -0.734
  336   1HB   LYS  45          2HB       LYS  45  10.783   0.391   1.143
  337   2HB   LYS  45          1HB       LYS  45  12.264   1.162   1.704
  338   1HG   LYS  45          2HG       LYS  45  10.132   3.069   1.901
  339   2HG   LYS  45          1HG       LYS  45   9.605   1.568   2.661
  340   1HD   LYS  45          2HD       LYS  45  11.983   1.611   3.768
  341   2HD   LYS  45          1HD       LYS  45  11.935   3.327   3.365
  342   1HE   LYS  45          2HE       LYS  45  10.852   3.520   5.378
  343   2HE   LYS  45          1HE       LYS  45   9.439   2.951   4.468
  344   1HZ   LYS  45          1HZ       LYS  45   9.761   1.494   6.321
  345   2HZ   LYS  45          2HZ       LYS  45  11.403   1.281   5.945
  346   3HZ   LYS  45          3HZ       LYS  45  10.205   0.652   4.917
  347    H    TYR  46           H        TYR  46   9.381   0.639  -0.680
  348    HA   TYR  46           HA       TYR  46   7.675   2.998  -1.412
  349   1HB   TYR  46          2HB       TYR  46   7.450   0.113  -2.324
  350   2HB   TYR  46          1HB       TYR  46   6.606   1.500  -2.999
  351    HD1  TYR  46           1HD      TYR  46   8.330  -0.449  -4.577
  352    HD2  TYR  46           2HD      TYR  46   9.267   3.281  -2.668
  353    HE1  TYR  46           1HE      TYR  46  10.196  -0.100  -6.170
  354    HE2  TYR  46           2HE      TYR  46  11.132   3.629  -4.260
  355    HH   TYR  46           HH       TYR  46  12.614   2.174  -5.698
  356    H    THR  47           H        THR  47   5.333   2.712  -0.939
  357    HA   THR  47           HA       THR  47   4.828   0.890   1.394
  358    HB   THR  47           HB       THR  47   3.854   3.719   0.862
  359    HG1  THR  47           1HG      THR  47   5.908   3.786   1.617
  360   1HG2  THR  47          1HG2      THR  47   3.225   3.182   3.460
  361   2HG2  THR  47          2HG2      THR  47   2.972   1.596   2.731
  362   3HG2  THR  47          3HG2      THR  47   2.091   2.997   2.122
  363    H    VAL  48           H        VAL  48   3.075  -0.453   1.091
  364    HA   VAL  48           HA       VAL  48   1.432  -0.017  -1.362
  365    HB   VAL  48           HB       VAL  48   1.927  -2.361   0.489
  366   1HG1  VAL  48          1HG1      VAL  48   0.115  -2.084  -1.916
  367   2HG1  VAL  48          2HG1      VAL  48  -0.315  -2.639  -0.299
  368   3HG1  VAL  48          3HG1      VAL  48   0.692  -3.645  -1.337
  369   1HG2  VAL  48          1HG2      VAL  48   2.977  -1.426  -2.140
  370   2HG2  VAL  48          2HG2      VAL  48   2.739  -3.162  -1.940
  371   3HG2  VAL  48          3HG2      VAL  48   3.805  -2.286  -0.842
  372    H    SER  49           H        SER  49  -0.325   1.262  -0.878
  373    HA   SER  49           HA       SER  49  -1.741   0.985   1.710
  374   1HB   SER  49          2HB       SER  49  -1.764   2.821  -0.674
  375   2HB   SER  49          1HB       SER  49  -3.119   2.845   0.452
  376    HG   SER  49           HG       SER  49  -0.386   3.403   0.916
  377    H    VAL  50           H        VAL  50  -3.022  -0.903   1.684
  378    HA   VAL  50           HA       VAL  50  -4.832  -1.217  -0.695
  379    HB   VAL  50           HB       VAL  50  -4.680  -3.660  -0.166
  380   1HG1  VAL  50          1HG1      VAL  50  -2.377  -1.951  -0.941
  381   2HG1  VAL  50          2HG1      VAL  50  -3.174  -3.244  -1.837
  382   3HG1  VAL  50          3HG1      VAL  50  -2.012  -3.636  -0.571
  383   1HG2  VAL  50          1HG2      VAL  50  -3.598  -4.454   1.672
  384   2HG2  VAL  50          2HG2      VAL  50  -3.801  -2.820   2.296
  385   3HG2  VAL  50          3HG2      VAL  50  -2.289  -3.284   1.521
  386    H    PHE  51           H        PHE  51  -7.047  -1.555  -0.247
  387    HA   PHE  51           HA       PHE  51  -7.817  -1.892   2.630
  388   1HB   PHE  51          2HB       PHE  51  -8.607   0.228   2.659
  389   2HB   PHE  51          1HB       PHE  51  -7.958   0.459   1.041
  390    HD1  PHE  51           1HD      PHE  51  -9.380  -0.248  -0.953
  391    HD2  PHE  51           2HD      PHE  51 -10.958   0.102   3.022
  392    HE1  PHE  51           1HE      PHE  51 -11.671  -0.169  -1.871
  393    HE2  PHE  51           2HE      PHE  51 -13.256   0.173   2.099
  394    HZ   PHE  51           HZ       PHE  51 -13.611   0.042  -0.348
  395    H    ALA  52           H        ALA  52 -10.350  -2.201   2.700
  396    HA   ALA  52           HA       ALA  52 -11.591  -3.370   0.340
  397   1HB   ALA  52          1HB       ALA  52 -11.387  -5.359   2.529
  398   2HB   ALA  52          2HB       ALA  52  -9.895  -5.040   1.645
  399   3HB   ALA  52          3HB       ALA  52 -11.327  -5.600   0.783
  400    H    LYS  53           H        LYS  53 -13.648  -4.752   1.334
  401    HA   LYS  53           HA       LYS  53 -14.900  -2.995   3.432
  402   1HB   LYS  53          2HB       LYS  53 -15.778  -4.014   0.739
  403   2HB   LYS  53          1HB       LYS  53 -16.981  -3.597   1.960
  404   1HG   LYS  53          2HG       LYS  53 -14.759  -1.697   1.212
  405   2HG   LYS  53          1HG       LYS  53 -16.287  -1.730   0.330
  406   1HD   LYS  53          2HD       LYS  53 -16.509  -1.668   3.281
  407   2HD   LYS  53          1HD       LYS  53 -15.879  -0.200   2.534
  408   1HE   LYS  53          2HE       LYS  53 -18.362  -1.532   1.445
  409   2HE   LYS  53          1HE       LYS  53 -18.456  -0.387   2.798
  410   1HZ   LYS  53          1HZ       LYS  53 -17.079   1.151   1.435
  411   2HZ   LYS  53          2HZ       LYS  53 -18.624   0.864   0.792
  412   3HZ   LYS  53          3HZ       LYS  53 -17.266   0.096   0.121
  413    H    SER  54           H        SER  54 -13.599  -5.656   3.863
  414    HA   SER  54           HA       SER  54 -15.899  -7.012   5.120
  415   1HB   SER  54          2HB       SER  54 -15.305  -9.145   3.836
  416   2HB   SER  54          1HB       SER  54 -16.101  -7.880   2.905
  417    HG   SER  54           HG       SER  54 -14.414  -8.113   1.660
  418    H    THR  55           H        THR  55 -14.292  -6.279   6.883
  419    HA   THR  55           HA       THR  55 -12.752  -8.574   7.798
  420    HB   THR  55           HB       THR  55 -11.024  -6.191   7.493
  421    HG1  THR  55           1HG      THR  55 -10.649  -6.521   5.355
  422   1HG2  THR  55          1HG2      THR  55 -10.319  -8.979   6.685
  423   2HG2  THR  55          2HG2      THR  55 -10.549  -8.622   8.398
  424   3HG2  THR  55          3HG2      THR  55  -9.322  -7.756   7.474
  425    H    GLY  56           H        GLY  56 -10.995  -6.602   9.394
  426   1HA   GLY  56          2HA       GLY  56 -12.538  -6.353  11.728
  427   2HA   GLY  56          1HA       GLY  56 -11.181  -5.287  11.348
  428    H    ASP  57           H        ASP  57 -12.408  -4.341   8.878
  429    HA   ASP  57           HA       ASP  57 -14.567  -2.582   9.986
  430   1HB   ASP  57          2HB       ASP  57 -12.070  -1.884   9.167
  431   2HB   ASP  57          1HB       ASP  57 -12.936  -1.793   7.636
  432    HA   PRO  58           HA       PRO  58 -16.316  -5.441   6.726
  433   1HB   PRO  58          2HB       PRO  58 -18.857  -4.568   7.767
  434   2HB   PRO  58          1HB       PRO  58 -18.117  -6.168   7.872
  435   1HG   PRO  58          2HG       PRO  58 -18.376  -4.162   9.942
  436   2HG   PRO  58          1HG       PRO  58 -17.779  -5.817  10.083
  437   1HD   PRO  58          2HD       PRO  58 -16.232  -3.464  10.292
  438   2HD   PRO  58          1HD       PRO  58 -15.602  -5.120  10.104
  439    H    GLN  59           H        GLN  59 -16.817  -2.085   7.517
  440    HA   GLN  59           HA       GLN  59 -18.046  -1.643   4.824
  441   1HB   GLN  59          2HB       GLN  59 -18.772   0.536   5.934
  442   2HB   GLN  59          1HB       GLN  59 -19.468  -0.931   6.625
  443   1HG   GLN  59          2HG       GLN  59 -18.139  -0.832   8.531
  444   2HG   GLN  59          1HG       GLN  59 -16.886   0.116   7.730
  445   1HE2  GLN  59          1HE2      GLN  59 -18.497   0.693  10.269
  446   2HE2  GLN  59          2HE2      GLN  59 -19.169   2.229  10.003
  447    H    GLY  60           H        GLY  60 -15.029  -1.743   5.746
  448   1HA   GLY  60          2HA       GLY  60 -13.866  -0.191   3.863
  449   2HA   GLY  60          1HA       GLY  60 -14.207   0.986   5.119
  450    H    VAL  61           H        VAL  61 -12.267  -1.802   4.266
  451    HA   VAL  61           HA       VAL  61 -10.688  -1.480   6.792
  452    HB   VAL  61           HB       VAL  61 -10.582  -3.679   4.708
  453   1HG1  VAL  61          1HG1      VAL  61  -9.844  -3.836   7.627
  454   2HG1  VAL  61          2HG1      VAL  61  -8.692  -3.274   6.416
  455   3HG1  VAL  61          3HG1      VAL  61  -9.356  -4.905   6.311
  456   1HG2  VAL  61          1HG2      VAL  61 -12.016  -4.969   6.276
  457   2HG2  VAL  61          2HG2      VAL  61 -12.844  -3.571   5.598
  458   3HG2  VAL  61          3HG2      VAL  61 -12.220  -3.514   7.243
  459    H    ILE  62           H        ILE  62  -8.529  -0.996   6.665
  460    HA   ILE  62           HA       ILE  62  -7.270  -0.729   3.979
  461    HB   ILE  62           HB       ILE  62  -6.839   1.536   5.827
  462   1HG1  ILE  62          2HG1      ILE  62  -9.564   0.959   4.624
  463   2HG1  ILE  62          1HG1      ILE  62  -9.190   1.118   6.329
  464   1HG2  ILE  62          1HG2      ILE  62  -6.182   2.359   3.837
  465   2HG2  ILE  62          2HG2      ILE  62  -7.853   2.294   3.280
  466   3HG2  ILE  62          3HG2      ILE  62  -6.781   0.921   3.016
  467   1HD1  ILE  62          1HD1      ILE  62  -9.494   3.322   6.230
  468   2HD1  ILE  62          2HD1      ILE  62  -9.957   3.158   4.536
  469   3HD1  ILE  62          3HD1      ILE  62  -8.274   3.459   4.965
  470    H    ARG  63           H        ARG  63  -4.909  -0.331   4.145
  471    HA   ARG  63           HA       ARG  63  -3.454  -0.521   6.626
  472   1HB   ARG  63          2HB       ARG  63  -4.657  -2.896   5.726
  473   2HB   ARG  63          1HB       ARG  63  -2.964  -3.050   5.258
  474   1HG   ARG  63          2HG       ARG  63  -2.224  -3.096   7.429
  475   2HG   ARG  63          1HG       ARG  63  -3.493  -2.008   7.994
  476   1HD   ARG  63          2HD       ARG  63  -5.067  -4.072   7.393
  477   2HD   ARG  63          1HD       ARG  63  -3.567  -4.984   7.655
  478    HE   ARG  63           HE       ARG  63  -3.539  -4.231   9.936
  479   1HH1  ARG  63          1HH1      ARG  63  -6.524  -4.730   9.581
  480   2HH1  ARG  63          2HH1      ARG  63  -7.189  -3.283  10.264
  481   1HH2  ARG  63          1HH2      ARG  63  -4.192  -1.541  10.164
  482   2HH2  ARG  63          2HH2      ARG  63  -5.869  -1.478  10.595
  483    H    HIS  64           H        HIS  64  -1.556   0.506   6.046
  484    HA   HIS  64           HA       HIS  64  -0.686   0.386   3.203
  485   1HB   HIS  64          2HB       HIS  64   0.567   2.031   5.397
  486   2HB   HIS  64          1HB       HIS  64   0.485   2.381   3.672
  487    HD1  HIS  64           1HD      HIS  64  -1.782   3.283   2.735
  488    HD2  HIS  64           2HD      HIS  64  -1.742   2.777   6.872
  489    HE1  HIS  64           1HE      HIS  64  -3.823   4.489   3.623
  490    H    TYR  65           H        TYR  65   0.475  -1.523   2.945
  491    HA   TYR  65           HA       TYR  65   2.414  -2.455   4.953
  492   1HB   TYR  65          2HB       TYR  65   1.995  -3.264   2.065
  493   2HB   TYR  65          1HB       TYR  65   2.765  -4.217   3.328
  494    HD1  TYR  65           1HD      TYR  65   0.855  -3.610   5.597
  495    HD2  TYR  65           2HD      TYR  65   0.134  -4.652   1.492
  496    HE1  TYR  65           1HE      TYR  65  -1.340  -4.572   6.227
  497    HE2  TYR  65           2HE      TYR  65  -2.061  -5.613   2.125
  498    HH   TYR  65           HH       TYR  65  -3.108  -6.583   4.223
  499    H    VAL  66           H        VAL  66   4.497  -1.707   5.022
  500    HA   VAL  66           HA       VAL  66   5.514  -0.229   2.626
  501    HB   VAL  66           HB       VAL  66   6.361  -0.101   5.540
  502   1HG1  VAL  66          1HG1      VAL  66   8.200   0.655   4.289
  503   2HG1  VAL  66          2HG1      VAL  66   7.313   2.147   4.602
  504   3HG1  VAL  66          3HG1      VAL  66   7.179   1.354   3.033
  505   1HG2  VAL  66          1HG2      VAL  66   5.059   2.238   4.304
  506   2HG2  VAL  66          2HG2      VAL  66   4.789   1.510   5.887
  507   3HG2  VAL  66          3HG2      VAL  66   3.997   0.839   4.461
  508    H    VAL  67           H        VAL  67   7.947  -0.407   2.355
  509    HA   VAL  67           HA       VAL  67   8.837  -3.198   2.995
  510    HB   VAL  67           HB       VAL  67   9.449  -1.378   0.644
  511   1HG1  VAL  67          1HG1      VAL  67  10.664  -3.864   1.648
  512   2HG1  VAL  67          2HG1      VAL  67  11.295  -2.687   0.497
  513   3HG1  VAL  67          3HG1      VAL  67  10.182  -3.942  -0.046
  514   1HG2  VAL  67          1HG2      VAL  67   7.373  -2.131   0.044
  515   2HG2  VAL  67          2HG2      VAL  67   7.422  -3.473   1.187
  516   3HG2  VAL  67          3HG2      VAL  67   8.246  -3.608  -0.365
  517    H    CYS  68           H        CYS  68  10.885  -3.431   3.871
  518    HA   CYS  68           HA       CYS  68  12.287  -0.942   4.717
  519   1HB   CYS  68          2HB       CYS  68  11.527  -2.788   6.304
  520   2HB   CYS  68          1HB       CYS  68  12.723  -3.832   5.538
  521    HG   CYS  68           HG       CYS  68  13.365  -1.409   7.366
  522    H    SER  69           H        SER  69  14.773  -1.105   4.595
  523    HA   SER  69           HA       SER  69  15.666  -2.821   2.315
  524   1HB   SER  69          2HB       SER  69  16.968  -0.533   1.769
  525   2HB   SER  69          1HB       SER  69  15.363  -0.880   1.126
  526    HG   SER  69           HG       SER  69  16.043   1.146   2.595
  527    H    THR  70           H        THR  70  17.578  -3.783   2.739
  528    HA   THR  70           HA       THR  70  19.218  -2.789   5.034
  529    HB   THR  70           HB       THR  70  18.227  -5.105   5.057
  530    HG1  THR  70           1HG      THR  70  19.921  -5.314   6.252
  531   1HG2  THR  70          1HG2      THR  70  20.233  -5.992   3.047
  532   2HG2  THR  70          2HG2      THR  70  18.770  -5.220   2.437
  533   3HG2  THR  70          3HG2      THR  70  18.653  -6.668   3.437
  534    HA   PRO  71           HA       PRO  71  22.395  -1.521   2.298
  535   1HB   PRO  71          2HB       PRO  71  24.563  -2.661   3.806
  536   2HB   PRO  71          1HB       PRO  71  24.003  -0.986   3.792
  537   1HG   PRO  71          2HG       PRO  71  23.721  -2.884   5.900
  538   2HG   PRO  71          1HG       PRO  71  23.076  -1.242   5.840
  539   1HD   PRO  71          2HD       PRO  71  21.637  -3.755   5.606
  540   2HD   PRO  71          1HD       PRO  71  20.972  -2.107   5.686
  541    H    GLN  72           H        GLN  72  21.716  -4.783   2.590
  542    HA   GLN  72           HA       GLN  72  23.967  -5.633   0.841
  543   1HB   GLN  72          2HB       GLN  72  23.328  -7.008   2.776
  544   2HB   GLN  72          1HB       GLN  72  21.671  -7.092   2.194
  545   1HG   GLN  72          2HG       GLN  72  23.019  -9.143   1.674
  546   2HG   GLN  72          1HG       GLN  72  22.365  -8.362   0.239
  547   1HE2  GLN  72          1HE2      GLN  72  23.911  -8.353  -1.396
  548   2HE2  GLN  72          2HE2      GLN  72  25.574  -8.101  -1.168
  549    H    SER  73           H        SER  73  21.704  -3.766   0.028
  550    HA   SER  73           HA       SER  73  20.343  -3.415  -1.859
  551   1HB   SER  73          2HB       SER  73  21.697  -5.917  -2.890
  552   2HB   SER  73          1HB       SER  73  21.091  -4.556  -3.828
  553    HG   SER  73           HG       SER  73  23.334  -4.694  -2.115
  554    H    GLN  74           H        GLN  74  19.097  -4.703   0.242
  555    HA   GLN  74           HA       GLN  74  17.351  -6.691  -1.159
  556   1HB   GLN  74          2HB       GLN  74  17.885  -7.007   1.745
  557   2HB   GLN  74          1HB       GLN  74  17.706  -8.241   0.505
  558   1HG   GLN  74          2HG       GLN  74  19.969  -7.354  -0.395
  559   2HG   GLN  74          1HG       GLN  74  20.142  -6.602   1.188
  560   1HE2  GLN  74          1HE2      GLN  74  20.142  -8.099   3.102
  561   2HE2  GLN  74          2HE2      GLN  74  20.588  -9.724   2.898
  562    H    TYR  75           H        TYR  75  15.218  -6.954   0.055
  563    HA   TYR  75           HA       TYR  75  14.438  -4.560   1.664
  564   1HB   TYR  75          2HB       TYR  75  12.973  -5.472  -0.822
  565   2HB   TYR  75          1HB       TYR  75  12.643  -4.030   0.129
  566    HD1  TYR  75           1HD      TYR  75  15.137  -5.657  -2.080
  567    HD2  TYR  75           2HD      TYR  75  13.871  -2.016  -0.198
  568    HE1  TYR  75           1HE      TYR  75  16.769  -4.396  -3.439
  569    HE2  TYR  75           2HE      TYR  75  15.500  -0.749  -1.560
  570    HH   TYR  75           HH       TYR  75  16.743  -0.953  -3.614
  571    H    TYR  76           H        TYR  76  12.305  -4.825   2.697
  572    HA   TYR  76           HA       TYR  76  10.676  -7.170   2.537
  573   1HB   TYR  76          2HB       TYR  76  11.456  -8.339   4.594
  574   2HB   TYR  76          1HB       TYR  76  12.735  -8.271   3.390
  575    HD1  TYR  76           1HD      TYR  76  11.451  -6.717   6.495
  576    HD2  TYR  76           2HD      TYR  76  14.777  -7.058   3.811
  577    HE1  TYR  76           1HE      TYR  76  12.891  -5.581   8.152
  578    HE2  TYR  76           2HE      TYR  76  16.224  -5.917   5.465
  579    HH   TYR  76           HH       TYR  76  15.795  -4.230   7.428
  580    H    LEU  77           H        LEU  77   9.030  -7.198   4.252
  581    HA   LEU  77           HA       LEU  77   8.725  -4.548   5.617
  582   1HB   LEU  77          2HB       LEU  77   6.862  -5.272   4.205
  583   2HB   LEU  77          1HB       LEU  77   6.848  -6.861   4.969
  584    HG   LEU  77           HG       LEU  77   6.265  -5.761   7.141
  585   1HD1  LEU  77          1HD1      LEU  77   7.186  -3.470   6.035
  586   2HD1  LEU  77          2HD1      LEU  77   6.035  -3.490   7.370
  587   3HD1  LEU  77          3HD1      LEU  77   5.463  -3.277   5.716
  588   1HD2  LEU  77          1HD2      LEU  77   4.272  -4.880   5.057
  589   2HD2  LEU  77          2HD2      LEU  77   3.969  -5.595   6.639
  590   3HD2  LEU  77          3HD2      LEU  77   4.584  -6.596   5.323
  591    H    ALA  78           H        ALA  78   9.769  -7.670   6.005
  592    HA   ALA  78           HA       ALA  78  10.020  -7.463   8.923
  593   1HB   ALA  78          1HB       ALA  78   9.153 -10.083   8.571
  594   2HB   ALA  78          2HB       ALA  78   8.102  -9.181   7.479
  595   3HB   ALA  78          3HB       ALA  78   8.153  -8.770   9.193
  596    H    GLU  79           H        GLU  79  12.185  -7.949   9.159
  597    HA   GLU  79           HA       GLU  79  13.958  -8.767   7.188
  598   1HB   GLU  79          2HB       GLU  79  13.843  -8.872  10.166
  599   2HB   GLU  79          1HB       GLU  79  15.145  -9.775   9.390
  600   1HG   GLU  79          2HG       GLU  79  15.602  -7.653   8.034
  601   2HG   GLU  79          1HG       GLU  79  14.548  -6.823   9.179
  602    H    LYS  80           H        LYS  80  11.666 -10.755   8.836
  603    HA   LYS  80           HA       LYS  80  12.644 -13.339   8.870
  604   1HB   LYS  80          2HB       LYS  80  10.085 -11.987   8.336
  605   2HB   LYS  80          1HB       LYS  80  10.168 -13.620   7.677
  606   1HG   LYS  80          2HG       LYS  80  11.307 -13.816  10.240
  607   2HG   LYS  80          1HG       LYS  80   9.898 -12.775  10.445
  608   1HD   LYS  80          2HD       LYS  80   9.495 -15.171   8.739
  609   2HD   LYS  80          1HD       LYS  80   9.751 -15.482  10.457
  610   1HE   LYS  80          2HE       LYS  80   7.861 -13.274   9.805
  611   2HE   LYS  80          1HE       LYS  80   7.305 -14.923   9.453
  612   1HZ   LYS  80          1HZ       LYS  80   8.474 -13.991  12.023
  613   2HZ   LYS  80          2HZ       LYS  80   7.995 -15.585  11.682
  614   3HZ   LYS  80          3HZ       LYS  80   6.837 -14.343  11.754
  615    H    HIS  81           H        HIS  81  11.711 -11.479   5.986
  616    HA   HIS  81           HA       HIS  81  13.345 -13.256   4.285
  617   1HB   HIS  81          2HB       HIS  81  11.317 -13.619   2.776
  618   2HB   HIS  81          1HB       HIS  81  11.273 -14.483   4.311
  619    HD1  HIS  81           1HD      HIS  81   9.974 -11.238   2.788
  620    HD2  HIS  81           2HD      HIS  81   9.038 -13.909   5.849
  621    HE1  HIS  81           1HE      HIS  81   7.764 -10.471   3.759
  622    H    LEU  82           H        LEU  82  14.157 -12.045   2.552
  623    HA   LEU  82           HA       LEU  82  12.766  -9.516   1.859
  624   1HB   LEU  82          2HB       LEU  82  14.809  -8.246   2.276
  625   2HB   LEU  82          1HB       LEU  82  14.400  -9.154   3.728
  626    HG   LEU  82           HG       LEU  82  16.301 -10.220   1.653
  627   1HD1  LEU  82          1HD1      LEU  82  17.424  -9.101   4.145
  628   2HD1  LEU  82          2HD1      LEU  82  16.768  -7.900   3.033
  629   3HD1  LEU  82          3HD1      LEU  82  18.031  -9.003   2.495
  630   1HD2  LEU  82          1HD2      LEU  82  16.080 -12.024   3.018
  631   2HD2  LEU  82          2HD2      LEU  82  15.255 -11.079   4.257
  632   3HD2  LEU  82          3HD2      LEU  82  17.017 -11.103   4.194
  633    H    PHE  83           H        PHE  83  13.147  -8.847  -0.271
  634    HA   PHE  83           HA       PHE  83  14.790 -10.713  -1.943
  635   1HB   PHE  83          2HB       PHE  83  12.181  -9.251  -2.314
  636   2HB   PHE  83          1HB       PHE  83  13.111  -9.764  -3.726
  637    HD1  PHE  83           1HD      PHE  83  13.784 -12.201  -3.939
  638    HD2  PHE  83           2HD      PHE  83  10.921 -10.823  -1.048
  639    HE1  PHE  83           1HE      PHE  83  12.955 -14.521  -3.654
  640    HE2  PHE  83           2HE      PHE  83  10.091 -13.143  -0.766
  641    HZ   PHE  83           HZ       PHE  83  11.109 -14.992  -2.069
  642    H    SER  84           H        SER  84  14.571  -8.875  -4.265
  643    HA   SER  84           HA       SER  84  16.590  -6.876  -3.326
  644   1HB   SER  84          2HB       SER  84  16.005  -7.976  -6.094
  645   2HB   SER  84          1HB       SER  84  17.391  -6.990  -5.635
  646    HG   SER  84           HG       SER  84  16.859  -9.670  -5.183
  647    H    THR  85           H        THR  85  13.336  -6.844  -3.924
  648    HA   THR  85           HA       THR  85  13.318  -3.969  -4.430
  649    HB   THR  85           HB       THR  85  12.000  -5.597  -6.588
  650    HG1  THR  85           1HG      THR  85  13.889  -6.283  -7.159
  651   1HG2  THR  85          1HG2      THR  85  11.675  -3.570  -7.504
  652   2HG2  THR  85          2HG2      THR  85  13.371  -3.131  -7.296
  653   3HG2  THR  85          3HG2      THR  85  12.228  -2.886  -5.976
  654    H    ILE  86           H        ILE  86  11.111  -3.078  -4.367
  655    HA   ILE  86           HA       ILE  86   9.362  -4.424  -2.539
  656    HB   ILE  86           HB       ILE  86   9.284  -2.009  -4.315
  657   1HG1  ILE  86          2HG1      ILE  86   8.619  -1.288  -1.753
  658   2HG1  ILE  86          1HG1      ILE  86   9.645  -2.692  -1.473
  659   1HG2  ILE  86          1HG2      ILE  86   6.992  -2.851  -4.453
  660   2HG2  ILE  86          2HG2      ILE  86   7.032  -1.455  -3.378
  661   3HG2  ILE  86          3HG2      ILE  86   6.944  -3.082  -2.706
  662   1HD1  ILE  86          1HD1      ILE  86  11.416  -1.331  -1.774
  663   2HD1  ILE  86          2HD1      ILE  86  10.389  -0.025  -2.366
  664   3HD1  ILE  86          3HD1      ILE  86  10.968  -1.264  -3.479
  665    HA   PRO  87           HA       PRO  87   6.490  -5.169  -6.447
  666   1HB   PRO  87          2HB       PRO  87   8.307  -5.485  -8.661
  667   2HB   PRO  87          1HB       PRO  87   7.001  -4.310  -8.485
  668   1HG   PRO  87          2HG       PRO  87   9.858  -3.873  -8.279
  669   2HG   PRO  87          1HG       PRO  87   8.557  -2.679  -8.265
  670   1HD   PRO  87          2HD       PRO  87  10.173  -3.428  -6.064
  671   2HD   PRO  87          1HD       PRO  87   8.689  -2.449  -5.996
  672    H    GLU  88           H        GLU  88   9.793  -6.340  -6.109
  673    HA   GLU  88           HA       GLU  88   9.383  -9.040  -7.026
  674   1HB   GLU  88          2HB       GLU  88  11.494  -7.511  -6.321
  675   2HB   GLU  88          1HB       GLU  88  11.285  -8.397  -4.811
  676   1HG   GLU  88          2HG       GLU  88  12.583  -9.960  -5.844
  677   2HG   GLU  88          1HG       GLU  88  11.065 -10.428  -6.607
  678    H    LEU  89           H        LEU  89   9.582  -7.692  -3.711
  679    HA   LEU  89           HA       LEU  89   8.745  -9.981  -2.273
  680   1HB   LEU  89          2HB       LEU  89   8.795  -7.023  -1.916
  681   2HB   LEU  89          1HB       LEU  89   7.766  -7.921  -0.801
  682    HG   LEU  89           HG       LEU  89  10.577  -8.847  -1.317
  683   1HD1  LEU  89          1HD1      LEU  89  11.189  -7.485   0.743
  684   2HD1  LEU  89          2HD1      LEU  89   9.678  -6.611   0.518
  685   3HD1  LEU  89          3HD1      LEU  89  10.929  -6.546  -0.724
  686   1HD2  LEU  89          1HD2      LEU  89  10.319  -9.901   0.807
  687   2HD2  LEU  89          2HD2      LEU  89   8.786 -10.158  -0.025
  688   3HD2  LEU  89          3HD2      LEU  89   8.918  -8.909   1.212
  689    H    ILE  90           H        ILE  90   6.705  -7.214  -3.317
  690    HA   ILE  90           HA       ILE  90   4.190  -8.141  -2.513
  691    HB   ILE  90           HB       ILE  90   4.980  -6.672  -5.054
  692   1HG1  ILE  90          2HG1      ILE  90   5.857  -5.564  -3.058
  693   2HG1  ILE  90          1HG1      ILE  90   4.487  -4.643  -3.674
  694   1HG2  ILE  90          1HG2      ILE  90   2.499  -7.663  -4.460
  695   2HG2  ILE  90          2HG2      ILE  90   2.779  -6.217  -5.429
  696   3HG2  ILE  90          3HG2      ILE  90   2.418  -6.070  -3.709
  697   1HD1  ILE  90          1HD1      ILE  90   4.643  -6.393  -1.236
  698   2HD1  ILE  90          2HD1      ILE  90   3.089  -6.125  -2.023
  699   3HD1  ILE  90          3HD1      ILE  90   4.004  -4.757  -1.389
  700    H    ASN  91           H        ASN  91   5.943  -8.923  -5.526
  701    HA   ASN  91           HA       ASN  91   3.908 -10.513  -6.750
  702   1HB   ASN  91          2HB       ASN  91   6.220  -9.571  -7.569
  703   2HB   ASN  91          1HB       ASN  91   6.858 -11.094  -6.950
  704   1HD2  ASN  91          1HD2      ASN  91   7.298 -12.065  -9.017
  705   2HD2  ASN  91          2HD2      ASN  91   6.068 -12.469 -10.115
  706    H    TYR  92           H        TYR  92   6.589 -11.388  -4.559
  707    HA   TYR  92           HA       TYR  92   6.044 -14.211  -4.482
  708   1HB   TYR  92          2HB       TYR  92   7.356 -12.321  -2.499
  709   2HB   TYR  92          1HB       TYR  92   7.502 -14.078  -2.463
  710    HD1  TYR  92           1HD      TYR  92   7.781 -14.801  -5.269
  711    HD2  TYR  92           2HD      TYR  92   9.445 -11.467  -3.141
  712    HE1  TYR  92           1HE      TYR  92   9.640 -14.687  -6.908
  713    HE2  TYR  92           2HE      TYR  92  11.304 -11.352  -4.776
  714    HH   TYR  92           HH       TYR  92  11.254 -13.036  -7.739
  715    H    HIS  93           H        HIS  93   4.450 -11.502  -3.035
  716    HA   HIS  93           HA       HIS  93   3.429 -12.535  -0.622
  717   1HB   HIS  93          2HB       HIS  93   3.233 -10.228  -1.842
  718   2HB   HIS  93          1HB       HIS  93   1.769 -10.917  -2.543
  719    HD1  HIS  93           1HD      HIS  93  -0.255 -11.238  -1.007
  720    HD2  HIS  93           2HD      HIS  93   3.126  -9.888   1.024
  721    HE1  HIS  93           1HE      HIS  93  -1.028 -10.585   1.315
  722    H    GLN  94           H        GLN  94   2.175 -12.979  -3.945
  723    HA   GLN  94           HA       GLN  94   0.763 -15.421  -3.048
  724   1HB   GLN  94          2HB       GLN  94  -0.469 -12.857  -3.222
  725   2HB   GLN  94          1HB       GLN  94  -1.094 -13.826  -4.556
  726   1HG   GLN  94          2HG       GLN  94  -1.866 -15.536  -3.084
  727   2HG   GLN  94          1HG       GLN  94  -0.950 -14.882  -1.726
  728   1HE2  GLN  94          1HE2      GLN  94  -3.905 -15.306  -1.874
  729   2HE2  GLN  94          2HE2      GLN  94  -4.603 -13.779  -1.628
  730    H    HIS  95           H        HIS  95   1.269 -13.134  -5.749
  731    HA   HIS  95           HA       HIS  95   1.276 -13.543  -8.098
  732   1HB   HIS  95          2HB       HIS  95   3.187 -15.165  -8.571
  733   2HB   HIS  95          1HB       HIS  95   3.571 -13.839  -7.478
  734    HD1  HIS  95           1HD      HIS  95   3.824 -14.416  -4.940
  735    HD2  HIS  95           2HD      HIS  95   3.223 -17.737  -7.384
  736    HE1  HIS  95           1HE      HIS  95   4.361 -16.444  -3.531
  737    H    ASN  96           H        ASN  96  -1.031 -14.525  -7.762
  738    HA   ASN  96           HA       ASN  96  -0.986 -17.331  -8.814
  739   1HB   ASN  96          2HB       ASN  96  -1.529 -17.116  -6.356
  740   2HB   ASN  96          1HB       ASN  96  -2.938 -16.158  -6.810
  741   1HD2  ASN  96          1HD2      ASN  96  -1.440 -19.328  -7.703
  742   2HD2  ASN  96          2HD2      ASN  96  -2.918 -20.153  -7.824
  743    H    SER  97           H        SER  97  -1.810 -17.157 -10.870
  744    HA   SER  97           HA       SER  97  -3.349 -14.983 -11.880
  745   1HB   SER  97          2HB       SER  97  -3.798 -16.642 -13.733
  746   2HB   SER  97          1HB       SER  97  -2.098 -16.505 -13.296
  747    HG   SER  97           HG       SER  97  -2.172 -18.439 -12.351
  748    H    ALA  98           H        ALA  98  -4.679 -18.285 -11.745
  749    HA   ALA  98           HA       ALA  98  -6.849 -19.044 -11.221
  750   1HB   ALA  98          1HB       ALA  98  -6.480 -18.689  -8.974
  751   2HB   ALA  98          2HB       ALA  98  -7.757 -17.495  -9.208
  752   3HB   ALA  98          3HB       ALA  98  -6.068 -16.990  -9.205
  753    H    GLY  99           H        GLY  99  -7.674 -15.721 -10.337
  754   1HA   GLY  99          2HA       GLY  99  -8.640 -14.707 -12.758
  755   2HA   GLY  99          1HA       GLY  99  -9.945 -15.706 -12.118
  756    H    LEU 100           H        LEU 100 -10.781 -15.157  -9.966
  757    HA   LEU 100           HA       LEU 100 -10.015 -12.545  -8.819
  758   1HB   LEU 100          2HB       LEU 100 -11.634 -12.319 -10.849
  759   2HB   LEU 100          1HB       LEU 100 -12.855 -12.959  -9.748
  760    HG   LEU 100           HG       LEU 100 -12.117 -11.133  -8.109
  761   1HD1  LEU 100          1HD1      LEU 100 -11.105  -9.131  -9.307
  762   2HD1  LEU 100          2HD1      LEU 100 -10.742 -10.219 -10.647
  763   3HD1  LEU 100          3HD1      LEU 100 -10.010 -10.492  -9.065
  764   1HD2  LEU 100          1HD2      LEU 100 -13.241 -10.050 -10.697
  765   2HD2  LEU 100          2HD2      LEU 100 -13.646  -9.574  -9.048
  766   3HD2  LEU 100          3HD2      LEU 100 -14.171 -11.139  -9.669
  767    H    ILE 101           H        ILE 101  -9.694 -14.750  -7.390
  768    HA   ILE 101           HA       ILE 101 -12.177 -15.124  -5.750
  769    HB   ILE 101           HB       ILE 101  -9.712 -16.852  -6.163
  770   1HG1  ILE 101          2HG1      ILE 101 -12.511 -17.617  -6.926
  771   2HG1  ILE 101          1HG1      ILE 101 -11.616 -16.523  -7.980
  772   1HG2  ILE 101          1HG2      ILE 101 -12.241 -17.306  -4.551
  773   2HG2  ILE 101          2HG2      ILE 101 -10.596 -17.192  -3.924
  774   3HG2  ILE 101          3HG2      ILE 101 -11.065 -18.566  -4.926
  775   1HD1  ILE 101          1HD1      ILE 101 -11.441 -19.155  -8.294
  776   2HD1  ILE 101          2HD1      ILE 101 -10.241 -18.999  -7.012
  777   3HD1  ILE 101          3HD1      ILE 101 -10.031 -18.123  -8.527
  778    H    SER 102           H        SER 102  -8.611 -15.206  -5.334
  779    HA   SER 102           HA       SER 102  -8.951 -13.590  -2.833
  780   1HB   SER 102          2HB       SER 102  -8.690 -16.163  -2.601
  781   2HB   SER 102          1HB       SER 102  -7.024 -15.900  -3.109
  782    HG   SER 102           HG       SER 102  -7.645 -15.816  -0.740
  783    H    ARG 103           H        ARG 103  -8.227 -12.231  -5.032
  784    HA   ARG 103           HA       ARG 103  -5.256 -11.918  -4.764
  785   1HB   ARG 103          2HB       ARG 103  -5.899 -13.102  -6.840
  786   2HB   ARG 103          1HB       ARG 103  -6.970 -11.766  -7.265
  787   1HG   ARG 103          2HG       ARG 103  -4.857 -11.503  -8.455
  788   2HG   ARG 103          1HG       ARG 103  -5.003 -10.229  -7.244
  789   1HD   ARG 103          2HD       ARG 103  -3.736 -12.631  -6.146
  790   2HD   ARG 103          1HD       ARG 103  -2.828 -11.948  -7.509
  791    HE   ARG 103           HE       ARG 103  -3.621 -10.401  -5.074
  792   1HH1  ARG 103          1HH2      ARG 103  -2.596  -9.877  -8.202
  793   2HH1  ARG 103          2HH2      ARG 103  -1.162  -9.001  -7.785
  794   1HH2  ARG 103          1HH1      ARG 103  -1.395  -9.703  -4.398
  795   2HH2  ARG 103          2HH1      ARG 103  -0.482  -8.903  -5.633
  796    H    LEU 104           H        LEU 104  -5.058  -9.961  -3.726
  797    HA   LEU 104           HA       LEU 104  -7.015  -7.802  -4.079
  798   1HB   LEU 104          2HB       LEU 104  -6.112  -7.991  -1.914
  799   2HB   LEU 104          1HB       LEU 104  -4.488  -8.311  -2.518
  800    HG   LEU 104           HG       LEU 104  -5.548  -5.692  -3.336
  801   1HD1  LEU 104          1HD1      LEU 104  -6.274  -6.351  -0.796
  802   2HD1  LEU 104          2HD1      LEU 104  -5.906  -4.707  -1.317
  803   3HD1  LEU 104          3HD1      LEU 104  -4.669  -5.675  -0.514
  804   1HD2  LEU 104          1HD2      LEU 104  -3.297  -5.762  -3.709
  805   2HD2  LEU 104          2HD2      LEU 104  -3.023  -6.958  -2.442
  806   3HD2  LEU 104          3HD2      LEU 104  -3.207  -5.254  -2.023
  807    H    LYS 105           H        LYS 105  -6.883  -6.344  -5.759
  808    HA   LYS 105           HA       LYS 105  -4.446  -5.033  -6.504
  809   1HB   LYS 105          2HB       LYS 105  -4.727  -7.642  -7.502
  810   2HB   LYS 105          1HB       LYS 105  -5.121  -6.594  -8.865
  811   1HG   LYS 105          2HG       LYS 105  -2.753  -5.856  -7.210
  812   2HG   LYS 105          1HG       LYS 105  -2.593  -7.246  -8.284
  813   1HD   LYS 105          2HD       LYS 105  -3.030  -5.957 -10.213
  814   2HD   LYS 105          1HD       LYS 105  -3.739  -4.641  -9.278
  815   1HE   LYS 105          2HE       LYS 105  -1.552  -3.874  -9.902
  816   2HE   LYS 105          1HE       LYS 105  -1.400  -4.377  -8.206
  817   1HZ   LYS 105          1HZ       LYS 105  -0.581  -6.492  -8.869
  818   2HZ   LYS 105          2HZ       LYS 105   0.325  -5.331  -9.716
  819   3HZ   LYS 105          3HZ       LYS 105  -0.910  -6.190 -10.505
  820    H    TYR 106           H        TYR 106  -6.343  -3.461  -6.147
  821    HA   TYR 106           HA       TYR 106  -7.899  -3.141  -8.698
  822   1HB   TYR 106          2HB       TYR 106  -9.320  -3.481  -6.731
  823   2HB   TYR 106          1HB       TYR 106  -8.465  -2.206  -5.865
  824    HD1  TYR 106           1HD      TYR 106 -10.959  -2.951  -8.440
  825    HD2  TYR 106           2HD      TYR 106  -8.662   0.157  -6.569
  826    HE1  TYR 106           1HE      TYR 106 -12.441  -1.241  -9.456
  827    HE2  TYR 106           2HE      TYR 106 -10.141   1.866  -7.585
  828    HH   TYR 106           HH       TYR 106 -12.162   1.284 -10.104
  829    HA   PRO 107           HA       PRO 107  -4.826   0.181  -8.971
  830   1HB   PRO 107          2HB       PRO 107  -5.941   0.831 -11.534
  831   2HB   PRO 107          1HB       PRO 107  -4.412   0.022 -11.179
  832   1HG   PRO 107          2HG       PRO 107  -6.791  -1.135 -12.282
  833   2HG   PRO 107          1HG       PRO 107  -5.269  -1.945 -11.901
  834   1HD   PRO 107          2HD       PRO 107  -7.794  -2.157 -10.508
  835   2HD   PRO 107          1HD       PRO 107  -6.267  -2.997 -10.144
  836    H    VAL 108           H        VAL 108  -5.539   1.800  -7.604
  837    HA   VAL 108           HA       VAL 108  -7.720   3.578  -8.622
  838    HB   VAL 108           HB       VAL 108  -8.230   2.045  -6.622
  839   1HG1  VAL 108          1HG1      VAL 108  -7.271   2.528  -4.511
  840   2HG1  VAL 108          2HG1      VAL 108  -6.577   4.044  -5.086
  841   3HG1  VAL 108          3HG1      VAL 108  -5.904   2.506  -5.625
  842   1HG2  VAL 108          1HG2      VAL 108  -9.556   4.056  -7.144
  843   2HG2  VAL 108          2HG2      VAL 108  -8.410   5.050  -6.246
  844   3HG2  VAL 108          3HG2      VAL 108  -9.394   3.856  -5.399
  845    H    SER 109           H        SER 109  -7.260   5.887  -8.238
  846    HA   SER 109           HA       SER 109  -4.363   6.387  -7.732
  847   1HB   SER 109          2HB       SER 109  -6.573   7.793  -9.221
  848   2HB   SER 109          1HB       SER 109  -5.086   8.642  -8.808
  849    HG   SER 109           HG       SER 109  -4.992   7.627 -10.871
  850    H    GLN 110           H        GLN 110  -7.048   8.676  -7.386
  851    HA   GLN 110           HA       GLN 110  -6.449   8.912  -4.498
  852   1HB   GLN 110          2HB       GLN 110  -6.624  11.281  -6.359
  853   2HB   GLN 110          1HB       GLN 110  -5.944  11.229  -4.734
  854   1HG   GLN 110          2HG       GLN 110  -4.253   9.530  -5.702
  855   2HG   GLN 110          1HG       GLN 110  -4.793  10.093  -7.283
  856   1HE2  GLN 110          1HE2      GLN 110  -2.241  10.701  -7.024
  857   2HE2  GLN 110          2HE2      GLN 110  -1.967  12.300  -6.523
  858    H    GLN 111           H        GLN 111  -8.040  11.519  -4.640
  859    HA   GLN 111           HA       GLN 111 -10.631  10.424  -4.055
  860   1HB   GLN 111          2HB       GLN 111 -11.220  12.841  -3.869
  861   2HB   GLN 111          1HB       GLN 111  -9.720  12.452  -3.020
  862   1HG   GLN 111          2HG       GLN 111  -8.407  13.594  -4.531
  863   2HG   GLN 111          1HG       GLN 111  -9.496  13.277  -5.881
  864   1HE2  GLN 111          1HE2      GLN 111  -9.872  15.448  -6.560
  865   2HE2  GLN 111          2HE2      GLN 111 -10.600  16.618  -5.570
  866    H    ASN 112           H        ASN 112 -10.382   9.351  -6.454
  867    HA   ASN 112           HA       ASN 112 -12.064  11.016  -8.248
  868   1HB   ASN 112          2HB       ASN 112  -9.652  10.901  -8.920
  869   2HB   ASN 112          1HB       ASN 112  -9.810   9.147  -9.028
  870   1HD2  ASN 112          1HD2      ASN 112  -9.382   9.248 -11.378
  871   2HD2  ASN 112          2HD2      ASN 112 -10.580   9.792 -12.450
  872    H    LYS 113           H        LYS 113 -11.112   7.810  -7.120
  873    HA   LYS 113           HA       LYS 113 -12.233   5.736  -7.190
  874   1HB   LYS 113          2HB       LYS 113 -14.678   7.487  -7.565
  875   2HB   LYS 113          1HB       LYS 113 -14.586   5.929  -6.747
  876   1HG   LYS 113          2HG       LYS 113 -13.300   8.519  -5.828
  877   2HG   LYS 113          1HG       LYS 113 -14.679   7.715  -5.082
  878   1HD   LYS 113          2HD       LYS 113 -13.259   6.514  -3.816
  879   2HD   LYS 113          1HD       LYS 113 -12.618   5.770  -5.277
  880   1HE   LYS 113          2HE       LYS 113 -11.468   8.367  -5.143
  881   2HE   LYS 113          1HE       LYS 113 -11.323   7.659  -3.525
  882   1HZ   LYS 113          1HZ       LYS 113  -9.540   7.035  -5.206
  883   2HZ   LYS 113          2HZ       LYS 113 -10.733   6.099  -5.971
  884   3HZ   LYS 113          3HZ       LYS 113 -10.280   5.760  -4.368
  885    H    ASN 114           H        ASN 114 -14.387   4.808  -8.616
  886    HA   ASN 114           HA       ASN 114 -14.373   5.695 -11.392
  887   1HB   ASN 114          2HB       ASN 114 -12.365   3.883 -10.406
  888   2HB   ASN 114          1HB       ASN 114 -13.372   3.055 -11.591
  889   1HD2  ASN 114          1HD2      ASN 114 -11.453   3.126 -13.075
  890   2HD2  ASN 114          2HD2      ASN 114 -11.098   4.561 -13.910
  891    H    ALA 115           H        ALA 115 -14.855   2.827  -9.305
  892    HA   ALA 115           HA       ALA 115 -16.652   1.295  -9.195
  893   1HB   ALA 115          1HB       ALA 115 -17.616   3.522  -8.487
  894   2HB   ALA 115          2HB       ALA 115 -18.805   2.410  -9.163
  895   3HB   ALA 115          3HB       ALA 115 -18.181   3.737 -10.144
  896    HA   PRO 116           HA       PRO 116 -16.467   0.914 -13.901
  897   1HB   PRO 116          2HB       PRO 116 -15.517  -1.766 -13.450
  898   2HB   PRO 116          1HB       PRO 116 -14.645  -0.409 -14.171
  899   1HG   PRO 116          2HG       PRO 116 -14.239  -1.592 -11.586
  900   2HG   PRO 116          1HG       PRO 116 -13.364  -0.241 -12.314
  901   1HD   PRO 116          2HD       PRO 116 -15.256  -0.150 -10.141
  902   2HD   PRO 116          1HD       PRO 116 -14.396   1.214 -10.894
  903    H    SER 117           H        SER 117 -17.424  -1.365 -11.335
  904    HA   SER 117           HA       SER 117 -19.327  -2.831 -12.962
  905   1HB   SER 117          2HB       SER 117 -19.880  -3.859 -10.840
  906   2HB   SER 117          1HB       SER 117 -18.141  -3.589 -10.861
  907    HG   SER 117           HG       SER 117 -18.453  -2.454  -9.131
  908    H    THR 118           H        THR 118 -21.172  -1.879 -13.732
  909    HA   THR 118           HA       THR 118 -23.119  -0.541 -13.814
  910    HB   THR 118           HB       THR 118 -22.977  -0.787 -10.800
  911    HG1  THR 118           1HG      THR 118 -24.001  -2.822 -11.165
  912   1HG2  THR 118          1HG2      THR 118 -24.960   0.277 -11.100
  913   2HG2  THR 118          2HG2      THR 118 -25.541  -1.307 -11.612
  914   3HG2  THR 118          3HG2      THR 118 -25.025  -0.126 -12.815
  Start of MODEL   13
    1    H    THR   1           1H       THR   1  14.343 -10.353 -10.765
    2    HA   THR   1           HA       THR   1  15.032  -8.983  -8.770
    3    HB   THR   1           HB       THR   1  16.954  -7.414  -9.464
    4    HG1  THR   1           1HG      THR   1  18.191  -8.065 -11.133
    5   1HG2  THR   1          1HG2      THR   1  17.445 -10.371  -9.030
    6   2HG2  THR   1          2HG2      THR   1  17.258  -9.142  -7.779
    7   3HG2  THR   1          3HG2      THR   1  18.670  -9.117  -8.836
    8    H    GLU   2           H        GLU   2  15.116  -8.412 -12.284
    9    HA   GLU   2           HA       GLU   2  13.988  -6.818 -13.616
   10   1HB   GLU   2          2HB       GLU   2  12.248  -8.131 -11.978
   11   2HB   GLU   2          1HB       GLU   2  11.923  -6.460 -11.518
   12   1HG   GLU   2          2HG       GLU   2  11.062  -5.914 -13.573
   13   2HG   GLU   2          1HG       GLU   2  12.143  -7.013 -14.432
   14    H    ALA   3           H        ALA   3  12.351  -4.628 -12.715
   15    HA   ALA   3           HA       ALA   3  13.989  -3.009 -10.867
   16   1HB   ALA   3          1HB       ALA   3  13.751  -2.487 -13.845
   17   2HB   ALA   3          2HB       ALA   3  15.229  -2.816 -12.942
   18   3HB   ALA   3          3HB       ALA   3  14.363  -1.300 -12.693
   19    H    GLU   4           H        GLU   4  13.021  -0.540 -11.297
   20    HA   GLU   4           HA       GLU   4  10.198  -0.409 -11.956
   21   1HB   GLU   4          2HB       GLU   4   9.480  -0.098  -9.544
   22   2HB   GLU   4          1HB       GLU   4   9.992  -1.739  -9.940
   23   1HG   GLU   4          2HG       GLU   4  11.927  -1.589  -8.701
   24   2HG   GLU   4          1HG       GLU   4  12.096   0.145  -8.977
   25    H    ASP   5           H        ASP   5  11.948   1.308 -12.913
   26    HA   ASP   5           HA       ASP   5  11.833   3.726 -11.138
   27   1HB   ASP   5          2HB       ASP   5  13.910   4.403 -12.312
   28   2HB   ASP   5          1HB       ASP   5  14.101   2.830 -11.539
   29    H    SER   6           H        SER   6   9.833   2.722 -13.164
   30    HA   SER   6           HA       SER   6  10.023   4.886 -15.223
   31   1HB   SER   6          2HB       SER   6   8.466   2.292 -15.024
   32   2HB   SER   6          1HB       SER   6   8.278   3.439 -16.346
   33    HG   SER   6           HG       SER   6  10.481   1.839 -15.640
   34    H    ILE   7           H        ILE   7   7.817   5.844 -15.810
   35    HA   ILE   7           HA       ILE   7   6.279   6.392 -13.303
   36    HB   ILE   7           HB       ILE   7   7.474   8.264 -14.379
   37   1HG1  ILE   7          2HG1      ILE   7   4.516   8.581 -14.928
   38   2HG1  ILE   7          1HG1      ILE   7   5.162   8.517 -13.288
   39   1HG2  ILE   7          1HG2      ILE   7   6.040   8.815 -16.688
   40   2HG2  ILE   7          2HG2      ILE   7   6.276   7.070 -16.773
   41   3HG2  ILE   7          3HG2      ILE   7   7.668   8.142 -16.629
   42   1HD1  ILE   7          1HD1      ILE   7   5.760  10.680 -13.415
   43   2HD1  ILE   7          2HD1      ILE   7   5.054  10.765 -15.029
   44   3HD1  ILE   7          3HD1      ILE   7   6.754  10.341 -14.832
   45    H    GLU   8           H        GLU   8   6.049   4.939 -16.427
   46    HA   GLU   8           HA       GLU   8   3.246   5.338 -16.932
   47   1HB   GLU   8          2HB       GLU   8   5.257   3.240 -17.798
   48   2HB   GLU   8          1HB       GLU   8   3.651   3.419 -18.509
   49   1HG   GLU   8          2HG       GLU   8   4.283   5.858 -18.960
   50   2HG   GLU   8          1HG       GLU   8   5.939   5.394 -18.567
   51    H    MET   9           H        MET   9   1.520   4.302 -15.990
   52    HA   MET   9           HA       MET   9   1.656   1.578 -15.029
   53   1HB   MET   9          2HB       MET   9   1.147   2.383 -12.611
   54   2HB   MET   9          1HB       MET   9   2.815   2.456 -13.170
   55   1HG   MET   9          2HG       MET   9   2.463   4.566 -12.171
   56   2HG   MET   9          1HG       MET   9   2.257   4.885 -13.890
   57   1HE   MET   9          1HE       MET   9  -0.998   6.367 -14.277
   58   2HE   MET   9          2HE       MET   9   0.214   5.375 -15.082
   59   3HE   MET   9          3HE       MET   9   0.715   6.794 -14.168
   60    H    TYR  10           H        TYR  10  -0.480   1.421 -13.383
   61    HA   TYR  10           HA       TYR  10  -2.695   2.350 -15.092
   62   1HB   TYR  10          2HB       TYR  10  -2.406   0.363 -12.830
   63   2HB   TYR  10          1HB       TYR  10  -3.949   0.707 -13.611
   64    HD1  TYR  10           1HD      TYR  10  -0.682  -0.902 -13.952
   65    HD2  TYR  10           2HD      TYR  10  -4.296   0.175 -16.010
   66    HE1  TYR  10           1HE      TYR  10  -0.102  -2.465 -15.787
   67    HE2  TYR  10           2HE      TYR  10  -3.716  -1.389 -17.845
   68    HH   TYR  10           HH       TYR  10  -0.605  -2.827 -18.119
   69    H    GLU  11           H        GLU  11  -2.638   1.878 -11.563
   70    HA   GLU  11           HA       GLU  11  -3.300   4.747 -11.125
   71   1HB   GLU  11          2HB       GLU  11  -5.333   3.063 -11.568
   72   2HB   GLU  11          1HB       GLU  11  -5.050   2.667  -9.875
   73   1HG   GLU  11          2HG       GLU  11  -6.670   4.422  -9.906
   74   2HG   GLU  11          1HG       GLU  11  -5.146   5.137  -9.376
   75    H    TRP  12           H        TRP  12  -2.968   1.534  -9.629
   76    HA   TRP  12           HA       TRP  12  -2.665   2.080  -6.961
   77   1HB   TRP  12          2HB       TRP  12  -1.147   0.109  -6.940
   78   2HB   TRP  12          1HB       TRP  12  -2.580  -0.142  -7.937
   79    HD1  TRP  12           HD       TRP  12  -2.263  -0.258 -10.558
   80    HE1  TRP  12           1HE      TRP  12  -0.185  -0.588 -12.048
   81    HE3  TRP  12           3HE      TRP  12   1.422   0.630  -7.138
   82    HZ2  TRP  12           2HZ      TRP  12   2.665  -0.488 -11.818
   83    HZ3  TRP  12           3HZ      TRP  12   3.807   0.506  -7.798
   84    HH2  TRP  12           HH       TRP  12   4.433  -0.051 -10.132
   85    H    TYR  13           H        TYR  13  -0.399   2.983  -9.478
   86    HA   TYR  13           HA       TYR  13   1.795   3.487  -7.585
   87   1HB   TYR  13          2HB       TYR  13   1.952   2.799 -10.044
   88   2HB   TYR  13          1HB       TYR  13   1.506   4.461 -10.434
   89    HD1  TYR  13           1HD      TYR  13   3.783   2.761  -7.979
   90    HD2  TYR  13           2HD      TYR  13   3.306   5.854 -10.921
   91    HE1  TYR  13           1HE      TYR  13   6.121   3.489  -7.590
   92    HE2  TYR  13           2HE      TYR  13   5.645   6.580 -10.535
   93    HH   TYR  13           HH       TYR  13   7.917   4.759  -9.082
   94    H    SER  14           H        SER  14   2.231   5.418  -6.577
   95    HA   SER  14           HA       SER  14   0.917   7.910  -7.541
   96   1HB   SER  14          2HB       SER  14   0.768   7.003  -4.662
   97   2HB   SER  14          1HB       SER  14  -0.147   8.291  -5.441
   98    HG   SER  14           HG       SER  14  -1.437   6.459  -5.272
   99    H    LYS  15           H        LYS  15   2.324   9.604  -7.350
  100    HA   LYS  15           HA       LYS  15   4.946   9.174  -6.110
  101   1HB   LYS  15          2HB       LYS  15   3.680  10.860  -8.101
  102   2HB   LYS  15          1HB       LYS  15   4.647  11.834  -6.994
  103   1HG   LYS  15          2HG       LYS  15   5.929  10.959  -8.985
  104   2HG   LYS  15          1HG       LYS  15   6.615  10.501  -7.426
  105   1HD   LYS  15          2HD       LYS  15   4.619   8.577  -8.359
  106   2HD   LYS  15          1HD       LYS  15   5.957   8.754  -9.495
  107   1HE   LYS  15          2HE       LYS  15   7.342   7.598  -8.124
  108   2HE   LYS  15          1HE       LYS  15   6.942   8.652  -6.757
  109   1HZ   LYS  15          1HZ       LYS  15   5.232   7.324  -6.099
  110   2HZ   LYS  15          2HZ       LYS  15   6.209   6.129  -6.807
  111   3HZ   LYS  15          3HZ       LYS  15   4.890   6.770  -7.665
  112    H    HIS  16           H        HIS  16   5.184   9.501  -3.970
  113    HA   HIS  16           HA       HIS  16   5.043  10.481  -1.842
  114   1HB   HIS  16          2HB       HIS  16   4.288  12.830  -3.606
  115   2HB   HIS  16          1HB       HIS  16   4.759  12.955  -1.912
  116    HD1  HIS  16           1HD      HIS  16   6.153  12.904  -5.268
  117    HD2  HIS  16           2HD      HIS  16   7.516  11.870  -1.467
  118    HE1  HIS  16           1HE      HIS  16   8.678  12.772  -5.423
  119    H    MET  17           H        MET  17   2.721   9.019  -2.644
  120    HA   MET  17           HA       MET  17   0.338  10.631  -2.058
  121   1HB   MET  17          2HB       MET  17   0.345   8.692  -3.587
  122   2HB   MET  17          1HB       MET  17   0.825   7.639  -2.256
  123   1HG   MET  17          2HG       MET  17  -1.383   8.894  -1.205
  124   2HG   MET  17          1HG       MET  17  -1.825   8.760  -2.906
  125   1HE   MET  17          1HE       MET  17   0.414   6.741  -0.543
  126   2HE   MET  17          2HE       MET  17  -0.544   5.318  -0.144
  127   3HE   MET  17          3HE       MET  17  -1.053   6.905   0.432
  128    H    THR  18           H        THR  18  -0.274  11.137   0.001
  129    HA   THR  18           HA       THR  18   1.112  10.231   2.341
  130    HB   THR  18           HB       THR  18  -1.680  11.377   2.241
  131    HG1  THR  18           1HG      THR  18  -0.746  13.362   1.876
  132   1HG2  THR  18          1HG2      THR  18  -0.469  12.732   4.157
  133   2HG2  THR  18          2HG2      THR  18   0.627  11.351   4.150
  134   3HG2  THR  18          3HG2      THR  18  -1.091  11.111   4.469
  135    H    ARG  19           H        ARG  19   0.620   8.627   3.817
  136    HA   ARG  19           HA       ARG  19  -0.780   6.280   3.112
  137   1HB   ARG  19          2HB       ARG  19  -0.565   5.780   5.513
  138   2HB   ARG  19          1HB       ARG  19   0.892   6.595   4.946
  139   1HG   ARG  19          2HG       ARG  19  -0.208   8.787   5.718
  140   2HG   ARG  19          1HG       ARG  19  -1.395   7.780   6.551
  141   1HD   ARG  19          2HD       ARG  19   0.856   6.582   7.443
  142   2HD   ARG  19          1HD       ARG  19   1.488   8.220   7.187
  143    HE   ARG  19           HE       ARG  19  -0.493   7.463   9.187
  144   1HH1  ARG  19          1HH1      ARG  19   1.662   9.802   8.672
  145   2HH1  ARG  19          2HH1      ARG  19   0.619  11.158   8.939
  146   1HH2  ARG  19          1HH2      ARG  19  -2.290   9.272   8.857
  147   2HH2  ARG  19          2HH2      ARG  19  -1.620  10.857   9.045
  148    H    SER  20           H        SER  20  -1.852   9.106   4.931
  149    HA   SER  20           HA       SER  20  -4.465   8.144   5.615
  150   1HB   SER  20          2HB       SER  20  -4.023   9.946   6.908
  151   2HB   SER  20          1HB       SER  20  -2.766  10.499   5.810
  152    HG   SER  20           HG       SER  20  -4.227  12.041   5.539
  153    H    GLN  21           H        GLN  21  -3.183  10.032   2.878
  154    HA   GLN  21           HA       GLN  21  -5.667  10.664   1.625
  155   1HB   GLN  21          2HB       GLN  21  -2.826  10.217   0.698
  156   2HB   GLN  21          1HB       GLN  21  -4.100  10.641  -0.447
  157   1HG   GLN  21          2HG       GLN  21  -3.964  12.298   2.011
  158   2HG   GLN  21          1HG       GLN  21  -2.628  12.491   0.877
  159   1HE2  GLN  21          1HE2      GLN  21  -6.010  11.696   0.016
  160   2HE2  GLN  21          2HE2      GLN  21  -6.288  13.120  -0.865
  161    H    ALA  22           H        ALA  22  -3.513   7.831   1.314
  162    HA   ALA  22           HA       ALA  22  -5.020   6.439  -0.665
  163   1HB   ALA  22          1HB       ALA  22  -3.201   5.122  -0.355
  164   2HB   ALA  22          2HB       ALA  22  -3.868   4.602   1.192
  165   3HB   ALA  22          3HB       ALA  22  -2.801   6.004   1.118
  166    H    GLU  23           H        GLU  23  -5.158   6.310   2.898
  167    HA   GLU  23           HA       GLU  23  -7.217   4.408   3.213
  168   1HB   GLU  23          2HB       GLU  23  -6.480   6.923   4.739
  169   2HB   GLU  23          1HB       GLU  23  -7.651   5.750   5.341
  170   1HG   GLU  23          2HG       GLU  23  -5.822   3.986   5.007
  171   2HG   GLU  23          1HG       GLU  23  -4.708   5.339   4.813
  172    H    GLN  24           H        GLN  24  -7.599   7.984   3.042
  173    HA   GLN  24           HA       GLN  24 -10.447   7.894   3.004
  174   1HB   GLN  24          2HB       GLN  24 -10.227  10.255   2.245
  175   2HB   GLN  24          1HB       GLN  24  -9.181   9.886   3.612
  176   1HG   GLN  24          2HG       GLN  24  -7.284   9.567   2.045
  177   2HG   GLN  24          1HG       GLN  24  -8.340  10.004   0.702
  178   1HE2  GLN  24          1HE2      GLN  24  -8.696  12.229   0.315
  179   2HE2  GLN  24          2HE2      GLN  24  -8.087  13.467   1.304
  180    H    LEU  25           H        LEU  25  -8.132   8.224   0.222
  181    HA   LEU  25           HA       LEU  25 -10.300   8.190  -1.687
  182   1HB   LEU  25          2HB       LEU  25  -8.480   7.821  -3.335
  183   2HB   LEU  25          1HB       LEU  25  -8.081   9.111  -2.207
  184    HG   LEU  25           HG       LEU  25  -7.011   7.070  -0.853
  185   1HD1  LEU  25          1HD1      LEU  25  -5.991   6.010  -3.304
  186   2HD1  LEU  25          2HD1      LEU  25  -7.751   5.909  -3.348
  187   3HD1  LEU  25          3HD1      LEU  25  -6.857   5.166  -2.025
  188   1HD2  LEU  25          1HD2      LEU  25  -5.042   8.093  -1.410
  189   2HD2  LEU  25          2HD2      LEU  25  -6.067   9.206  -2.311
  190   3HD2  LEU  25          3HD2      LEU  25  -5.301   7.847  -3.133
  191    H    LEU  26           H        LEU  26  -8.744   5.701   0.148
  192    HA   LEU  26           HA       LEU  26  -9.522   3.529  -1.679
  193   1HB   LEU  26          2HB       LEU  26  -8.188   3.882   0.975
  194   2HB   LEU  26          1HB       LEU  26  -8.976   2.342   0.692
  195    HG   LEU  26           HG       LEU  26  -6.977   3.566  -1.224
  196   1HD1  LEU  26          1HD1      LEU  26  -6.427   2.492   1.298
  197   2HD1  LEU  26          2HD1      LEU  26  -5.276   2.694  -0.020
  198   3HD1  LEU  26          3HD1      LEU  26  -6.120   1.160   0.184
  199   1HD2  LEU  26          1HD2      LEU  26  -8.821   1.700  -1.795
  200   2HD2  LEU  26          2HD2      LEU  26  -7.595   0.649  -1.086
  201   3HD2  LEU  26          3HD2      LEU  26  -7.199   1.646  -2.484
  202    H    LYS  27           H        LYS  27 -10.480   4.502   1.645
  203    HA   LYS  27           HA       LYS  27 -12.844   2.911   1.806
  204   1HB   LYS  27          2HB       LYS  27 -11.405   4.818   3.316
  205   2HB   LYS  27          1HB       LYS  27 -13.047   5.448   3.188
  206   1HG   LYS  27          2HG       LYS  27 -12.837   2.550   3.778
  207   2HG   LYS  27          1HG       LYS  27 -12.286   3.629   5.060
  208   1HD   LYS  27          2HD       LYS  27 -14.556   4.901   4.429
  209   2HD   LYS  27          1HD       LYS  27 -15.021   3.276   3.924
  210   1HE   LYS  27          2HE       LYS  27 -13.964   2.629   6.298
  211   2HE   LYS  27          1HE       LYS  27 -14.421   4.302   6.668
  212   1HZ   LYS  27          1HZ       LYS  27 -16.234   2.366   5.338
  213   2HZ   LYS  27          2HZ       LYS  27 -16.631   3.903   5.943
  214   3HZ   LYS  27          3HZ       LYS  27 -16.239   2.642   7.011
  215    H    GLN  28           H        GLN  28 -12.303   6.201   0.583
  216    HA   GLN  28           HA       GLN  28 -15.051   6.917   0.198
  217   1HB   GLN  28          2HB       GLN  28 -13.098   8.451   0.263
  218   2HB   GLN  28          1HB       GLN  28 -12.563   7.806  -1.290
  219   1HG   GLN  28          2HG       GLN  28 -13.777   9.586  -2.081
  220   2HG   GLN  28          1HG       GLN  28 -15.099   8.427  -1.945
  221   1HE2  GLN  28          1HE2      GLN  28 -16.859   9.579  -1.119
  222   2HE2  GLN  28          2HE2      GLN  28 -16.792  10.621   0.219
  223    H    GLU  29           H        GLU  29 -12.695   5.386  -2.063
  224    HA   GLU  29           HA       GLU  29 -14.455   5.432  -4.335
  225   1HB   GLU  29          2HB       GLU  29 -11.926   5.017  -4.181
  226   2HB   GLU  29          1HB       GLU  29 -12.326   3.368  -3.720
  227   1HG   GLU  29          2HG       GLU  29 -11.867   3.754  -6.205
  228   2HG   GLU  29          1HG       GLU  29 -13.373   2.929  -5.826
  229    H    GLY  30           H        GLY  30 -13.991   3.111  -1.694
  230   1HA   GLY  30          2HA       GLY  30 -15.623   1.645  -0.827
  231   2HA   GLY  30          1HA       GLY  30 -16.661   2.086  -2.175
  232    H    LYS  31           H        LYS  31 -13.370   0.822  -2.500
  233    HA   LYS  31           HA       LYS  31 -14.477  -1.468  -4.062
  234   1HB   LYS  31          2HB       LYS  31 -11.589  -0.613  -3.695
  235   2HB   LYS  31          1HB       LYS  31 -12.264  -1.584  -5.000
  236   1HG   LYS  31          2HG       LYS  31 -12.849   1.346  -4.463
  237   2HG   LYS  31          1HG       LYS  31 -11.880   0.704  -5.789
  238   1HD   LYS  31          2HD       LYS  31 -14.813   0.074  -5.339
  239   2HD   LYS  31          1HD       LYS  31 -14.209   1.265  -6.490
  240   1HE   LYS  31          2HE       LYS  31 -13.829  -0.359  -8.021
  241   2HE   LYS  31          1HE       LYS  31 -12.817  -1.250  -6.866
  242   1HZ   LYS  31          1HZ       LYS  31 -14.702  -2.260  -5.906
  243   2HZ   LYS  31          2HZ       LYS  31 -14.924  -2.406  -7.585
  244   3HZ   LYS  31          3HZ       LYS  31 -15.778  -1.225  -6.711
  245    H    GLU  32           H        GLU  32 -13.180  -3.609  -3.708
  246    HA   GLU  32           HA       GLU  32 -12.609  -3.931  -0.786
  247   1HB   GLU  32          2HB       GLU  32 -13.346  -6.353  -1.270
  248   2HB   GLU  32          1HB       GLU  32 -14.592  -5.113  -1.159
  249   1HG   GLU  32          2HG       GLU  32 -14.731  -4.947  -3.578
  250   2HG   GLU  32          1HG       GLU  32 -13.339  -6.013  -3.771
  251    H    GLY  33           H        GLY  33 -10.357  -3.645  -1.064
  252   1HA   GLY  33          2HA       GLY  33  -8.361  -5.070  -1.047
  253   2HA   GLY  33          1HA       GLY  33  -9.023  -5.886  -2.463
  254    H    GLY  34           H        GLY  34  -9.225  -2.394  -2.193
  255   1HA   GLY  34          2HA       GLY  34  -8.003  -1.952  -4.722
  256   2HA   GLY  34          1HA       GLY  34  -8.211  -0.711  -3.482
  257    H    PHE  35           H        PHE  35  -5.868  -1.225  -5.243
  258    HA   PHE  35           HA       PHE  35  -3.848  -1.688  -3.067
  259   1HB   PHE  35          2HB       PHE  35  -4.194  -3.583  -4.669
  260   2HB   PHE  35          1HB       PHE  35  -3.700  -2.513  -5.978
  261    HD1  PHE  35           1HD      PHE  35  -1.385  -1.623  -6.068
  262    HD2  PHE  35           2HD      PHE  35  -2.597  -4.501  -3.121
  263    HE1  PHE  35           1HE      PHE  35   0.993  -2.145  -5.599
  264    HE2  PHE  35           2HE      PHE  35  -0.219  -5.020  -2.649
  265    HZ   PHE  35           HZ       PHE  35   1.577  -3.842  -3.888
  266    H    ILE  36           H        ILE  36  -2.544   0.068  -2.798
  267    HA   ILE  36           HA       ILE  36  -1.915   1.768  -5.190
  268    HB   ILE  36           HB       ILE  36  -2.409   2.722  -2.346
  269   1HG1  ILE  36          2HG1      ILE  36  -4.250   2.864  -4.757
  270   2HG1  ILE  36          1HG1      ILE  36  -4.490   1.820  -3.356
  271   1HG2  ILE  36          1HG2      ILE  36  -1.886   4.075  -4.993
  272   2HG2  ILE  36          2HG2      ILE  36  -1.030   4.286  -3.465
  273   3HG2  ILE  36          3HG2      ILE  36  -2.659   4.931  -3.660
  274   1HD1  ILE  36          1HD1      ILE  36  -5.828   3.915  -3.202
  275   2HD1  ILE  36          2HD1      ILE  36  -4.335   4.854  -3.250
  276   3HD1  ILE  36          3HD1      ILE  36  -4.660   3.782  -1.888
  277    H    VAL  37           H        VAL  37   0.182   2.930  -4.915
  278    HA   VAL  37           HA       VAL  37   1.951   1.959  -2.747
  279    HB   VAL  37           HB       VAL  37   2.488   1.521  -5.702
  280   1HG1  VAL  37          1HG1      VAL  37   4.541   0.467  -5.001
  281   2HG1  VAL  37          2HG1      VAL  37   4.089   0.592  -3.301
  282   3HG1  VAL  37          3HG1      VAL  37   4.478   2.047  -4.219
  283   1HG2  VAL  37          1HG2      VAL  37   2.453  -0.918  -4.938
  284   2HG2  VAL  37          2HG2      VAL  37   0.887  -0.110  -4.980
  285   3HG2  VAL  37          3HG2      VAL  37   1.717  -0.342  -3.442
  286    H    ARG  38           H        ARG  38   3.737   3.367  -2.407
  287    HA   ARG  38           HA       ARG  38   4.179   5.585  -4.335
  288   1HB   ARG  38          2HB       ARG  38   3.841   7.251  -2.492
  289   2HB   ARG  38          1HB       ARG  38   2.368   6.371  -2.895
  290   1HG   ARG  38          2HG       ARG  38   2.317   6.152  -0.595
  291   2HG   ARG  38          1HG       ARG  38   3.269   4.722  -0.995
  292   1HD   ARG  38          2HD       ARG  38   4.842   5.573   0.414
  293   2HD   ARG  38          1HD       ARG  38   5.172   6.761  -0.862
  294    HE   ARG  38           HE       ARG  38   3.458   8.232   0.212
  295   1HH1  ARG  38          1HH2      ARG  38   5.724   6.703   2.052
  296   2HH1  ARG  38          2HH2      ARG  38   4.880   6.821   3.560
  297   1HH2  ARG  38          1HH1      ARG  38   1.912   7.888   2.120
  298   2HH2  ARG  38          2HH1      ARG  38   2.722   7.492   3.598
  299    H    ASP  39           H        ASP  39   6.128   6.868  -3.725
  300    HA   ASP  39           HA       ASP  39   8.262   5.131  -2.728
  301   1HB   ASP  39          2HB       ASP  39   8.275   6.849  -4.649
  302   2HB   ASP  39          1HB       ASP  39   8.407   8.078  -3.390
  303    H    SER  40           H        SER  40   9.507   5.474  -0.835
  304    HA   SER  40           HA       SER  40   8.140   7.003   1.316
  305   1HB   SER  40          2HB       SER  40   9.066   4.522   1.275
  306   2HB   SER  40          1HB       SER  40  10.596   5.307   1.654
  307    HG   SER  40           HG       SER  40   8.155   5.387   3.093
  308    H    SER  41           H        SER  41  10.769   7.158   2.798
  309    HA   SER  41           HA       SER  41  12.323   9.119   1.205
  310   1HB   SER  41          2HB       SER  41  10.322   9.729   3.269
  311   2HB   SER  41          1HB       SER  41  11.882  10.489   3.569
  312    HG   SER  41           HG       SER  41  11.770  11.204   1.337
  313    H    LYS  42           H        LYS  42  11.850   7.867   4.541
  314    HA   LYS  42           HA       LYS  42  14.479   8.241   5.504
  315   1HB   LYS  42          2HB       LYS  42  12.433   6.060   6.026
  316   2HB   LYS  42          1HB       LYS  42  13.836   6.367   7.050
  317   1HG   LYS  42          2HG       LYS  42  13.022   8.730   7.337
  318   2HG   LYS  42          1HG       LYS  42  11.550   8.271   6.478
  319   1HD   LYS  42          2HD       LYS  42  12.383   6.532   8.748
  320   2HD   LYS  42          1HD       LYS  42  11.744   8.125   9.154
  321   1HE   LYS  42          2HE       LYS  42   9.701   7.108   8.977
  322   2HE   LYS  42          1HE       LYS  42   9.958   7.260   7.227
  323   1HZ   LYS  42          1HZ       LYS  42  11.035   5.005   8.823
  324   2HZ   LYS  42          2HZ       LYS  42  10.942   5.132   7.132
  325   3HZ   LYS  42          3HZ       LYS  42   9.527   4.936   8.051
  326    H    ALA  43           H        ALA  43  13.214   5.057   4.473
  327    HA   ALA  43           HA       ALA  43  15.955   4.138   3.839
  328   1HB   ALA  43          1HB       ALA  43  13.539   3.021   4.755
  329   2HB   ALA  43          2HB       ALA  43  15.007   2.136   4.339
  330   3HB   ALA  43          3HB       ALA  43  13.748   2.373   3.128
  331    H    GLY  44           H        GLY  44  13.299   5.564   2.208
  332   1HA   GLY  44          2HA       GLY  44  13.057   6.100  -0.081
  333   2HA   GLY  44          1HA       GLY  44  14.616   5.314  -0.385
  334    H    LYS  45           H        LYS  45  12.113   3.706   1.422
  335    HA   LYS  45           HA       LYS  45  12.041   1.543  -0.568
  336   1HB   LYS  45          2HB       LYS  45  10.863   0.373   1.244
  337   2HB   LYS  45          1HB       LYS  45  12.313   1.155   1.867
  338   1HG   LYS  45          2HG       LYS  45  10.113   3.013   1.986
  339   2HG   LYS  45          1HG       LYS  45   9.639   1.502   2.761
  340   1HD   LYS  45          2HD       LYS  45  12.006   1.664   3.891
  341   2HD   LYS  45          1HD       LYS  45  11.878   3.373   3.475
  342   1HE   LYS  45          2HE       LYS  45  10.775   3.516   5.483
  343   2HE   LYS  45          1HE       LYS  45   9.395   2.898   4.554
  344   1HZ   LYS  45          1HZ       LYS  45  10.185   0.634   5.021
  345   2HZ   LYS  45          2HZ       LYS  45   9.785   1.472   6.444
  346   3HZ   LYS  45          3HZ       LYS  45  11.413   1.267   6.004
  347    H    TYR  46           H        TYR  46   9.496   0.562  -0.381
  348    HA   TYR  46           HA       TYR  46   7.804   2.809  -1.443
  349   1HB   TYR  46          2HB       TYR  46   7.950  -0.147  -2.087
  350   2HB   TYR  46          1HB       TYR  46   6.711   0.921  -2.728
  351    HD1  TYR  46           1HD      TYR  46   7.081   1.751  -4.854
  352    HD2  TYR  46           2HD      TYR  46  10.461   0.931  -2.337
  353    HE1  TYR  46           1HE      TYR  46   8.613   2.426  -6.682
  354    HE2  TYR  46           2HE      TYR  46  11.989   1.605  -4.159
  355    HH   TYR  46           HH       TYR  46  10.891   2.116  -7.383
  356    H    THR  47           H        THR  47   5.454   2.545  -1.039
  357    HA   THR  47           HA       THR  47   4.828   0.888   1.384
  358    HB   THR  47           HB       THR  47   3.954   3.722   0.711
  359    HG1  THR  47           1HG      THR  47   6.015   3.722   1.502
  360   1HG2  THR  47          1HG2      THR  47   3.240   3.332   3.300
  361   2HG2  THR  47          2HG2      THR  47   3.002   1.703   2.670
  362   3HG2  THR  47          3HG2      THR  47   2.142   3.062   1.947
  363    H    VAL  48           H        VAL  48   3.183  -0.516   0.914
  364    HA   VAL  48           HA       VAL  48   1.541  -0.002  -1.521
  365    HB   VAL  48           HB       VAL  48   2.251  -2.377   0.196
  366   1HG1  VAL  48          1HG1      VAL  48   0.126  -2.226  -1.960
  367   2HG1  VAL  48          2HG1      VAL  48  -0.111  -2.674  -0.271
  368   3HG1  VAL  48          3HG1      VAL  48   0.803  -3.734  -1.345
  369   1HG2  VAL  48          1HG2      VAL  48   2.396  -2.298  -2.784
  370   2HG2  VAL  48          2HG2      VAL  48   3.487  -3.060  -1.628
  371   3HG2  VAL  48          3HG2      VAL  48   3.552  -1.316  -1.885
  372    H    SER  49           H        SER  49  -0.259   1.206  -1.016
  373    HA   SER  49           HA       SER  49  -1.686   0.803   1.552
  374   1HB   SER  49          2HB       SER  49  -1.486   2.803  -0.622
  375   2HB   SER  49          1HB       SER  49  -3.080   2.659   0.114
  376    HG   SER  49           HG       SER  49  -1.515   4.152   1.129
  377    H    VAL  50           H        VAL  50  -3.148  -0.911   1.552
  378    HA   VAL  50           HA       VAL  50  -4.851  -1.200  -0.904
  379    HB   VAL  50           HB       VAL  50  -4.732  -3.612  -0.592
  380   1HG1  VAL  50          1HG1      VAL  50  -2.245  -3.955  -0.788
  381   2HG1  VAL  50          2HG1      VAL  50  -2.031  -2.255  -0.369
  382   3HG1  VAL  50          3HG1      VAL  50  -2.880  -2.698  -1.848
  383   1HG2  VAL  50          1HG2      VAL  50  -4.705  -3.570   1.901
  384   2HG2  VAL  50          2HG2      VAL  50  -3.031  -3.017   1.852
  385   3HG2  VAL  50          3HG2      VAL  50  -3.452  -4.614   1.235
  386    H    PHE  51           H        PHE  51  -7.086  -1.293  -0.505
  387    HA   PHE  51           HA       PHE  51  -7.916  -1.695   2.355
  388   1HB   PHE  51          2HB       PHE  51  -8.546   0.471   2.426
  389   2HB   PHE  51          1HB       PHE  51  -7.915   0.690   0.802
  390    HD1  PHE  51           1HD      PHE  51 -10.865   0.657   2.822
  391    HD2  PHE  51           2HD      PHE  51  -9.440  -0.048  -1.166
  392    HE1  PHE  51           1HE      PHE  51 -13.166   0.937   1.945
  393    HE2  PHE  51           2HE      PHE  51 -11.731   0.240  -2.037
  394    HZ   PHE  51           HZ       PHE  51 -13.601   0.729  -0.485
  395    H    ALA  52           H        ALA  52 -10.336  -2.100   2.513
  396    HA   ALA  52           HA       ALA  52 -11.775  -2.949   0.128
  397   1HB   ALA  52          1HB       ALA  52 -11.122  -5.141   2.085
  398   2HB   ALA  52          2HB       ALA  52 -10.032  -4.782   0.746
  399   3HB   ALA  52          3HB       ALA  52 -11.691  -5.284   0.422
  400    H    LYS  53           H        LYS  53 -13.954  -3.821   0.704
  401    HA   LYS  53           HA       LYS  53 -14.875  -2.727   3.346
  402   1HB   LYS  53          2HB       LYS  53 -16.021  -3.042   0.583
  403   2HB   LYS  53          1HB       LYS  53 -17.117  -2.930   1.962
  404   1HG   LYS  53          2HG       LYS  53 -15.499  -0.881   2.575
  405   2HG   LYS  53          1HG       LYS  53 -15.286  -0.870   0.824
  406   1HD   LYS  53          2HD       LYS  53 -17.787  -0.862   0.583
  407   2HD   LYS  53          1HD       LYS  53 -17.908  -0.681   2.333
  408   1HE   LYS  53          2HE       LYS  53 -17.451   1.540   2.212
  409   2HE   LYS  53          1HE       LYS  53 -16.051   1.258   1.158
  410   1HZ   LYS  53          1HZ       LYS  53 -17.633   0.827  -0.672
  411   2HZ   LYS  53          2HZ       LYS  53 -17.717   2.420  -0.091
  412   3HZ   LYS  53          3HZ       LYS  53 -18.908   1.290   0.344
  413    H    SER  54           H        SER  54 -13.767  -5.256   3.623
  414    HA   SER  54           HA       SER  54 -16.109  -6.874   4.359
  415   1HB   SER  54          2HB       SER  54 -16.007  -7.476   2.059
  416   2HB   SER  54          1HB       SER  54 -14.247  -7.552   2.078
  417    HG   SER  54           HG       SER  54 -14.339  -9.424   3.206
  418    H    THR  55           H        THR  55 -14.549  -6.110   6.287
  419    HA   THR  55           HA       THR  55 -13.161  -8.497   7.225
  420    HB   THR  55           HB       THR  55 -11.342  -6.167   7.121
  421    HG1  THR  55           1HG      THR  55 -10.854  -6.411   5.003
  422   1HG2  THR  55          1HG2      THR  55 -10.536  -8.192   8.099
  423   2HG2  THR  55          2HG2      THR  55  -9.742  -8.041   6.532
  424   3HG2  THR  55          3HG2      THR  55 -11.101  -9.148   6.728
  425    H    GLY  56           H        GLY  56 -11.450  -6.675   9.012
  426   1HA   GLY  56          2HA       GLY  56 -13.148  -6.434  11.239
  427   2HA   GLY  56          1HA       GLY  56 -11.708  -5.438  11.006
  428    H    ASP  57           H        ASP  57 -12.695  -4.328   8.491
  429    HA   ASP  57           HA       ASP  57 -14.806  -2.470   9.525
  430   1HB   ASP  57          2HB       ASP  57 -12.211  -1.947   8.840
  431   2HB   ASP  57          1HB       ASP  57 -13.016  -1.711   7.290
  432    HA   PRO  58           HA       PRO  58 -16.505  -5.160   6.092
  433   1HB   PRO  58          2HB       PRO  58 -19.066  -4.263   7.061
  434   2HB   PRO  58          1HB       PRO  58 -18.368  -5.883   7.134
  435   1HG   PRO  58          2HG       PRO  58 -18.675  -3.958   9.271
  436   2HG   PRO  58          1HG       PRO  58 -18.107  -5.627   9.369
  437   1HD   PRO  58          2HD       PRO  58 -16.539  -3.298   9.722
  438   2HD   PRO  58          1HD       PRO  58 -15.928  -4.958   9.526
  439    H    GLN  59           H        GLN  59 -16.977  -1.822   6.991
  440    HA   GLN  59           HA       GLN  59 -18.110  -1.259   4.280
  441   1HB   GLN  59          2HB       GLN  59 -18.754   0.927   5.440
  442   2HB   GLN  59          1HB       GLN  59 -19.541  -0.527   6.055
  443   1HG   GLN  59          2HG       GLN  59 -18.341  -0.515   8.025
  444   2HG   GLN  59          1HG       GLN  59 -16.945   0.276   7.292
  445   1HE2  GLN  59          1HE2      GLN  59 -17.071   1.814   9.194
  446   2HE2  GLN  59          2HE2      GLN  59 -18.181   3.096   9.139
  447    H    GLY  60           H        GLY  60 -15.104  -1.371   5.517
  448   1HA   GLY  60          2HA       GLY  60 -13.852   0.149   3.582
  449   2HA   GLY  60          1HA       GLY  60 -14.169   1.293   4.878
  450    H    VAL  61           H        VAL  61 -12.295  -1.488   3.921
  451    HA   VAL  61           HA       VAL  61 -10.758  -1.376   6.490
  452    HB   VAL  61           HB       VAL  61 -10.751  -3.422   4.244
  453   1HG1  VAL  61          1HG1      VAL  61  -9.653  -3.498   7.065
  454   2HG1  VAL  61          2HG1      VAL  61  -8.707  -3.426   5.579
  455   3HG1  VAL  61          3HG1      VAL  61  -9.663  -4.861   5.947
  456   1HG2  VAL  61          1HG2      VAL  61 -12.943  -3.372   5.273
  457   2HG2  VAL  61          2HG2      VAL  61 -12.227  -3.410   6.881
  458   3HG2  VAL  61          3HG2      VAL  61 -12.088  -4.809   5.823
  459    H    ILE  62           H        ILE  62  -8.562  -0.971   6.412
  460    HA   ILE  62           HA       ILE  62  -7.273  -0.552   3.766
  461    HB   ILE  62           HB       ILE  62  -6.795   1.590   5.740
  462   1HG1  ILE  62          2HG1      ILE  62  -9.541   1.163   4.523
  463   2HG1  ILE  62          1HG1      ILE  62  -9.153   1.209   6.233
  464   1HG2  ILE  62          1HG2      ILE  62  -6.751   1.140   2.903
  465   2HG2  ILE  62          2HG2      ILE  62  -6.131   2.520   3.803
  466   3HG2  ILE  62          3HG2      ILE  62  -7.802   2.515   3.242
  467   1HD1  ILE  62          1HD1      ILE  62  -8.461   3.547   6.033
  468   2HD1  ILE  62          2HD1      ILE  62 -10.126   3.332   5.494
  469   3HD1  ILE  62          3HD1      ILE  62  -8.833   3.513   4.309
  470    H    ARG  63           H        ARG  63  -4.934  -0.399   3.917
  471    HA   ARG  63           HA       ARG  63  -3.493  -0.652   6.411
  472   1HB   ARG  63          2HB       ARG  63  -4.821  -2.940   5.598
  473   2HB   ARG  63          1HB       ARG  63  -3.206  -3.185   4.933
  474   1HG   ARG  63          2HG       ARG  63  -2.260  -3.430   6.989
  475   2HG   ARG  63          1HG       ARG  63  -3.243  -2.148   7.697
  476   1HD   ARG  63          2HD       ARG  63  -5.203  -3.909   7.402
  477   2HD   ARG  63          1HD       ARG  63  -3.862  -5.072   7.427
  478    HE   ARG  63           HE       ARG  63  -3.205  -3.496   9.534
  479   1HH1  ARG  63          1HH2      ARG  63  -6.429  -3.368   8.885
  480   2HH1  ARG  63          2HH2      ARG  63  -6.964  -4.162  10.328
  481   1HH2  ARG  63          1HH1      ARG  63  -3.784  -5.181  11.264
  482   2HH2  ARG  63          2HH1      ARG  63  -5.466  -5.188  11.675
  483    H    HIS  64           H        HIS  64  -1.632   0.409   5.803
  484    HA   HIS  64           HA       HIS  64  -0.720   0.226   2.985
  485   1HB   HIS  64          2HB       HIS  64   0.574   1.880   5.141
  486   2HB   HIS  64          1HB       HIS  64   0.419   2.230   3.421
  487    HD1  HIS  64           1HD      HIS  64  -2.494   2.057   2.866
  488    HD2  HIS  64           2HD      HIS  64  -1.068   3.686   6.428
  489    HE1  HIS  64           1HE      HIS  64  -4.345   3.521   3.772
  490    H    TYR  65           H        TYR  65   0.480  -1.618   2.682
  491    HA   TYR  65           HA       TYR  65   2.323  -2.654   4.723
  492   1HB   TYR  65          2HB       TYR  65   2.102  -3.312   1.780
  493   2HB   TYR  65          1HB       TYR  65   2.738  -4.340   3.057
  494    HD1  TYR  65           1HD      TYR  65   0.377  -4.817   1.005
  495    HD2  TYR  65           2HD      TYR  65   0.542  -3.633   5.132
  496    HE1  TYR  65           1HE      TYR  65  -1.873  -5.782   1.372
  497    HE2  TYR  65           2HE      TYR  65  -1.711  -4.597   5.496
  498    HH   TYR  65           HH       TYR  65  -3.828  -5.068   3.655
  499    H    VAL  66           H        VAL  66   4.358  -1.823   4.956
  500    HA   VAL  66           HA       VAL  66   5.496  -0.266   2.671
  501    HB   VAL  66           HB       VAL  66   6.200  -0.264   5.626
  502   1HG1  VAL  66          1HG1      VAL  66   7.093   1.359   3.239
  503   2HG1  VAL  66          2HG1      VAL  66   8.088   0.530   4.436
  504   3HG1  VAL  66          3HG1      VAL  66   7.217   2.000   4.877
  505   1HG2  VAL  66          1HG2      VAL  66   5.048   2.196   4.748
  506   2HG2  VAL  66          2HG2      VAL  66   4.385   1.050   5.913
  507   3HG2  VAL  66          3HG2      VAL  66   3.985   0.900   4.202
  508    H    VAL  67           H        VAL  67   7.941  -0.437   2.509
  509    HA   VAL  67           HA       VAL  67   8.782  -3.254   3.080
  510    HB   VAL  67           HB       VAL  67   9.455  -1.351   0.821
  511   1HG1  VAL  67          1HG1      VAL  67  10.215  -4.063   0.313
  512   2HG1  VAL  67          2HG1      VAL  67  10.911  -3.579   1.859
  513   3HG1  VAL  67          3HG1      VAL  67  11.249  -2.638   0.407
  514   1HG2  VAL  67          1HG2      VAL  67   7.337  -3.273   1.271
  515   2HG2  VAL  67          2HG2      VAL  67   8.334  -3.784  -0.090
  516   3HG2  VAL  67          3HG2      VAL  67   7.575  -2.193  -0.102
  517    H    CYS  68           H        CYS  68  10.514  -3.457   4.382
  518    HA   CYS  68           HA       CYS  68  12.074  -1.073   5.163
  519   1HB   CYS  68          2HB       CYS  68  11.184  -2.713   6.814
  520   2HB   CYS  68          1HB       CYS  68  12.135  -3.983   6.045
  521    HG   CYS  68           HG       CYS  68  13.204  -2.020   8.059
  522    H    SER  69           H        SER  69  14.408  -1.025   4.859
  523    HA   SER  69           HA       SER  69  15.419  -2.988   2.831
  524   1HB   SER  69          2HB       SER  69  16.724  -0.831   2.080
  525   2HB   SER  69          1HB       SER  69  15.042  -1.047   1.593
  526    HG   SER  69           HG       SER  69  14.421   0.421   3.055
  527    H    THR  70           H        THR  70  17.365  -3.877   3.318
  528    HA   THR  70           HA       THR  70  18.826  -2.880   5.721
  529    HB   THR  70           HB       THR  70  18.029  -5.252   5.544
  530    HG1  THR  70           1HG      THR  70  19.696  -5.508   6.760
  531   1HG2  THR  70          1HG2      THR  70  20.147  -5.937   3.604
  532   2HG2  THR  70          2HG2      THR  70  18.757  -5.087   2.930
  533   3HG2  THR  70          3HG2      THR  70  18.529  -6.609   3.794
  534    HA   PRO  71           HA       PRO  71  22.067  -1.199   3.290
  535   1HB   PRO  71          2HB       PRO  71  24.209  -2.281   4.876
  536   2HB   PRO  71          1HB       PRO  71  23.527  -0.653   4.924
  537   1HG   PRO  71          2HG       PRO  71  23.248  -2.704   6.887
  538   2HG   PRO  71          1HG       PRO  71  22.490  -1.109   6.884
  539   1HD   PRO  71          2HD       PRO  71  21.258  -3.694   6.396
  540   2HD   PRO  71          1HD       PRO  71  20.471  -2.103   6.527
  541    H    GLN  72           H        GLN  72  21.588  -4.506   3.319
  542    HA   GLN  72           HA       GLN  72  24.025  -5.122   1.734
  543   1HB   GLN  72          2HB       GLN  72  23.279  -6.667   3.488
  544   2HB   GLN  72          1HB       GLN  72  21.684  -6.768   2.755
  545   1HG   GLN  72          2HG       GLN  72  23.160  -8.723   2.216
  546   2HG   GLN  72          1HG       GLN  72  22.595  -7.864   0.788
  547   1HE2  GLN  72          1HE2      GLN  72  24.356  -8.079  -0.650
  548   2HE2  GLN  72          2HE2      GLN  72  25.945  -7.611  -0.284
  549    H    SER  73           H        SER  73  21.714  -3.313   0.844
  550    HA   SER  73           HA       SER  73  20.573  -2.887  -1.180
  551   1HB   SER  73          2HB       SER  73  22.922  -4.230  -1.770
  552   2HB   SER  73          1HB       SER  73  21.708  -5.231  -2.562
  553    HG   SER  73           HG       SER  73  22.642  -2.776  -3.228
  554    H    GLN  74           H        GLN  74  19.215  -4.361   0.758
  555    HA   GLN  74           HA       GLN  74  17.631  -6.277  -0.913
  556   1HB   GLN  74          2HB       GLN  74  17.946  -6.799   1.993
  557   2HB   GLN  74          1HB       GLN  74  17.924  -7.937   0.652
  558   1HG   GLN  74          2HG       GLN  74  20.224  -6.901   0.028
  559   2HG   GLN  74          1HG       GLN  74  20.227  -6.285   1.678
  560   1HE2  GLN  74          1HE2      GLN  74  20.198  -7.920   3.451
  561   2HE2  GLN  74          2HE2      GLN  74  20.691  -9.515   3.150
  562    H    TYR  75           H        TYR  75  15.418  -6.668   0.118
  563    HA   TYR  75           HA       TYR  75  14.455  -4.395   1.808
  564   1HB   TYR  75          2HB       TYR  75  13.201  -5.200  -0.827
  565   2HB   TYR  75          1HB       TYR  75  12.755  -3.827   0.179
  566    HD1  TYR  75           1HD      TYR  75  13.946  -1.767   0.074
  567    HD2  TYR  75           2HD      TYR  75  15.455  -5.246  -1.930
  568    HE1  TYR  75           1HE      TYR  75  15.628  -0.372  -1.086
  569    HE2  TYR  75           2HE      TYR  75  17.142  -3.859  -3.086
  570    HH   TYR  75           HH       TYR  75  17.033  -0.893  -3.607
  571    H    TYR  76           H        TYR  76  12.264  -4.777   2.667
  572    HA   TYR  76           HA       TYR  76  10.726  -7.157   2.275
  573   1HB   TYR  76          2HB       TYR  76  11.414  -8.405   4.319
  574   2HB   TYR  76          1HB       TYR  76  12.760  -8.239   3.200
  575    HD1  TYR  76           1HD      TYR  76  11.243  -6.871   6.294
  576    HD2  TYR  76           2HD      TYR  76  14.737  -6.998   3.810
  577    HE1  TYR  76           1HE      TYR  76  12.548  -5.786   8.090
  578    HE2  TYR  76           2HE      TYR  76  16.047  -5.909   5.606
  579    HH   TYR  76           HH       TYR  76  15.476  -4.347   7.610
  580    H    LEU  77           H        LEU  77   8.987  -7.343   3.897
  581    HA   LEU  77           HA       LEU  77   8.482  -4.771   5.357
  582   1HB   LEU  77          2HB       LEU  77   6.873  -5.987   3.662
  583   2HB   LEU  77          1HB       LEU  77   6.575  -7.101   4.996
  584    HG   LEU  77           HG       LEU  77   6.431  -4.212   5.669
  585   1HD1  LEU  77          1HD1      LEU  77   5.301  -4.582   3.356
  586   2HD1  LEU  77          2HD1      LEU  77   4.362  -3.785   4.618
  587   3HD1  LEU  77          3HD1      LEU  77   4.089  -5.490   4.259
  588   1HD2  LEU  77          1HD2      LEU  77   5.922  -6.325   7.116
  589   2HD2  LEU  77          2HD2      LEU  77   4.398  -6.363   6.229
  590   3HD2  LEU  77          3HD2      LEU  77   4.815  -4.955   7.206
  591    H    ALA  78           H        ALA  78   9.601  -7.902   5.657
  592    HA   ALA  78           HA       ALA  78   9.718  -7.803   8.594
  593   1HB   ALA  78          1HB       ALA  78   8.942 -10.358   8.340
  594   2HB   ALA  78          2HB       ALA  78   8.122  -9.720   6.915
  595   3HB   ALA  78          3HB       ALA  78   7.749  -9.071   8.512
  596    H    GLU  79           H        GLU  79  11.881  -8.278   8.949
  597    HA   GLU  79           HA       GLU  79  13.780  -8.917   7.020
  598   1HB   GLU  79          2HB       GLU  79  13.525  -9.242   9.980
  599   2HB   GLU  79          1HB       GLU  79  14.910 -10.004   9.196
  600   1HG   GLU  79          2HG       GLU  79  15.363  -7.781   8.067
  601   2HG   GLU  79          1HG       GLU  79  14.140  -7.080   9.127
  602    H    LYS  80           H        LYS  80  11.445 -11.052   8.383
  603    HA   LYS  80           HA       LYS  80  12.495 -13.611   8.337
  604   1HB   LYS  80          2HB       LYS  80   9.959 -12.305   7.990
  605   2HB   LYS  80          1HB       LYS  80  10.054 -13.654   6.859
  606   1HG   LYS  80          2HG       LYS  80  11.005 -14.172   9.632
  607   2HG   LYS  80          1HG       LYS  80   9.267 -13.974   9.415
  608   1HD   LYS  80          2HD       LYS  80   9.236 -15.724   7.716
  609   2HD   LYS  80          1HD       LYS  80  10.991 -15.878   7.806
  610   1HE   LYS  80          2HE       LYS  80  10.898 -17.134   9.713
  611   2HE   LYS  80          1HE       LYS  80   9.600 -16.142  10.408
  612   1HZ   LYS  80          1HZ       LYS  80   9.302 -18.136   8.223
  613   2HZ   LYS  80          2HZ       LYS  80   8.060 -17.132   8.804
  614   3HZ   LYS  80          3HZ       LYS  80   8.745 -18.313   9.814
  615    H    HIS  81           H        HIS  81  11.665 -11.617   5.510
  616    HA   HIS  81           HA       HIS  81  13.453 -13.251   3.813
  617   1HB   HIS  81          2HB       HIS  81  11.471 -13.457   2.149
  618   2HB   HIS  81          1HB       HIS  81  11.472 -14.536   3.542
  619    HD1  HIS  81           1HD      HIS  81  10.182 -10.992   2.860
  620    HD2  HIS  81           2HD      HIS  81   8.998 -14.519   4.741
  621    HE1  HIS  81           1HE      HIS  81   7.871 -10.562   3.801
  622    H    LEU  82           H        LEU  82  14.341 -11.918   2.185
  623    HA   LEU  82           HA       LEU  82  12.945  -9.368   1.601
  624   1HB   LEU  82          2HB       LEU  82  14.931  -8.094   2.241
  625   2HB   LEU  82          1HB       LEU  82  14.432  -9.104   3.594
  626    HG   LEU  82           HG       LEU  82  16.505  -9.992   1.602
  627   1HD1  LEU  82          1HD1      LEU  82  18.134  -8.802   2.649
  628   2HD1  LEU  82          2HD1      LEU  82  17.433  -9.067   4.242
  629   3HD1  LEU  82          3HD1      LEU  82  16.810  -7.782   3.207
  630   1HD2  LEU  82          1HD2      LEU  82  17.048 -11.060   4.109
  631   2HD2  LEU  82          2HD2      LEU  82  16.204 -11.899   2.808
  632   3HD2  LEU  82          3HD2      LEU  82  15.286 -11.054   4.053
  633    H    PHE  83           H        PHE  83  13.332  -8.616  -0.466
  634    HA   PHE  83           HA       PHE  83  15.142 -10.267  -2.185
  635   1HB   PHE  83          2HB       PHE  83  12.511  -8.879  -2.482
  636   2HB   PHE  83          1HB       PHE  83  13.541  -8.976  -3.914
  637    HD1  PHE  83           1HD      PHE  83  12.327 -11.139  -1.096
  638    HD2  PHE  83           2HD      PHE  83  13.421 -10.884  -5.241
  639    HE1  PHE  83           1HE      PHE  83  11.671 -13.510  -1.415
  640    HE2  PHE  83           2HE      PHE  83  12.761 -13.254  -5.562
  641    HZ   PHE  83           HZ       PHE  83  11.887 -14.568  -3.648
  642    H    SER  84           H        SER  84  15.305  -8.428  -4.338
  643    HA   SER  84           HA       SER  84  17.103  -6.387  -3.120
  644   1HB   SER  84          2HB       SER  84  16.761  -7.447  -5.944
  645   2HB   SER  84          1HB       SER  84  17.998  -6.296  -5.447
  646    HG   SER  84           HG       SER  84  18.725  -8.488  -5.433
  647    H    THR  85           H        THR  85  13.925  -6.429  -3.941
  648    HA   THR  85           HA       THR  85  13.780  -3.536  -4.273
  649    HB   THR  85           HB       THR  85  12.725  -5.132  -6.607
  650    HG1  THR  85           1HG      THR  85  14.746  -5.630  -6.959
  651   1HG2  THR  85          1HG2      THR  85  12.182  -3.090  -7.361
  652   2HG2  THR  85          2HG2      THR  85  13.844  -2.533  -7.166
  653   3HG2  THR  85          3HG2      THR  85  12.714  -2.424  -5.817
  654    H    ILE  86           H        ILE  86  11.469  -2.813  -4.318
  655    HA   ILE  86           HA       ILE  86   9.780  -4.508  -2.695
  656    HB   ILE  86           HB       ILE  86   9.632  -1.840  -4.036
  657   1HG1  ILE  86          2HG1      ILE  86   8.812  -1.529  -1.491
  658   2HG1  ILE  86          1HG1      ILE  86   9.696  -3.041  -1.318
  659   1HG2  ILE  86          1HG2      ILE  86   7.293  -3.523  -3.232
  660   2HG2  ILE  86          2HG2      ILE  86   7.405  -2.291  -4.489
  661   3HG2  ILE  86          3HG2      ILE  86   7.256  -1.815  -2.798
  662   1HD1  ILE  86          1HD1      ILE  86  11.064  -0.957  -2.907
  663   2HD1  ILE  86          2HD1      ILE  86  11.716  -2.064  -1.700
  664   3HD1  ILE  86          3HD1      ILE  86  10.876  -0.600  -1.190
  665    HA   PRO  87           HA       PRO  87   7.057  -4.831  -6.750
  666   1HB   PRO  87          2HB       PRO  87   8.945  -4.781  -8.927
  667   2HB   PRO  87          1HB       PRO  87   7.579  -3.697  -8.641
  668   1HG   PRO  87          2HG       PRO  87  10.401  -3.157  -8.300
  669   2HG   PRO  87          1HG       PRO  87   9.041  -2.041  -8.145
  670   1HD   PRO  87          2HD       PRO  87  10.662  -3.042  -6.041
  671   2HD   PRO  87          1HD       PRO  87   9.153  -2.116  -5.863
  672    H    GLU  88           H        GLU  88  10.445  -5.911  -6.694
  673    HA   GLU  88           HA       GLU  88   9.976  -8.524  -7.836
  674   1HB   GLU  88          2HB       GLU  88  12.174  -7.344  -7.663
  675   2HB   GLU  88          1HB       GLU  88  12.108  -7.528  -5.910
  676   1HG   GLU  88          2HG       GLU  88  13.478  -9.316  -6.832
  677   2HG   GLU  88          1HG       GLU  88  11.972 -10.007  -6.226
  678    H    LEU  89           H        LEU  89  10.111  -7.248  -4.518
  679    HA   LEU  89           HA       LEU  89   9.779  -9.683  -3.070
  680   1HB   LEU  89          2HB       LEU  89   9.915  -6.901  -2.614
  681   2HB   LEU  89          1HB       LEU  89   8.368  -7.399  -1.931
  682    HG   LEU  89           HG       LEU  89  10.878  -8.964  -1.358
  683   1HD1  LEU  89          1HD1      LEU  89   9.841  -6.728   0.396
  684   2HD1  LEU  89          2HD1      LEU  89  11.114  -6.462  -0.795
  685   3HD1  LEU  89          3HD1      LEU  89  11.366  -7.599   0.526
  686   1HD2  LEU  89          1HD2      LEU  89   8.323  -9.562  -0.840
  687   2HD2  LEU  89          2HD2      LEU  89   8.621  -8.518   0.550
  688   3HD2  LEU  89          3HD2      LEU  89   9.610  -9.957   0.301
  689    H    ILE  90           H        ILE  90   7.270  -7.289  -4.014
  690    HA   ILE  90           HA       ILE  90   4.990  -8.744  -3.189
  691    HB   ILE  90           HB       ILE  90   5.405  -6.892  -5.564
  692   1HG1  ILE  90          2HG1      ILE  90   4.161  -5.972  -3.027
  693   2HG1  ILE  90          1HG1      ILE  90   5.890  -6.314  -2.956
  694   1HG2  ILE  90          1HG2      ILE  90   3.008  -6.454  -5.403
  695   2HG2  ILE  90          2HG2      ILE  90   2.871  -7.551  -4.030
  696   3HG2  ILE  90          3HG2      ILE  90   3.267  -8.183  -5.628
  697   1HD1  ILE  90          1HD1      ILE  90   4.632  -4.573  -5.090
  698   2HD1  ILE  90          2HD1      ILE  90   6.350  -4.771  -4.743
  699   3HD1  ILE  90          3HD1      ILE  90   5.309  -3.932  -3.593
  700    H    ASN  91           H        ASN  91   6.634  -8.768  -6.369
  701    HA   ASN  91           HA       ASN  91   4.912 -10.672  -7.635
  702   1HB   ASN  91          2HB       ASN  91   7.485  -9.339  -8.054
  703   2HB   ASN  91          1HB       ASN  91   7.474 -10.974  -8.713
  704   1HD2  ASN  91          1HD2      ASN  91   4.885  -8.465  -8.489
  705   2HD2  ASN  91          2HD2      ASN  91   4.523  -8.482 -10.148
  706    H    TYR  92           H        TYR  92   7.873 -11.052  -5.703
  707    HA   TYR  92           HA       TYR  92   8.166 -13.888  -6.053
  708   1HB   TYR  92          2HB       TYR  92  10.080 -13.192  -5.064
  709   2HB   TYR  92          1HB       TYR  92   9.327 -11.682  -4.573
  710    HD1  TYR  92           1HD      TYR  92   9.484 -15.302  -3.631
  711    HD2  TYR  92           2HD      TYR  92   8.959 -11.255  -2.300
  712    HE1  TYR  92           1HE      TYR  92   9.471 -16.077  -1.278
  713    HE2  TYR  92           2HE      TYR  92   8.943 -12.027   0.053
  714    HH   TYR  92           HH       TYR  92   9.703 -13.909   1.373
  715    H    HIS  93           H        HIS  93   5.969 -11.988  -4.148
  716    HA   HIS  93           HA       HIS  93   5.370 -13.664  -1.966
  717   1HB   HIS  93          2HB       HIS  93   4.504 -11.342  -2.600
  718   2HB   HIS  93          1HB       HIS  93   3.350 -12.164  -3.650
  719    HD1  HIS  93           1HD      HIS  93   1.618 -10.978  -1.854
  720    HD2  HIS  93           2HD      HIS  93   3.855 -14.213  -0.470
  721    HE1  HIS  93           1HE      HIS  93   0.459 -11.808   0.239
  722    H    GLN  94           H        GLN  94   4.143 -13.839  -5.317
  723    HA   GLN  94           HA       GLN  94   3.306 -16.657  -4.773
  724   1HB   GLN  94          2HB       GLN  94   1.625 -14.365  -5.081
  725   2HB   GLN  94          1HB       GLN  94   1.423 -15.368  -6.518
  726   1HG   GLN  94          2HG       GLN  94  -0.072 -16.474  -5.186
  727   2HG   GLN  94          1HG       GLN  94   1.382 -17.288  -4.609
  728   1HE2  GLN  94          1HE2      GLN  94  -1.156 -15.045  -3.727
  729   2HE2  GLN  94          2HE2      GLN  94  -0.644 -14.792  -2.128
  730    H    HIS  95           H        HIS  95   2.847 -14.483  -7.569
  731    HA   HIS  95           HA       HIS  95   5.035 -15.556  -9.125
  732   1HB   HIS  95          2HB       HIS  95   3.615 -16.947 -10.641
  733   2HB   HIS  95          1HB       HIS  95   3.639 -17.570  -8.992
  734    HD1  HIS  95           1HD      HIS  95   1.422 -17.795  -7.825
  735    HD2  HIS  95           2HD      HIS  95   1.158 -15.402 -11.229
  736    HE1  HIS  95           1HE      HIS  95  -1.038 -17.294  -8.161
  737    H    ASN  96           H        ASN  96   4.003 -15.291 -11.688
  738    HA   ASN  96           HA       ASN  96   2.306 -12.960 -12.010
  739   1HB   ASN  96          2HB       ASN  96   4.322 -11.943 -11.003
  740   2HB   ASN  96          1HB       ASN  96   5.315 -12.647 -12.280
  741   1HD2  ASN  96          1HD2      ASN  96   5.630 -11.337 -14.090
  742   2HD2  ASN  96          2HD2      ASN  96   4.657 -10.010 -14.510
  743    H    SER  97           H        SER  97   1.338 -14.051 -13.750
  744    HA   SER  97           HA       SER  97   3.122 -14.686 -16.080
  745   1HB   SER  97          2HB       SER  97   1.722 -16.457 -14.619
  746   2HB   SER  97          1HB       SER  97   0.446 -15.964 -15.729
  747    HG   SER  97           HG       SER  97   1.391 -17.131 -17.186
  748    H    ALA  98           H        ALA  98   1.259 -14.985 -18.045
  749    HA   ALA  98           HA       ALA  98  -0.130 -12.325 -18.126
  750   1HB   ALA  98          1HB       ALA  98   1.959 -13.100 -19.619
  751   2HB   ALA  98          2HB       ALA  98   0.683 -12.075 -20.277
  752   3HB   ALA  98          3HB       ALA  98   0.671 -13.811 -20.591
  753    H    GLY  99           H        GLY  99  -1.974 -12.396 -19.841
  754   1HA   GLY  99          2HA       GLY  99  -3.332 -14.476 -20.901
  755   2HA   GLY  99          1HA       GLY  99  -3.696 -14.700 -19.189
  756    H    LEU 100           H        LEU 100  -4.433 -12.545 -18.089
  757    HA   LEU 100           HA       LEU 100  -6.014 -10.825 -19.932
  758   1HB   LEU 100          2HB       LEU 100  -7.035 -13.064 -18.543
  759   2HB   LEU 100          1HB       LEU 100  -7.602 -11.654 -17.649
  760    HG   LEU 100           HG       LEU 100  -8.085 -10.780 -20.146
  761   1HD1  LEU 100          1HD1      LEU 100  -8.472 -12.427 -21.706
  762   2HD1  LEU 100          2HD1      LEU 100  -8.910 -13.625 -20.488
  763   3HD1  LEU 100          3HD1      LEU 100  -7.213 -13.243 -20.777
  764   1HD2  LEU 100          1HD2      LEU 100  -9.823 -12.639 -18.492
  765   2HD2  LEU 100          2HD2      LEU 100 -10.421 -11.650 -19.823
  766   3HD2  LEU 100          3HD2      LEU 100  -9.758 -10.880 -18.381
  767    H    ILE 101           H        ILE 101  -5.801 -11.486 -16.413
  768    HA   ILE 101           HA       ILE 101  -5.880  -8.643 -15.760
  769    HB   ILE 101           HB       ILE 101  -5.595  -9.540 -13.451
  770   1HG1  ILE 101          2HG1      ILE 101  -5.631 -12.332 -14.527
  771   2HG1  ILE 101          1HG1      ILE 101  -4.087 -11.480 -14.507
  772   1HG2  ILE 101          1HG2      ILE 101  -7.798  -9.606 -14.795
  773   2HG2  ILE 101          2HG2      ILE 101  -7.696 -10.630 -13.364
  774   3HG2  ILE 101          3HG2      ILE 101  -7.492 -11.333 -14.968
  775   1HD1  ILE 101          1HD1      ILE 101  -4.779 -10.874 -12.042
  776   2HD1  ILE 101          2HD1      ILE 101  -4.096 -12.462 -12.392
  777   3HD1  ILE 101          3HD1      ILE 101  -5.838 -12.274 -12.202
  778    H    SER 102           H        SER 102  -4.001  -8.316 -13.785
  779    HA   SER 102           HA       SER 102  -1.336  -9.025 -14.885
  780   1HB   SER 102          2HB       SER 102  -0.724  -6.638 -15.037
  781   2HB   SER 102          1HB       SER 102  -2.110  -6.986 -16.067
  782    HG   SER 102           HG       SER 102  -1.907  -5.407 -13.834
  783    H    ARG 103           H        ARG 103  -2.091 -10.082 -12.565
  784    HA   ARG 103           HA       ARG 103  -1.645 -10.196 -10.247
  785   1HB   ARG 103          2HB       ARG 103   0.576  -9.259 -11.692
  786   2HB   ARG 103          1HB       ARG 103   0.475  -8.199 -10.286
  787   1HG   ARG 103          2HG       ARG 103   0.264 -10.274  -8.853
  788   2HG   ARG 103          1HG       ARG 103   0.636 -11.223 -10.292
  789   1HD   ARG 103          2HD       ARG 103   2.819 -10.946  -9.689
  790   2HD   ARG 103          1HD       ARG 103   2.634  -9.284 -10.287
  791    HE   ARG 103           HE       ARG 103   2.730 -10.074  -7.485
  792   1HH1  ARG 103          1HH1      ARG 103   2.923  -7.472  -9.498
  793   2HH1  ARG 103          2HH1      ARG 103   2.059  -6.363  -8.485
  794   1HH2  ARG 103          1HH2      ARG 103   0.970  -8.810  -6.283
  795   2HH2  ARG 103          2HH2      ARG 103   0.953  -7.120  -6.665
  796    H    LEU 104           H        LEU 104  -0.825  -8.312  -8.400
  797    HA   LEU 104           HA       LEU 104  -1.624  -6.505  -7.103
  798   1HB   LEU 104          2HB       LEU 104  -0.880  -5.470  -9.371
  799   2HB   LEU 104          1HB       LEU 104  -2.605  -5.358  -9.720
  800    HG   LEU 104           HG       LEU 104  -1.772  -4.370  -7.050
  801   1HD1  LEU 104          1HD1      LEU 104  -1.358  -2.452  -9.289
  802   2HD1  LEU 104          2HD1      LEU 104  -0.087  -3.646  -9.026
  803   3HD1  LEU 104          3HD1      LEU 104  -0.547  -2.547  -7.726
  804   1HD2  LEU 104          1HD2      LEU 104  -3.281  -2.438  -8.197
  805   2HD2  LEU 104          2HD2      LEU 104  -3.981  -3.858  -7.422
  806   3HD2  LEU 104          3HD2      LEU 104  -3.783  -3.818  -9.173
  807    H    LYS 105           H        LYS 105  -3.688  -5.504  -6.368
  808    HA   LYS 105           HA       LYS 105  -5.972  -7.311  -6.878
  809   1HB   LYS 105          2HB       LYS 105  -5.501  -5.011  -4.953
  810   2HB   LYS 105          1HB       LYS 105  -6.911  -6.070  -4.928
  811   1HG   LYS 105          2HG       LYS 105  -5.454  -8.019  -4.561
  812   2HG   LYS 105          1HG       LYS 105  -4.035  -6.974  -4.607
  813   1HD   LYS 105          2HD       LYS 105  -5.564  -5.697  -2.734
  814   2HD   LYS 105          1HD       LYS 105  -6.006  -7.379  -2.444
  815   1HE   LYS 105          2HE       LYS 105  -3.277  -7.582  -2.723
  816   2HE   LYS 105          1HE       LYS 105  -3.448  -6.007  -1.920
  817   1HZ   LYS 105          1HZ       LYS 105  -5.016  -7.070  -0.361
  818   2HZ   LYS 105          2HZ       LYS 105  -3.453  -7.724  -0.258
  819   3HZ   LYS 105          3HZ       LYS 105  -4.680  -8.575  -1.069
  820    H    TYR 106           H        TYR 106  -6.361  -3.841  -6.188
  821    HA   TYR 106           HA       TYR 106  -7.632  -3.533  -8.887
  822   1HB   TYR 106          2HB       TYR 106  -9.163  -3.927  -6.869
  823   2HB   TYR 106          1HB       TYR 106  -8.641  -2.344  -6.298
  824    HD1  TYR 106           1HD      TYR 106 -11.111  -3.987  -8.113
  825    HD2  TYR 106           2HD      TYR 106  -8.664  -0.463  -8.244
  826    HE1  TYR 106           1HE      TYR 106 -12.756  -2.901  -9.622
  827    HE2  TYR 106           2HE      TYR 106 -10.303   0.624  -9.752
  828    HH   TYR 106           HH       TYR 106 -13.431  -0.673 -10.306
  829    HA   PRO 107           HA       PRO 107  -4.701  -0.091  -8.767
  830   1HB   PRO 107          2HB       PRO 107  -5.725   0.761 -11.308
  831   2HB   PRO 107          1HB       PRO 107  -4.206  -0.073 -10.971
  832   1HG   PRO 107          2HG       PRO 107  -6.515  -1.137 -12.276
  833   2HG   PRO 107          1HG       PRO 107  -5.023  -1.986 -11.865
  834   1HD   PRO 107          2HD       PRO 107  -7.640  -2.235 -10.620
  835   2HD   PRO 107          1HD       PRO 107  -6.166  -3.180 -10.294
  836    H    VAL 108           H        VAL 108  -6.400   0.625  -7.053
  837    HA   VAL 108           HA       VAL 108  -7.985   2.925  -8.126
  838    HB   VAL 108           HB       VAL 108  -9.315   1.054  -7.256
  839   1HG1  VAL 108          1HG1      VAL 108  -8.740   1.170  -4.471
  840   2HG1  VAL 108          2HG1      VAL 108  -7.213   0.930  -5.318
  841   3HG1  VAL 108          3HG1      VAL 108  -8.543  -0.200  -5.563
  842   1HG2  VAL 108          1HG2      VAL 108 -10.656   2.282  -5.662
  843   2HG2  VAL 108          2HG2      VAL 108 -10.008   3.441  -6.823
  844   3HG2  VAL 108          3HG2      VAL 108  -9.282   3.296  -5.223
  845    H    SER 109           H        SER 109  -6.077   4.332  -7.800
  846    HA   SER 109           HA       SER 109  -5.145   4.610  -5.001
  847   1HB   SER 109          2HB       SER 109  -4.220   5.816  -7.620
  848   2HB   SER 109          1HB       SER 109  -3.403   6.018  -6.069
  849    HG   SER 109           HG       SER 109  -3.964   3.529  -7.313
  850    H    GLN 110           H        GLN 110  -4.472   7.521  -5.852
  851    HA   GLN 110           HA       GLN 110  -6.319   8.927  -4.391
  852   1HB   GLN 110          2HB       GLN 110  -5.652  10.865  -5.863
  853   2HB   GLN 110          1HB       GLN 110  -4.290   9.896  -5.304
  854   1HG   GLN 110          2HG       GLN 110  -4.585   8.578  -7.517
  855   2HG   GLN 110          1HG       GLN 110  -5.553   9.955  -8.040
  856   1HE2  GLN 110          1HE2      GLN 110  -2.502   9.737  -6.113
  857   2HE2  GLN 110          2HE2      GLN 110  -1.630  10.802  -7.107
  858    H    GLN 111           H        GLN 111  -6.598   8.242  -7.896
  859    HA   GLN 111           HA       GLN 111  -8.464   8.435  -9.345
  860   1HB   GLN 111          2HB       GLN 111  -9.355   7.192  -6.747
  861   2HB   GLN 111          1HB       GLN 111 -10.462   7.318  -8.119
  862   1HG   GLN 111          2HG       GLN 111  -8.262   6.328  -9.369
  863   2HG   GLN 111          1HG       GLN 111  -8.069   5.604  -7.772
  864   1HE2  GLN 111          1HE2      GLN 111  -8.798   4.162 -10.255
  865   2HE2  GLN 111          2HE2      GLN 111 -10.326   3.477  -9.979
  866    H    ASN 112           H        ASN 112 -11.123   8.955  -8.915
  867    HA   ASN 112           HA       ASN 112 -11.144  11.697  -7.759
  868   1HB   ASN 112          2HB       ASN 112 -11.277  11.336 -10.298
  869   2HB   ASN 112          1HB       ASN 112 -12.873  10.646 -10.002
  870   1HD2  ASN 112          1HD2      ASN 112 -10.978  13.624  -9.239
  871   2HD2  ASN 112          2HD2      ASN 112 -12.316  14.667  -9.309
  872    H    LYS 113           H        LYS 113 -12.104   8.698  -7.009
  873    HA   LYS 113           HA       LYS 113 -13.813   7.807  -5.646
  874   1HB   LYS 113          2HB       LYS 113 -14.489  10.727  -5.168
  875   2HB   LYS 113          1HB       LYS 113 -14.734   9.373  -4.066
  876   1HG   LYS 113          2HG       LYS 113 -12.055  10.457  -4.991
  877   2HG   LYS 113          1HG       LYS 113 -12.759  10.659  -3.387
  878   1HD   LYS 113          2HD       LYS 113 -11.714   8.748  -2.808
  879   2HD   LYS 113          1HD       LYS 113 -12.871   7.905  -3.829
  880   1HE   LYS 113          2HE       LYS 113 -10.851   9.004  -5.540
  881   2HE   LYS 113          1HE       LYS 113 -10.045   8.149  -4.217
  882   1HZ   LYS 113          1HZ       LYS 113 -12.316   6.682  -5.014
  883   2HZ   LYS 113          2HZ       LYS 113 -10.684   6.220  -5.075
  884   3HZ   LYS 113          3HZ       LYS 113 -11.389   7.026  -6.389
  885    H    ASN 114           H        ASN 114 -14.505   7.841  -8.325
  886    HA   ASN 114           HA       ASN 114 -17.396   7.911  -8.241
  887   1HB   ASN 114          2HB       ASN 114 -16.101  10.360  -8.589
  888   2HB   ASN 114          1HB       ASN 114 -16.587   9.887 -10.213
  889   1HD2  ASN 114          1HD2      ASN 114 -18.683  10.507 -10.750
  890   2HD2  ASN 114          2HD2      ASN 114 -19.942  10.755  -9.639
  891    H    ALA 115           H        ALA 115 -17.734   8.483 -11.070
  892    HA   ALA 115           HA       ALA 115 -17.637   7.352 -13.139
  893   1HB   ALA 115          1HB       ALA 115 -15.439   6.988 -13.906
  894   2HB   ALA 115          2HB       ALA 115 -14.871   6.484 -12.313
  895   3HB   ALA 115          3HB       ALA 115 -15.212   8.185 -12.631
  896    HA   PRO 116           HA       PRO 116 -18.495   3.376 -10.842
  897   1HB   PRO 116          2HB       PRO 116 -20.881   3.218 -12.444
  898   2HB   PRO 116          1HB       PRO 116 -20.756   3.491 -10.704
  899   1HG   PRO 116          2HG       PRO 116 -21.507   5.378 -12.727
  900   2HG   PRO 116          1HG       PRO 116 -21.365   5.651 -10.988
  901   1HD   PRO 116          2HD       PRO 116 -19.620   6.607 -13.082
  902   2HD   PRO 116          1HD       PRO 116 -19.484   6.892 -11.330
  903    H    SER 117           H        SER 117 -17.154   1.880 -11.826
  904    HA   SER 117           HA       SER 117 -17.911   0.819 -14.473
  905   1HB   SER 117          2HB       SER 117 -15.784   2.755 -14.015
  906   2HB   SER 117          1HB       SER 117 -15.152   1.268 -14.718
  907    HG   SER 117           HG       SER 117 -16.362   1.567 -16.473
  908    H    THR 118           H        THR 118 -16.120  -0.952 -15.048
  909    HA   THR 118           HA       THR 118 -16.126  -2.913 -12.963
  910    HB   THR 118           HB       THR 118 -16.023  -3.426 -15.358
  911    HG1  THR 118           1HG      THR 118 -14.992  -5.134 -14.767
  912   1HG2  THR 118          1HG2      THR 118 -14.789  -1.701 -16.350
  913   2HG2  THR 118          2HG2      THR 118 -13.668  -3.060 -16.427
  914   3HG2  THR 118          3HG2      THR 118 -13.480  -1.831 -15.176
  Start of MODEL   14
    1    H    THR   1           1H       THR   1  18.747  -7.877 -15.571
    2    HA   THR   1           HA       THR   1  18.368  -6.531 -13.675
    3    HB   THR   1           HB       THR   1  16.722  -4.894 -15.404
    4    HG1  THR   1           1HG      THR   1  17.294  -5.577 -17.284
    5   1HG2  THR   1          1HG2      THR   1  19.698  -4.709 -15.372
    6   2HG2  THR   1          2HG2      THR   1  18.851  -4.499 -13.838
    7   3HG2  THR   1          3HG2      THR   1  18.489  -3.436 -15.198
    8    H    GLU   2           H        GLU   2  16.728  -5.179 -12.465
    9    HA   GLU   2           HA       GLU   2  13.909  -6.070 -12.691
   10   1HB   GLU   2          2HB       GLU   2  13.936  -6.816 -10.313
   11   2HB   GLU   2          1HB       GLU   2  15.027  -7.771 -11.315
   12   1HG   GLU   2          2HG       GLU   2  16.575  -5.595 -10.440
   13   2HG   GLU   2          1HG       GLU   2  15.645  -6.092  -9.025
   14    H    ALA   3           H        ALA   3  12.609  -4.330 -12.252
   15    HA   ALA   3           HA       ALA   3  13.208  -2.394 -10.155
   16   1HB   ALA   3          1HB       ALA   3  14.736  -1.374 -11.569
   17   2HB   ALA   3          2HB       ALA   3  13.264  -0.567 -12.111
   18   3HB   ALA   3          3HB       ALA   3  13.910  -1.929 -13.025
   19    H    GLU   4           H        GLU   4  11.691  -0.272 -10.935
   20    HA   GLU   4           HA       GLU   4   9.198  -1.042 -12.237
   21   1HB   GLU   4          2HB       GLU   4   7.880  -0.937 -10.088
   22   2HB   GLU   4          1HB       GLU   4   8.978  -2.314 -10.176
   23   1HG   GLU   4          2HG       GLU   4  10.148  -1.596  -8.386
   24   2HG   GLU   4          1HG       GLU   4  10.324   0.017  -9.076
   25    H    ASP   5           H        ASP   5  11.215   1.204 -12.118
   26    HA   ASP   5           HA       ASP   5   9.349   3.423 -11.349
   27   1HB   ASP   5          2HB       ASP   5  11.471   4.711 -10.996
   28   2HB   ASP   5          1HB       ASP   5  11.351   3.294  -9.952
   29    H    SER   6           H        SER   6   8.404   3.951 -13.328
   30    HA   SER   6           HA       SER   6  10.165   5.091 -15.401
   31   1HB   SER   6          2HB       SER   6   8.996   3.535 -17.106
   32   2HB   SER   6          1HB       SER   6  10.242   2.820 -16.087
   33    HG   SER   6           HG       SER   6   7.451   2.796 -15.553
   34    H    ILE   7           H        ILE   7   8.335   5.344 -17.449
   35    HA   ILE   7           HA       ILE   7   6.609   7.451 -16.551
   36    HB   ILE   7           HB       ILE   7   7.549   7.256 -18.813
   37   1HG1  ILE   7          2HG1      ILE   7   4.641   6.897 -19.355
   38   2HG1  ILE   7          1HG1      ILE   7   5.085   8.169 -18.216
   39   1HG2  ILE   7          1HG2      ILE   7   6.099   4.651 -18.711
   40   2HG2  ILE   7          2HG2      ILE   7   7.646   5.049 -19.457
   41   3HG2  ILE   7          3HG2      ILE   7   6.140   5.490 -20.261
   42   1HD1  ILE   7          1HD1      ILE   7   6.188   9.411 -19.815
   43   2HD1  ILE   7          2HD1      ILE   7   5.003   8.616 -20.852
   44   3HD1  ILE   7          3HD1      ILE   7   6.649   7.989 -20.751
   45    H    GLU   8           H        GLU   8   6.204   4.027 -16.498
   46    HA   GLU   8           HA       GLU   8   3.445   3.648 -16.914
   47   1HB   GLU   8          2HB       GLU   8   5.331   2.394 -14.892
   48   2HB   GLU   8          1HB       GLU   8   3.786   1.704 -15.390
   49   1HG   GLU   8          2HG       GLU   8   4.718   1.895 -17.803
   50   2HG   GLU   8          1HG       GLU   8   6.290   2.077 -17.026
   51    H    MET   9           H        MET   9   1.618   4.057 -15.664
   52    HA   MET   9           HA       MET   9   1.722   4.665 -12.842
   53   1HB   MET   9          2HB       MET   9   0.845   7.093 -13.389
   54   2HB   MET   9          1HB       MET   9   2.575   6.770 -13.382
   55   1HG   MET   9          2HG       MET   9   2.391   7.857 -15.415
   56   2HG   MET   9          1HG       MET   9   2.119   6.204 -15.951
   57   1HE   MET   9          1HE       MET   9  -0.681   6.105 -17.757
   58   2HE   MET   9          2HE       MET   9  -1.055   5.379 -16.196
   59   3HE   MET   9          3HE       MET   9   0.589   5.300 -16.825
   60    H    TYR  10           H        TYR  10   0.151   2.797 -13.883
   61    HA   TYR  10           HA       TYR  10  -2.311   3.373 -15.080
   62   1HB   TYR  10          2HB       TYR  10  -1.368   1.397 -13.013
   63   2HB   TYR  10          1HB       TYR  10  -3.049   1.384 -13.544
   64    HD1  TYR  10           1HD      TYR  10   0.465   0.949 -14.613
   65    HD2  TYR  10           2HD      TYR  10  -3.661   0.702 -15.784
   66    HE1  TYR  10           1HE      TYR  10   1.120  -0.285 -16.663
   67    HE2  TYR  10           2HE      TYR  10  -3.007  -0.531 -17.833
   68    HH   TYR  10           HH       TYR  10  -0.632  -2.113 -18.346
   69    H    GLU  11           H        GLU  11  -2.586   2.540 -11.656
   70    HA   GLU  11           HA       GLU  11  -3.754   5.195 -11.021
   71   1HB   GLU  11          2HB       GLU  11  -5.365   3.285 -12.034
   72   2HB   GLU  11          1HB       GLU  11  -5.393   2.806 -10.341
   73   1HG   GLU  11          2HG       GLU  11  -7.141   4.320 -10.372
   74   2HG   GLU  11          1HG       GLU  11  -5.801   5.382  -9.946
   75    H    TRP  12           H        TRP  12  -3.218   1.862  -9.837
   76    HA   TRP  12           HA       TRP  12  -3.351   2.385  -7.065
   77   1HB   TRP  12          2HB       TRP  12  -1.962   0.304  -6.915
   78   2HB   TRP  12          1HB       TRP  12  -3.313   0.151  -8.035
   79    HD1  TRP  12           HD       TRP  12  -2.780  -0.336 -10.513
   80    HE1  TRP  12           1HE      TRP  12  -0.607  -0.669 -11.858
   81    HE3  TRP  12           3HE      TRP  12   0.647   1.147  -7.030
   82    HZ2  TRP  12           2HZ      TRP  12   2.214  -0.347 -11.504
   83    HZ3  TRP  12           3HZ      TRP  12   3.068   1.123  -7.559
   84    HH2  TRP  12           HH       TRP  12   3.855   0.379  -9.789
   85    H    TYR  13           H        TYR  13  -0.842   3.222  -9.346
   86    HA   TYR  13           HA       TYR  13   1.241   3.536  -7.296
   87   1HB   TYR  13          2HB       TYR  13   1.522   2.867  -9.745
   88   2HB   TYR  13          1HB       TYR  13   1.182   4.550 -10.148
   89    HD1  TYR  13           1HD      TYR  13   3.218   5.480 -10.854
   90    HD2  TYR  13           2HD      TYR  13   3.115   3.090  -7.285
   91    HE1  TYR  13           1HE      TYR  13   5.579   6.073 -10.384
   92    HE2  TYR  13           2HE      TYR  13   5.472   3.687  -6.816
   93    HH   TYR  13           HH       TYR  13   7.441   4.459  -7.999
   94    H    SER  14           H        SER  14   1.869   5.485  -6.352
   95    HA   SER  14           HA       SER  14   0.633   8.019  -7.296
   96   1HB   SER  14          2HB       SER  14   0.455   7.145  -4.413
   97   2HB   SER  14          1HB       SER  14  -0.433   8.437  -5.214
   98    HG   SER  14           HG       SER  14  -1.400   6.171  -4.830
   99    H    LYS  15           H        LYS  15   2.109   9.643  -7.138
  100    HA   LYS  15           HA       LYS  15   4.767   9.169  -6.082
  101   1HB   LYS  15          2HB       LYS  15   3.242  11.235  -7.549
  102   2HB   LYS  15          1HB       LYS  15   4.574  11.858  -6.577
  103   1HG   LYS  15          2HG       LYS  15   5.363  11.313  -8.834
  104   2HG   LYS  15          1HG       LYS  15   6.102  10.227  -7.655
  105   1HD   LYS  15          2HD       LYS  15   4.158   8.626  -8.159
  106   2HD   LYS  15          1HD       LYS  15   3.839   9.642  -9.565
  107   1HE   LYS  15          2HE       LYS  15   5.294   7.989 -10.428
  108   2HE   LYS  15          1HE       LYS  15   6.409   9.316 -10.041
  109   1HZ   LYS  15          1HZ       LYS  15   6.925   6.998  -9.093
  110   2HZ   LYS  15          2HZ       LYS  15   5.669   7.320  -7.995
  111   3HZ   LYS  15          3HZ       LYS  15   7.031   8.332  -8.053
  112    H    HIS  16           H        HIS  16   4.938   9.033  -3.876
  113    HA   HIS  16           HA       HIS  16   4.926   9.704  -1.622
  114   1HB   HIS  16          2HB       HIS  16   4.594  12.366  -3.038
  115   2HB   HIS  16          1HB       HIS  16   5.074  12.177  -1.353
  116    HD1  HIS  16           1HD      HIS  16   6.901   9.601  -1.972
  117    HD2  HIS  16           2HD      HIS  16   7.154  13.316  -3.845
  118    HE1  HIS  16           1HE      HIS  16   9.248   9.772  -2.908
  119    H    MET  17           H        MET  17   2.497   8.671  -2.330
  120    HA   MET  17           HA       MET  17   0.312  10.539  -1.760
  121   1HB   MET  17          2HB       MET  17  -0.088   8.694  -3.239
  122   2HB   MET  17          1HB       MET  17   0.594   7.541  -2.097
  123   1HG   MET  17          2HG       MET  17  -1.880   7.440  -2.108
  124   2HG   MET  17          1HG       MET  17  -1.266   7.957  -0.540
  125   1HE   MET  17          1HE       MET  17  -2.327   9.119  -4.010
  126   2HE   MET  17          2HE       MET  17  -1.114  10.351  -3.666
  127   3HE   MET  17          3HE       MET  17  -2.810  10.808  -3.799
  128    H    THR  18           H        THR  18  -0.681  10.834   0.231
  129    HA   THR  18           HA       THR  18   0.759  10.053   2.632
  130    HB   THR  18           HB       THR  18  -2.023  11.216   2.434
  131    HG1  THR  18           1HG      THR  18   0.461  12.557   2.164
  132   1HG2  THR  18          1HG2      THR  18   0.196  11.137   4.428
  133   2HG2  THR  18          2HG2      THR  18  -1.547  11.027   4.681
  134   3HG2  THR  18          3HG2      THR  18  -0.799  12.592   4.361
  135    H    ARG  19           H        ARG  19   0.310   8.391   4.024
  136    HA   ARG  19           HA       ARG  19  -1.103   6.070   3.360
  137   1HB   ARG  19          2HB       ARG  19  -0.874   5.556   5.725
  138   2HB   ARG  19          1HB       ARG  19   0.533   6.505   5.246
  139   1HG   ARG  19          2HG       ARG  19  -0.690   8.574   6.060
  140   2HG   ARG  19          1HG       ARG  19  -1.932   7.505   6.717
  141   1HD   ARG  19          2HD       ARG  19  -0.574   7.652   8.590
  142   2HD   ARG  19          1HD       ARG  19   0.268   6.320   7.772
  143    HE   ARG  19           HE       ARG  19   1.448   8.477   6.612
  144   1HH1  ARG  19          1HH2      ARG  19   2.384   6.789   9.125
  145   2HH1  ARG  19          2HH2      ARG  19   2.965   8.083  10.118
  146   1HH2  ARG  19          1HH1      ARG  19   1.468  10.569   8.219
  147   2HH2  ARG  19          2HH1      ARG  19   2.446  10.223   9.607
  148    H    SER  20           H        SER  20  -2.254   8.947   5.046
  149    HA   SER  20           HA       SER  20  -4.877   7.931   5.685
  150   1HB   SER  20          2HB       SER  20  -4.539   9.729   7.007
  151   2HB   SER  20          1HB       SER  20  -3.204  10.274   6.004
  152    HG   SER  20           HG       SER  20  -4.527  11.792   5.399
  153    H    GLN  21           H        GLN  21  -3.563   9.912   3.019
  154    HA   GLN  21           HA       GLN  21  -6.050  10.487   1.727
  155   1HB   GLN  21          2HB       GLN  21  -3.172  10.199   0.843
  156   2HB   GLN  21          1HB       GLN  21  -4.445  10.639  -0.297
  157   1HG   GLN  21          2HG       GLN  21  -4.290  12.145   2.279
  158   2HG   GLN  21          1HG       GLN  21  -3.096  12.505   1.034
  159   1HE2  GLN  21          1HE2      GLN  21  -6.294  13.170   2.048
  160   2HE2  GLN  21          2HE2      GLN  21  -6.837  13.918   0.625
  161    H    ALA  22           H        ALA  22  -3.763   7.763   1.395
  162    HA   ALA  22           HA       ALA  22  -5.184   6.387  -0.669
  163   1HB   ALA  22          1HB       ALA  22  -3.979   4.430   0.855
  164   2HB   ALA  22          2HB       ALA  22  -3.070   5.865   1.329
  165   3HB   ALA  22          3HB       ALA  22  -3.142   5.388  -0.367
  166    H    GLU  23           H        GLU  23  -5.362   6.248   2.869
  167    HA   GLU  23           HA       GLU  23  -7.296   4.198   3.154
  168   1HB   GLU  23          2HB       GLU  23  -6.485   6.651   4.704
  169   2HB   GLU  23          1HB       GLU  23  -7.818   5.651   5.277
  170   1HG   GLU  23          2HG       GLU  23  -5.999   3.722   4.767
  171   2HG   GLU  23          1HG       GLU  23  -4.914   5.050   5.167
  172    H    GLN  24           H        GLN  24  -7.848   7.757   3.004
  173    HA   GLN  24           HA       GLN  24 -10.693   7.520   3.015
  174   1HB   GLN  24          2HB       GLN  24 -10.671   9.851   2.659
  175   2HB   GLN  24          1HB       GLN  24  -9.155   9.539   3.492
  176   1HG   GLN  24          2HG       GLN  24  -7.957   9.572   1.348
  177   2HG   GLN  24          1HG       GLN  24  -9.474   9.844   0.494
  178   1HE2  GLN  24          1HE2      GLN  24  -8.816  11.969  -0.280
  179   2HE2  GLN  24          2HE2      GLN  24  -8.686  13.293   0.774
  180    H    LEU  25           H        LEU  25  -8.419   7.964   0.236
  181    HA   LEU  25           HA       LEU  25 -10.597   7.842  -1.653
  182   1HB   LEU  25          2HB       LEU  25  -8.777   7.596  -3.315
  183   2HB   LEU  25          1HB       LEU  25  -8.424   8.876  -2.159
  184    HG   LEU  25           HG       LEU  25  -7.249   6.874  -0.852
  185   1HD1  LEU  25          1HD1      LEU  25  -6.382   5.941  -3.489
  186   2HD1  LEU  25          2HD1      LEU  25  -8.070   5.563  -3.147
  187   3HD1  LEU  25          3HD1      LEU  25  -6.803   5.015  -2.050
  188   1HD2  LEU  25          1HD2      LEU  25  -5.372   8.040  -1.395
  189   2HD2  LEU  25          2HD2      LEU  25  -6.419   9.029  -2.405
  190   3HD2  LEU  25          3HD2      LEU  25  -5.549   7.666  -3.106
  191    H    LEU  26           H        LEU  26  -8.659   5.408  -0.014
  192    HA   LEU  26           HA       LEU  26  -9.394   3.191  -1.746
  193   1HB   LEU  26          2HB       LEU  26  -8.179   3.645   0.941
  194   2HB   LEU  26          1HB       LEU  26  -8.934   2.082   0.691
  195    HG   LEU  26           HG       LEU  26  -6.902   3.270  -1.215
  196   1HD1  LEU  26          1HD1      LEU  26  -6.576   1.816   1.324
  197   2HD1  LEU  26          2HD1      LEU  26  -5.406   2.776   0.426
  198   3HD1  LEU  26          3HD1      LEU  26  -5.702   1.097  -0.025
  199   1HD2  LEU  26          1HD2      LEU  26  -7.495   0.352  -0.977
  200   2HD2  LEU  26          2HD2      LEU  26  -7.059   1.294  -2.401
  201   3HD2  LEU  26          3HD2      LEU  26  -8.703   1.363  -1.769
  202    H    LYS  27           H        LYS  27 -10.523   4.193   1.516
  203    HA   LYS  27           HA       LYS  27 -12.847   2.564   1.654
  204   1HB   LYS  27          2HB       LYS  27 -11.549   4.455   3.182
  205   2HB   LYS  27          1HB       LYS  27 -13.047   5.288   2.765
  206   1HG   LYS  27          2HG       LYS  27 -14.175   3.015   3.440
  207   2HG   LYS  27          1HG       LYS  27 -12.667   2.741   4.314
  208   1HD   LYS  27          2HD       LYS  27 -13.066   5.168   5.224
  209   2HD   LYS  27          1HD       LYS  27 -14.738   4.876   4.744
  210   1HE   LYS  27          2HE       LYS  27 -13.502   2.642   6.239
  211   2HE   LYS  27          1HE       LYS  27 -13.718   4.135   7.173
  212   1HZ   LYS  27          1HZ       LYS  27 -15.723   2.685   7.126
  213   2HZ   LYS  27          2HZ       LYS  27 -15.821   2.941   5.449
  214   3HZ   LYS  27          3HZ       LYS  27 -15.994   4.247   6.523
  215    H    GLN  28           H        GLN  28 -12.351   5.806   0.286
  216    HA   GLN  28           HA       GLN  28 -15.042   6.441  -0.376
  217   1HB   GLN  28          2HB       GLN  28 -13.094   7.977  -0.410
  218   2HB   GLN  28          1HB       GLN  28 -12.458   7.125  -1.818
  219   1HG   GLN  28          2HG       GLN  28 -13.871   8.193  -3.228
  220   2HG   GLN  28          1HG       GLN  28 -15.252   7.943  -2.159
  221   1HE2  GLN  28          1HE2      GLN  28 -12.168   9.821  -1.895
  222   2HE2  GLN  28          2HE2      GLN  28 -12.921  11.257  -1.391
  223    H    GLU  29           H        GLU  29 -12.554   4.752  -2.354
  224    HA   GLU  29           HA       GLU  29 -14.128   4.408  -4.703
  225   1HB   GLU  29          2HB       GLU  29 -11.588   3.839  -3.962
  226   2HB   GLU  29          1HB       GLU  29 -12.280   2.223  -3.833
  227   1HG   GLU  29          2HG       GLU  29 -11.872   3.936  -6.244
  228   2HG   GLU  29          1HG       GLU  29 -11.642   2.204  -6.051
  229    H    GLY  30           H        GLY  30 -13.810   2.375  -1.792
  230   1HA   GLY  30          2HA       GLY  30 -15.538   1.100  -0.800
  231   2HA   GLY  30          1HA       GLY  30 -16.523   1.423  -2.219
  232    H    LYS  31           H        LYS  31 -13.333   0.216  -2.798
  233    HA   LYS  31           HA       LYS  31 -14.457  -2.275  -3.919
  234   1HB   LYS  31          2HB       LYS  31 -11.588  -1.300  -3.696
  235   2HB   LYS  31          1HB       LYS  31 -12.194  -2.531  -4.799
  236   1HG   LYS  31          2HG       LYS  31 -12.853   0.429  -4.824
  237   2HG   LYS  31          1HG       LYS  31 -11.966  -0.473  -6.050
  238   1HD   LYS  31          2HD       LYS  31 -14.897  -0.773  -5.338
  239   2HD   LYS  31          1HD       LYS  31 -14.233  -0.140  -6.843
  240   1HE   LYS  31          2HE       LYS  31 -13.007  -2.530  -6.867
  241   2HE   LYS  31          1HE       LYS  31 -14.443  -2.973  -5.922
  242   1HZ   LYS  31          1HZ       LYS  31 -14.826  -3.126  -8.339
  243   2HZ   LYS  31          2HZ       LYS  31 -14.503  -1.464  -8.482
  244   3HZ   LYS  31          3HZ       LYS  31 -15.848  -1.998  -7.592
  245    H    GLU  32           H        GLU  32 -13.362  -4.403  -3.319
  246    HA   GLU  32           HA       GLU  32 -12.671  -4.412  -0.407
  247   1HB   GLU  32          2HB       GLU  32 -13.357  -6.876  -0.632
  248   2HB   GLU  32          1HB       GLU  32 -14.636  -5.667  -0.678
  249   1HG   GLU  32          2HG       GLU  32 -15.043  -5.981  -2.937
  250   2HG   GLU  32          1HG       GLU  32 -13.377  -6.452  -3.274
  251    H    GLY  33           H        GLY  33 -10.441  -3.981  -0.921
  252   1HA   GLY  33          2HA       GLY  33  -8.415  -5.445  -0.711
  253   2HA   GLY  33          1HA       GLY  33  -9.039  -6.300  -2.122
  254    H    GLY  34           H        GLY  34  -9.257  -2.802  -1.831
  255   1HA   GLY  34          2HA       GLY  34  -8.073  -2.343  -4.376
  256   2HA   GLY  34          1HA       GLY  34  -8.290  -1.106  -3.135
  257    H    PHE  35           H        PHE  35  -5.962  -1.291  -4.798
  258    HA   PHE  35           HA       PHE  35  -3.920  -1.762  -2.680
  259   1HB   PHE  35          2HB       PHE  35  -3.944  -3.807  -3.874
  260   2HB   PHE  35          1HB       PHE  35  -4.180  -2.998  -5.421
  261    HD1  PHE  35           1HD      PHE  35  -2.309  -1.720  -6.464
  262    HD2  PHE  35           2HD      PHE  35  -1.742  -4.102  -2.936
  263    HE1  PHE  35           1HE      PHE  35   0.144  -1.686  -6.838
  264    HE2  PHE  35           2HE      PHE  35   0.712  -4.069  -3.310
  265    HZ   PHE  35           HZ       PHE  35   1.654  -2.861  -5.258
  266    H    ILE  36           H        ILE  36  -2.571  -0.030  -2.579
  267    HA   ILE  36           HA       ILE  36  -2.069   1.574  -5.061
  268    HB   ILE  36           HB       ILE  36  -2.734   2.494  -2.242
  269   1HG1  ILE  36          2HG1      ILE  36  -4.104   2.940  -4.912
  270   2HG1  ILE  36          1HG1      ILE  36  -4.667   1.857  -3.640
  271   1HG2  ILE  36          1HG2      ILE  36  -2.464   4.789  -3.119
  272   2HG2  ILE  36          2HG2      ILE  36  -1.921   4.134  -4.664
  273   3HG2  ILE  36          3HG2      ILE  36  -0.947   3.894  -3.212
  274   1HD1  ILE  36          1HD1      ILE  36  -5.873   3.670  -2.968
  275   2HD1  ILE  36          2HD1      ILE  36  -4.821   4.806  -3.810
  276   3HD1  ILE  36          3HD1      ILE  36  -4.353   4.174  -2.230
  277    H    VAL  37           H        VAL  37   0.033   2.787  -4.898
  278    HA   VAL  37           HA       VAL  37   1.860   1.795  -2.767
  279    HB   VAL  37           HB       VAL  37   2.424   1.645  -5.741
  280   1HG1  VAL  37          1HG1      VAL  37   4.307   1.990  -3.960
  281   2HG1  VAL  37          2HG1      VAL  37   4.504   0.715  -5.163
  282   3HG1  VAL  37          3HG1      VAL  37   3.976   0.313  -3.528
  283   1HG2  VAL  37          1HG2      VAL  37   0.787  -0.044  -5.198
  284   2HG2  VAL  37          2HG2      VAL  37   1.633  -0.464  -3.708
  285   3HG2  VAL  37          3HG2      VAL  37   2.352  -0.855  -5.271
  286    H    ARG  38           H        ARG  38   3.473   3.284  -2.228
  287    HA   ARG  38           HA       ARG  38   3.847   5.665  -3.981
  288   1HB   ARG  38          2HB       ARG  38   3.487   7.130  -1.996
  289   2HB   ARG  38          1HB       ARG  38   2.039   6.222  -2.429
  290   1HG   ARG  38          2HG       ARG  38   2.023   5.672  -0.214
  291   2HG   ARG  38          1HG       ARG  38   3.232   4.482  -0.695
  292   1HD   ARG  38          2HD       ARG  38   4.735   5.499   0.658
  293   2HD   ARG  38          1HD       ARG  38   4.585   6.976  -0.313
  294    HE   ARG  38           HE       ARG  38   2.298   7.015   1.227
  295   1HH1  ARG  38          1HH1      ARG  38   3.813   5.423   3.262
  296   2HH1  ARG  38          2HH1      ARG  38   4.543   6.665   4.224
  297   1HH2  ARG  38          1HH2      ARG  38   4.037   9.158   1.867
  298   2HH2  ARG  38          2HH2      ARG  38   4.671   8.779   3.434
  299    H    ASP  39           H        ASP  39   5.866   6.745  -3.602
  300    HA   ASP  39           HA       ASP  39   8.028   5.062  -2.700
  301   1HB   ASP  39          2HB       ASP  39   7.862   7.060  -4.400
  302   2HB   ASP  39          1HB       ASP  39   8.198   8.051  -2.980
  303    H    SER  40           H        SER  40   9.611   5.791  -0.973
  304    HA   SER  40           HA       SER  40   8.131   6.829   1.421
  305   1HB   SER  40          2HB       SER  40   8.936   4.443   1.375
  306   2HB   SER  40          1HB       SER  40  10.584   5.052   1.248
  307    HG   SER  40           HG       SER  40  10.216   4.767   3.394
  308    H    SER  41           H        SER  41  10.746   7.006   2.866
  309    HA   SER  41           HA       SER  41  12.169   9.174   1.411
  310   1HB   SER  41          2HB       SER  41  10.276   9.443   3.662
  311   2HB   SER  41          1HB       SER  41  11.799  10.299   3.887
  312    HG   SER  41           HG       SER  41  11.436  11.403   1.997
  313    H    LYS  42           H        LYS  42  11.911   7.669   4.666
  314    HA   LYS  42           HA       LYS  42  14.603   8.011   5.468
  315   1HB   LYS  42          2HB       LYS  42  12.519   5.883   6.031
  316   2HB   LYS  42          1HB       LYS  42  14.044   5.982   6.911
  317   1HG   LYS  42          2HG       LYS  42  13.327   8.512   7.227
  318   2HG   LYS  42          1HG       LYS  42  11.711   7.860   6.950
  319   1HD   LYS  42          2HD       LYS  42  12.610   6.027   8.706
  320   2HD   LYS  42          1HD       LYS  42  13.565   7.414   9.233
  321   1HE   LYS  42          2HE       LYS  42  11.662   8.673   9.804
  322   2HE   LYS  42          1HE       LYS  42  10.597   7.706   8.763
  323   1HZ   LYS  42          1HZ       LYS  42  11.022   5.787  10.180
  324   2HZ   LYS  42          2HZ       LYS  42  10.341   7.057  11.080
  325   3HZ   LYS  42          3HZ       LYS  42  12.005   6.728  11.193
  326    H    ALA  43           H        ALA  43  13.256   4.876   4.393
  327    HA   ALA  43           HA       ALA  43  15.936   3.969   3.543
  328   1HB   ALA  43          1HB       ALA  43  14.984   1.979   4.059
  329   2HB   ALA  43          2HB       ALA  43  13.728   2.232   2.848
  330   3HB   ALA  43          3HB       ALA  43  13.508   2.843   4.487
  331    H    GLY  44           H        GLY  44  13.191   5.481   2.134
  332   1HA   GLY  44          2HA       GLY  44  12.820   6.129  -0.107
  333   2HA   GLY  44          1HA       GLY  44  14.378   5.397  -0.527
  334    H    LYS  45           H        LYS  45  11.988   3.636   1.294
  335    HA   LYS  45           HA       LYS  45  11.866   1.591  -0.814
  336   1HB   LYS  45          2HB       LYS  45  10.812   0.284   0.969
  337   2HB   LYS  45          1HB       LYS  45  12.254   1.084   1.590
  338   1HG   LYS  45          2HG       LYS  45   9.976   2.836   1.885
  339   2HG   LYS  45          1HG       LYS  45   9.615   1.270   2.606
  340   1HD   LYS  45          2HD       LYS  45  11.975   1.474   3.682
  341   2HD   LYS  45          1HD       LYS  45  11.833   3.188   3.286
  342   1HE   LYS  45          2HE       LYS  45  10.807   3.284   5.344
  343   2HE   LYS  45          1HE       LYS  45   9.390   2.735   4.426
  344   1HZ   LYS  45          1HZ       LYS  45   9.937   1.296   6.360
  345   2HZ   LYS  45          2HZ       LYS  45  11.413   0.910   5.611
  346   3HZ   LYS  45          3HZ       LYS  45   9.944   0.472   4.878
  347    H    TYR  46           H        TYR  46   9.388   0.551  -0.729
  348    HA   TYR  46           HA       TYR  46   7.592   2.843  -1.462
  349   1HB   TYR  46          2HB       TYR  46   7.474  -0.041  -2.395
  350   2HB   TYR  46          1HB       TYR  46   6.606   1.329  -3.077
  351    HD1  TYR  46           1HD      TYR  46   9.153   3.214  -2.734
  352    HD2  TYR  46           2HD      TYR  46   8.471  -0.599  -4.580
  353    HE1  TYR  46           1HE      TYR  46  11.041   3.630  -4.283
  354    HE2  TYR  46           2HE      TYR  46  10.363  -0.187  -6.126
  355    HH   TYR  46           HH       TYR  46  11.749   2.840  -6.567
  356    H    THR  47           H        THR  47   5.256   2.452  -1.013
  357    HA   THR  47           HA       THR  47   4.800   0.570   1.280
  358    HB   THR  47           HB       THR  47   3.805   3.413   0.874
  359    HG1  THR  47           1HG      THR  47   5.082   3.746   2.765
  360   1HG2  THR  47          1HG2      THR  47   2.067   2.624   2.131
  361   2HG2  THR  47          2HG2      THR  47   3.221   2.778   3.456
  362   3HG2  THR  47          3HG2      THR  47   2.973   1.214   2.679
  363    H    VAL  48           H        VAL  48   3.009  -0.736   0.994
  364    HA   VAL  48           HA       VAL  48   1.362  -0.253  -1.449
  365    HB   VAL  48           HB       VAL  48   1.917  -2.610   0.363
  366   1HG1  VAL  48          1HG1      VAL  48  -0.371  -2.912  -0.234
  367   2HG1  VAL  48          2HG1      VAL  48   0.541  -3.885  -1.386
  368   3HG1  VAL  48          3HG1      VAL  48  -0.099  -2.316  -1.871
  369   1HG2  VAL  48          1HG2      VAL  48   2.986  -3.532  -1.597
  370   2HG2  VAL  48          2HG2      VAL  48   3.600  -1.893  -1.376
  371   3HG2  VAL  48          3HG2      VAL  48   2.378  -2.219  -2.606
  372    H    SER  49           H        SER  49  -0.360   1.079  -0.913
  373    HA   SER  49           HA       SER  49  -1.777   0.748   1.668
  374   1HB   SER  49          2HB       SER  49  -1.657   2.687  -0.604
  375   2HB   SER  49          1HB       SER  49  -3.144   2.641   0.339
  376    HG   SER  49           HG       SER  49  -1.065   3.958   0.973
  377    H    VAL  50           H        VAL  50  -3.081  -1.110   1.599
  378    HA   VAL  50           HA       VAL  50  -4.889  -1.367  -0.788
  379    HB   VAL  50           HB       VAL  50  -4.808  -3.815  -0.236
  380   1HG1  VAL  50          1HG1      VAL  50  -2.129  -3.839  -0.634
  381   2HG1  VAL  50          2HG1      VAL  50  -2.478  -2.158  -1.035
  382   3HG1  VAL  50          3HG1      VAL  50  -3.287  -3.458  -1.908
  383   1HG2  VAL  50          1HG2      VAL  50  -3.631  -4.647   1.554
  384   2HG2  VAL  50          2HG2      VAL  50  -3.992  -3.059   2.227
  385   3HG2  VAL  50          3HG2      VAL  50  -2.423  -3.364   1.488
  386    H    PHE  51           H        PHE  51  -7.117  -1.550  -0.352
  387    HA   PHE  51           HA       PHE  51  -7.911  -1.857   2.530
  388   1HB   PHE  51          2HB       PHE  51  -8.667   0.272   2.507
  389   2HB   PHE  51          1HB       PHE  51  -7.956   0.457   0.911
  390    HD1  PHE  51           1HD      PHE  51  -9.355  -0.346  -1.116
  391    HD2  PHE  51           2HD      PHE  51 -11.006   0.357   2.784
  392    HE1  PHE  51           1HE      PHE  51 -11.611  -0.152  -2.109
  393    HE2  PHE  51           2HE      PHE  51 -13.268   0.543   1.788
  394    HZ   PHE  51           HZ       PHE  51 -13.570   0.291  -0.657
  395    H    ALA  52           H        ALA  52 -10.396  -2.195   2.664
  396    HA   ALA  52           HA       ALA  52 -11.778  -3.284   0.359
  397   1HB   ALA  52          1HB       ALA  52 -11.706  -5.591   0.883
  398   2HB   ALA  52          2HB       ALA  52 -11.081  -5.286   2.503
  399   3HB   ALA  52          3HB       ALA  52 -10.042  -5.051   1.097
  400    H    LYS  53           H        LYS  53 -13.977  -4.040   0.960
  401    HA   LYS  53           HA       LYS  53 -14.906  -2.760   3.512
  402   1HB   LYS  53          2HB       LYS  53 -16.028  -3.293   0.778
  403   2HB   LYS  53          1HB       LYS  53 -17.142  -3.107   2.132
  404   1HG   LYS  53          2HG       LYS  53 -15.564  -0.995   2.622
  405   2HG   LYS  53          1HG       LYS  53 -15.334  -1.097   0.877
  406   1HD   LYS  53          2HD       LYS  53 -17.822  -1.128   0.599
  407   2HD   LYS  53          1HD       LYS  53 -17.982  -0.872   2.337
  408   1HE   LYS  53          2HE       LYS  53 -17.546   1.348   2.134
  409   2HE   LYS  53          1HE       LYS  53 -16.140   1.046   1.094
  410   1HZ   LYS  53          1HZ       LYS  53 -17.810   2.118  -0.218
  411   2HZ   LYS  53          2HZ       LYS  53 -19.000   1.016   0.289
  412   3HZ   LYS  53          3HZ       LYS  53 -17.728   0.497  -0.711
  413    H    SER  54           H        SER  54 -13.798  -5.232   4.037
  414    HA   SER  54           HA       SER  54 -16.054  -6.772   5.031
  415   1HB   SER  54          2HB       SER  54 -15.697  -8.735   3.567
  416   2HB   SER  54          1HB       SER  54 -16.127  -7.314   2.621
  417    HG   SER  54           HG       SER  54 -14.143  -7.224   1.835
  418    H    THR  55           H        THR  55 -14.292  -6.050   6.735
  419    HA   THR  55           HA       THR  55 -13.018  -8.303   7.853
  420    HB   THR  55           HB       THR  55 -11.513  -6.896   5.726
  421    HG1  THR  55           1HG      THR  55 -11.249  -9.443   6.929
  422   1HG2  THR  55          1HG2      THR  55  -9.344  -7.704   6.968
  423   2HG2  THR  55          2HG2      THR  55 -10.330  -7.505   8.417
  424   3HG2  THR  55          3HG2      THR  55 -10.030  -6.127   7.358
  425    H    GLY  56           H        GLY  56 -13.611  -7.343   9.844
  426   1HA   GLY  56          2HA       GLY  56 -13.262  -5.968  11.731
  427   2HA   GLY  56          1HA       GLY  56 -11.896  -5.244  10.876
  428    H    ASP  57           H        ASP  57 -12.741  -4.021   8.780
  429    HA   ASP  57           HA       ASP  57 -14.945  -2.191   9.638
  430   1HB   ASP  57          2HB       ASP  57 -12.302  -1.719   9.033
  431   2HB   ASP  57          1HB       ASP  57 -13.074  -1.456   7.473
  432    HA   PRO  58           HA       PRO  58 -16.418  -5.014   6.153
  433   1HB   PRO  58          2HB       PRO  58 -19.037  -4.186   7.027
  434   2HB   PRO  58          1HB       PRO  58 -18.297  -5.785   7.133
  435   1HG   PRO  58          2HG       PRO  58 -18.699  -3.826   9.241
  436   2HG   PRO  58          1HG       PRO  58 -18.162  -5.504   9.379
  437   1HD   PRO  58          2HD       PRO  58 -16.564  -3.236   9.817
  438   2HD   PRO  58          1HD       PRO  58 -15.962  -4.890   9.539
  439    H    GLN  59           H        GLN  59 -17.044  -1.696   7.033
  440    HA   GLN  59           HA       GLN  59 -18.133  -1.160   4.306
  441   1HB   GLN  59          2HB       GLN  59 -18.695   1.076   5.447
  442   2HB   GLN  59          1HB       GLN  59 -19.540  -0.348   6.055
  443   1HG   GLN  59          2HG       GLN  59 -18.342  -0.394   8.030
  444   2HG   GLN  59          1HG       GLN  59 -16.925   0.372   7.309
  445   1HE2  GLN  59          1HE2      GLN  59 -16.993   1.920   9.185
  446   2HE2  GLN  59          2HE2      GLN  59 -18.088   3.216   9.153
  447    H    GLY  60           H        GLY  60 -15.131  -1.261   5.624
  448   1HA   GLY  60          2HA       GLY  60 -13.830   0.130   3.617
  449   2HA   GLY  60          1HA       GLY  60 -14.138   1.339   4.856
  450    H    VAL  61           H        VAL  61 -12.390  -1.616   4.120
  451    HA   VAL  61           HA       VAL  61 -10.847  -1.367   6.672
  452    HB   VAL  61           HB       VAL  61 -10.838  -3.540   4.551
  453   1HG1  VAL  61          1HG1      VAL  61  -9.500  -4.773   5.972
  454   2HG1  VAL  61          2HG1      VAL  61 -10.104  -3.961   7.416
  455   3HG1  VAL  61          3HG1      VAL  61  -8.945  -3.146   6.366
  456   1HG2  VAL  61          1HG2      VAL  61 -12.464  -3.257   7.079
  457   2HG2  VAL  61          2HG2      VAL  61 -12.228  -4.798   6.258
  458   3HG2  VAL  61          3HG2      VAL  61 -13.057  -3.479   5.436
  459    H    ILE  62           H        ILE  62  -8.629  -1.040   6.593
  460    HA   ILE  62           HA       ILE  62  -7.326  -0.782   3.934
  461    HB   ILE  62           HB       ILE  62  -6.794   1.437   5.802
  462   1HG1  ILE  62          2HG1      ILE  62  -9.546   1.023   4.587
  463   2HG1  ILE  62          1HG1      ILE  62  -9.169   1.142   6.295
  464   1HG2  ILE  62          1HG2      ILE  62  -7.725   2.330   3.298
  465   2HG2  ILE  62          2HG2      ILE  62  -6.850   0.838   2.964
  466   3HG2  ILE  62          3HG2      ILE  62  -6.044   2.159   3.802
  467   1HD1  ILE  62          1HD1      ILE  62  -9.206   3.295   4.225
  468   2HD1  ILE  62          2HD1      ILE  62  -8.160   3.460   5.635
  469   3HD1  ILE  62          3HD1      ILE  62  -9.902   3.287   5.845
  470    H    ARG  63           H        ARG  63  -4.978  -0.545   4.096
  471    HA   ARG  63           HA       ARG  63  -3.527  -0.816   6.579
  472   1HB   ARG  63          2HB       ARG  63  -4.851  -3.090   5.890
  473   2HB   ARG  63          1HB       ARG  63  -3.345  -3.336   5.005
  474   1HG   ARG  63          2HG       ARG  63  -3.023  -4.299   7.181
  475   2HG   ARG  63          1HG       ARG  63  -2.117  -2.786   7.160
  476   1HD   ARG  63          2HD       ARG  63  -4.378  -1.771   8.098
  477   2HD   ARG  63          1HD       ARG  63  -4.658  -3.445   8.616
  478    HE   ARG  63           HE       ARG  63  -2.150  -3.160   9.488
  479   1HH1  ARG  63          1HH1      ARG  63  -3.167  -0.144   8.939
  480   2HH1  ARG  63          2HH1      ARG  63  -3.306   0.367  10.588
  481   1HH2  ARG  63          1HH2      ARG  63  -3.010  -2.836  11.883
  482   2HH2  ARG  63          2HH2      ARG  63  -3.219  -1.158  12.254
  483    H    HIS  64           H        HIS  64  -1.628   0.196   5.987
  484    HA   HIS  64           HA       HIS  64  -0.774   0.064   3.141
  485   1HB   HIS  64          2HB       HIS  64   0.517   1.709   5.307
  486   2HB   HIS  64          1HB       HIS  64   0.382   2.063   3.586
  487    HD1  HIS  64           1HD      HIS  64  -2.331   2.268   2.815
  488    HD2  HIS  64           2HD      HIS  64  -1.333   3.138   6.766
  489    HE1  HIS  64           1HE      HIS  64  -4.239   3.645   3.746
  490    H    TYR  65           H        TYR  65   0.392  -1.824   2.856
  491    HA   TYR  65           HA       TYR  65   2.322  -2.797   4.850
  492   1HB   TYR  65          2HB       TYR  65   1.968  -3.545   1.941
  493   2HB   TYR  65          1HB       TYR  65   2.668  -4.533   3.218
  494    HD1  TYR  65           1HD      TYR  65   0.631  -3.863   5.399
  495    HD2  TYR  65           2HD      TYR  65   0.151  -4.971   1.275
  496    HE1  TYR  65           1HE      TYR  65  -1.605  -4.801   5.910
  497    HE2  TYR  65           2HE      TYR  65  -2.085  -5.906   1.789
  498    HH   TYR  65           HH       TYR  65  -3.888  -5.257   3.984
  499    H    VAL  66           H        VAL  66   4.383  -1.993   4.959
  500    HA   VAL  66           HA       VAL  66   5.417  -0.513   2.571
  501    HB   VAL  66           HB       VAL  66   6.242  -0.360   5.489
  502   1HG1  VAL  66          1HG1      VAL  66   7.204   1.871   4.574
  503   2HG1  VAL  66          2HG1      VAL  66   7.017   1.138   2.981
  504   3HG1  VAL  66          3HG1      VAL  66   8.069   0.386   4.180
  505   1HG2  VAL  66          1HG2      VAL  66   4.668   1.265   5.815
  506   2HG2  VAL  66          2HG2      VAL  66   3.864   0.530   4.428
  507   3HG2  VAL  66          3HG2      VAL  66   4.897   1.942   4.202
  508    H    VAL  67           H        VAL  67   7.764  -0.744   2.171
  509    HA   VAL  67           HA       VAL  67   8.716  -3.475   2.940
  510    HB   VAL  67           HB       VAL  67   9.255  -1.730   0.519
  511   1HG1  VAL  67          1HG1      VAL  67  10.976  -3.089   0.007
  512   2HG1  VAL  67          2HG1      VAL  67   9.999  -4.527   0.294
  513   3HG1  VAL  67          3HG1      VAL  67  10.854  -3.760   1.632
  514   1HG2  VAL  67          1HG2      VAL  67   6.978  -2.776   0.680
  515   2HG2  VAL  67          2HG2      VAL  67   7.755  -4.357   0.775
  516   3HG2  VAL  67          3HG2      VAL  67   7.922  -3.378  -0.683
  517    H    CYS  68           H        CYS  68  10.607  -3.585   4.053
  518    HA   CYS  68           HA       CYS  68  12.031  -1.086   4.714
  519   1HB   CYS  68          2HB       CYS  68  11.328  -2.916   6.344
  520   2HB   CYS  68          1HB       CYS  68  12.543  -3.946   5.589
  521    HG   CYS  68           HG       CYS  68  13.118  -1.733   7.583
  522    H    SER  69           H        SER  69  14.511  -1.172   4.567
  523    HA   SER  69           HA       SER  69  15.457  -2.928   2.345
  524   1HB   SER  69          2HB       SER  69  16.608  -0.591   1.663
  525   2HB   SER  69          1HB       SER  69  15.025  -1.079   1.057
  526    HG   SER  69           HG       SER  69  14.064   0.202   2.566
  527    H    THR  70           H        THR  70  17.433  -3.746   2.779
  528    HA   THR  70           HA       THR  70  19.035  -2.547   5.001
  529    HB   THR  70           HB       THR  70  18.212  -4.915   5.146
  530    HG1  THR  70           1HG      THR  70  20.143  -5.694   5.843
  531   1HG2  THR  70          1HG2      THR  70  18.705  -5.086   2.505
  532   2HG2  THR  70          2HG2      THR  70  18.649  -6.498   3.559
  533   3HG2  THR  70          3HG2      THR  70  20.200  -5.785   3.123
  534    HA   PRO  71           HA       PRO  71  22.085  -1.191   2.158
  535   1HB   PRO  71          2HB       PRO  71  24.338  -2.087   3.705
  536   2HB   PRO  71          1HB       PRO  71  23.658  -0.460   3.605
  537   1HG   PRO  71          2HG       PRO  71  23.527  -2.253   5.817
  538   2HG   PRO  71          1HG       PRO  71  22.760  -0.669   5.672
  539   1HD   PRO  71          2HD       PRO  71  21.516  -3.296   5.586
  540   2HD   PRO  71          1HD       PRO  71  20.727  -1.701   5.590
  541    H    GLN  72           H        GLN  72  21.617  -4.465   2.610
  542    HA   GLN  72           HA       GLN  72  23.936  -5.270   0.931
  543   1HB   GLN  72          2HB       GLN  72  23.341  -6.584   2.922
  544   2HB   GLN  72          1HB       GLN  72  21.701  -6.788   2.322
  545   1HG   GLN  72          2HG       GLN  72  23.152  -8.787   1.919
  546   2HG   GLN  72          1HG       GLN  72  22.502  -8.103   0.434
  547   1HE2  GLN  72          1HE2      GLN  72  24.099  -8.141  -1.153
  548   2HE2  GLN  72          2HE2      GLN  72  25.738  -7.779  -0.898
  549    H    SER  73           H        SER  73  21.541  -3.585   0.024
  550    HA   SER  73           HA       SER  73  20.231  -3.406  -1.932
  551   1HB   SER  73          2HB       SER  73  22.526  -4.557  -2.666
  552   2HB   SER  73          1HB       SER  73  21.473  -5.944  -2.941
  553    HG   SER  73           HG       SER  73  21.700  -3.579  -4.317
  554    H    GLN  74           H        GLN  74  19.045  -4.636   0.266
  555    HA   GLN  74           HA       GLN  74  17.359  -6.737  -1.039
  556   1HB   GLN  74          2HB       GLN  74  17.924  -6.956   1.865
  557   2HB   GLN  74          1HB       GLN  74  17.818  -8.223   0.649
  558   1HG   GLN  74          2HG       GLN  74  20.034  -7.258  -0.264
  559   2HG   GLN  74          1HG       GLN  74  20.157  -6.426   1.285
  560   1HE2  GLN  74          1HE2      GLN  74  20.167  -7.855   3.270
  561   2HE2  GLN  74          2HE2      GLN  74  20.730  -9.450   3.138
  562    H    TYR  75           H        TYR  75  15.237  -7.006   0.131
  563    HA   TYR  75           HA       TYR  75  14.383  -4.636   1.739
  564   1HB   TYR  75          2HB       TYR  75  12.965  -5.575  -0.767
  565   2HB   TYR  75          1HB       TYR  75  12.598  -4.139   0.183
  566    HD1  TYR  75           1HD      TYR  75  13.789  -2.104  -0.126
  567    HD2  TYR  75           2HD      TYR  75  15.143  -5.713  -2.011
  568    HE1  TYR  75           1HE      TYR  75  15.400  -0.799  -1.473
  569    HE2  TYR  75           2HE      TYR  75  16.759  -4.412  -3.353
  570    HH   TYR  75           HH       TYR  75  17.972  -2.047  -2.992
  571    H    TYR  76           H        TYR  76  12.235  -4.968   2.742
  572    HA   TYR  76           HA       TYR  76  10.684  -7.364   2.549
  573   1HB   TYR  76          2HB       TYR  76  11.472  -8.504   4.622
  574   2HB   TYR  76          1HB       TYR  76  12.762  -8.397   3.434
  575    HD1  TYR  76           1HD      TYR  76  11.392  -6.884   6.524
  576    HD2  TYR  76           2HD      TYR  76  14.754  -7.110   3.871
  577    HE1  TYR  76           1HE      TYR  76  12.777  -5.694   8.190
  578    HE2  TYR  76           2HE      TYR  76  16.144  -5.917   5.535
  579    HH   TYR  76           HH       TYR  76  14.972  -4.170   7.995
  580    H    LEU  77           H        LEU  77   9.060  -7.498   4.312
  581    HA   LEU  77           HA       LEU  77   8.576  -4.839   5.612
  582   1HB   LEU  77          2HB       LEU  77   6.926  -6.349   4.120
  583   2HB   LEU  77          1HB       LEU  77   6.668  -7.174   5.657
  584    HG   LEU  77           HG       LEU  77   6.584  -4.217   5.796
  585   1HD1  LEU  77          1HD1      LEU  77   5.445  -4.776   3.598
  586   2HD1  LEU  77          2HD1      LEU  77   4.406  -3.990   4.788
  587   3HD1  LEU  77          3HD1      LEU  77   4.285  -5.730   4.523
  588   1HD2  LEU  77          1HD2      LEU  77   5.969  -6.179   7.510
  589   2HD2  LEU  77          2HD2      LEU  77   4.401  -6.041   6.713
  590   3HD2  LEU  77          3HD2      LEU  77   5.107  -4.641   7.521
  591    H    ALA  78           H        ALA  78   9.649  -8.013   6.057
  592    HA   ALA  78           HA       ALA  78  10.011  -7.663   8.966
  593   1HB   ALA  78          1HB       ALA  78   8.883 -10.211   7.758
  594   2HB   ALA  78          2HB       ALA  78   7.828  -8.938   8.372
  595   3HB   ALA  78          3HB       ALA  78   8.943  -9.759   9.463
  596    H    GLU  79           H        GLU  79  12.192  -8.107   9.227
  597    HA   GLU  79           HA       GLU  79  13.985  -8.833   7.233
  598   1HB   GLU  79          2HB       GLU  79  13.899  -8.989  10.215
  599   2HB   GLU  79          1HB       GLU  79  15.237  -9.807   9.406
  600   1HG   GLU  79          2HG       GLU  79  15.617  -7.657   8.109
  601   2HG   GLU  79          1HG       GLU  79  14.474  -6.888   9.211
  602    H    LYS  80           H        LYS  80  11.772 -10.924   8.864
  603    HA   LYS  80           HA       LYS  80  12.839 -13.468   8.881
  604   1HB   LYS  80          2HB       LYS  80  10.225 -12.228   8.212
  605   2HB   LYS  80          1HB       LYS  80  10.414 -13.918   7.745
  606   1HG   LYS  80          2HG       LYS  80   9.856 -14.409   9.885
  607   2HG   LYS  80          1HG       LYS  80  11.482 -13.868  10.300
  608   1HD   LYS  80          2HD       LYS  80  10.420 -12.367  11.633
  609   2HD   LYS  80          1HD       LYS  80  10.134 -11.482  10.134
  610   1HE   LYS  80          2HE       LYS  80   7.949 -11.655  10.949
  611   2HE   LYS  80          1HE       LYS  80   8.038 -13.137   9.977
  612   1HZ   LYS  80          1HZ       LYS  80   7.321 -13.777  12.133
  613   2HZ   LYS  80          2HZ       LYS  80   8.529 -12.855  12.891
  614   3HZ   LYS  80          3HZ       LYS  80   8.946 -14.246  12.009
  615    H    HIS  81           H        HIS  81  11.839 -11.634   6.001
  616    HA   HIS  81           HA       HIS  81  13.554 -13.342   4.299
  617   1HB   HIS  81          2HB       HIS  81  11.615 -13.837   2.791
  618   2HB   HIS  81          1HB       HIS  81  11.428 -14.562   4.386
  619    HD1  HIS  81           1HD      HIS  81  10.297 -11.503   2.427
  620    HD2  HIS  81           2HD      HIS  81   9.141 -13.737   5.750
  621    HE1  HIS  81           1HE      HIS  81   8.055 -10.585   3.163
  622    H    LEU  82           H        LEU  82  14.307 -12.112   2.526
  623    HA   LEU  82           HA       LEU  82  12.875  -9.596   1.894
  624   1HB   LEU  82          2HB       LEU  82  14.895  -8.283   2.336
  625   2HB   LEU  82          1HB       LEU  82  14.474  -9.206   3.775
  626    HG   LEU  82           HG       LEU  82  16.431 -10.230   1.731
  627   1HD1  LEU  82          1HD1      LEU  82  17.500  -9.112   4.245
  628   2HD1  LEU  82          2HD1      LEU  82  16.836  -7.911   3.138
  629   3HD1  LEU  82          3HD1      LEU  82  18.126  -8.988   2.603
  630   1HD2  LEU  82          1HD2      LEU  82  16.203 -12.046   3.083
  631   2HD2  LEU  82          2HD2      LEU  82  15.356 -11.115   4.318
  632   3HD2  LEU  82          3HD2      LEU  82  17.119 -11.122   4.272
  633    H    PHE  83           H        PHE  83  13.115  -8.985  -0.247
  634    HA   PHE  83           HA       PHE  83  14.875 -10.722  -1.935
  635   1HB   PHE  83          2HB       PHE  83  12.197  -9.421  -2.209
  636   2HB   PHE  83          1HB       PHE  83  13.155  -9.635  -3.679
  637    HD1  PHE  83           1HD      PHE  83  14.277 -11.998  -3.971
  638    HD2  PHE  83           2HD      PHE  83  10.901 -11.215  -1.436
  639    HE1  PHE  83           1HE      PHE  83  13.684 -14.406  -4.017
  640    HE2  PHE  83           2HE      PHE  83  10.306 -13.621  -1.483
  641    HZ   PHE  83           HZ       PHE  83  11.698 -15.217  -2.773
  642    H    SER  84           H        SER  84  14.760  -8.933  -4.238
  643    HA   SER  84           HA       SER  84  16.658  -6.853  -3.229
  644   1HB   SER  84          2HB       SER  84  16.242  -7.829  -6.064
  645   2HB   SER  84          1HB       SER  84  17.654  -7.015  -5.398
  646    HG   SER  84           HG       SER  84  18.235  -8.824  -4.378
  647    H    THR  85           H        THR  85  13.442  -6.884  -3.904
  648    HA   THR  85           HA       THR  85  13.373  -4.020  -4.452
  649    HB   THR  85           HB       THR  85  12.116  -5.719  -6.598
  650    HG1  THR  85           1HG      THR  85  13.978  -5.764  -7.720
  651   1HG2  THR  85          1HG2      THR  85  12.313  -2.968  -6.007
  652   2HG2  THR  85          2HG2      THR  85  11.651  -3.704  -7.467
  653   3HG2  THR  85          3HG2      THR  85  13.353  -3.243  -7.405
  654    H    ILE  86           H        ILE  86  11.128  -3.190  -4.409
  655    HA   ILE  86           HA       ILE  86   9.449  -4.572  -2.539
  656    HB   ILE  86           HB       ILE  86   9.285  -2.173  -4.323
  657   1HG1  ILE  86          2HG1      ILE  86   8.632  -1.449  -1.763
  658   2HG1  ILE  86          1HG1      ILE  86   9.683  -2.833  -1.480
  659   1HG2  ILE  86          1HG2      ILE  86   7.031  -1.671  -3.340
  660   2HG2  ILE  86          2HG2      ILE  86   6.989  -3.313  -2.700
  661   3HG2  ILE  86          3HG2      ILE  86   7.013  -3.046  -4.443
  662   1HD1  ILE  86          1HD1      ILE  86  10.372  -0.161  -2.411
  663   2HD1  ILE  86          2HD1      ILE  86  10.980  -1.410  -3.497
  664   3HD1  ILE  86          3HD1      ILE  86  11.423  -1.433  -1.790
  665    HA   PRO  87           HA       PRO  87   6.487  -5.335  -6.378
  666   1HB   PRO  87          2HB       PRO  87   8.254  -5.719  -8.618
  667   2HB   PRO  87          1HB       PRO  87   6.966  -4.524  -8.431
  668   1HG   PRO  87          2HG       PRO  87   9.835  -4.125  -8.284
  669   2HG   PRO  87          1HG       PRO  87   8.549  -2.915  -8.266
  670   1HD   PRO  87          2HD       PRO  87  10.192  -3.645  -6.084
  671   2HD   PRO  87          1HD       PRO  87   8.716  -2.655  -6.003
  672    H    GLU  88           H        GLU  88   9.708  -6.749  -7.167
  673    HA   GLU  88           HA       GLU  88   8.812  -9.393  -7.554
  674   1HB   GLU  88          2HB       GLU  88  11.175  -9.957  -7.251
  675   2HB   GLU  88          1HB       GLU  88  11.038  -8.433  -8.125
  676   1HG   GLU  88          2HG       GLU  88  11.257  -7.283  -5.848
  677   2HG   GLU  88          1HG       GLU  88  11.759  -8.854  -5.223
  678    H    LEU  89           H        LEU  89   9.950  -7.852  -4.523
  679    HA   LEU  89           HA       LEU  89   9.859 -10.121  -2.835
  680   1HB   LEU  89          2HB       LEU  89  10.725  -7.758  -2.416
  681   2HB   LEU  89          1HB       LEU  89   9.054  -7.288  -2.109
  682    HG   LEU  89           HG       LEU  89  10.267  -9.630  -0.663
  683   1HD1  LEU  89          1HD1      LEU  89  11.252  -8.284   0.961
  684   2HD1  LEU  89          2HD1      LEU  89  10.279  -6.877   0.536
  685   3HD1  LEU  89          3HD1      LEU  89  11.617  -7.371  -0.502
  686   1HD2  LEU  89          1HD2      LEU  89   7.985  -9.540  -0.218
  687   2HD2  LEU  89          2HD2      LEU  89   7.924  -7.783  -0.365
  688   3HD2  LEU  89          3HD2      LEU  89   8.612  -8.524   1.080
  689    H    ILE  90           H        ILE  90   7.286  -7.622  -3.133
  690    HA   ILE  90           HA       ILE  90   5.284  -8.983  -1.674
  691    HB   ILE  90           HB       ILE  90   5.051  -7.149  -4.086
  692   1HG1  ILE  90          2HG1      ILE  90   6.410  -6.141  -2.322
  693   2HG1  ILE  90          1HG1      ILE  90   4.823  -5.374  -2.334
  694   1HG2  ILE  90          1HG2      ILE  90   2.864  -7.816  -3.820
  695   2HG2  ILE  90          2HG2      ILE  90   2.908  -6.557  -2.588
  696   3HG2  ILE  90          3HG2      ILE  90   3.091  -8.250  -2.126
  697   1HD1  ILE  90          1HD1      ILE  90   4.359  -7.424  -0.610
  698   2HD1  ILE  90          2HD1      ILE  90   4.883  -5.820  -0.098
  699   3HD1  ILE  90          3HD1      ILE  90   6.065  -7.114  -0.285
  700    H    ASN  91           H        ASN  91   6.182  -9.257  -5.104
  701    HA   ASN  91           HA       ASN  91   3.980 -11.002  -5.832
  702   1HB   ASN  91          2HB       ASN  91   5.977  -9.532  -7.091
  703   2HB   ASN  91          1HB       ASN  91   6.449 -11.201  -7.404
  704   1HD2  ASN  91          1HD2      ASN  91   5.223  -9.131  -9.274
  705   2HD2  ASN  91          2HD2      ASN  91   3.837  -9.886  -9.900
  706    H    TYR  92           H        TYR  92   7.360 -11.528  -4.837
  707    HA   TYR  92           HA       TYR  92   7.674 -14.269  -5.314
  708   1HB   TYR  92          2HB       TYR  92   8.621 -12.298  -3.270
  709   2HB   TYR  92          1HB       TYR  92   8.994 -14.001  -3.007
  710    HD1  TYR  92           1HD      TYR  92   9.562 -15.154  -5.517
  711    HD2  TYR  92           2HD      TYR  92  10.425 -11.161  -4.207
  712    HE1  TYR  92           1HE      TYR  92  11.407 -15.008  -7.166
  713    HE2  TYR  92           2HE      TYR  92  12.266 -11.011  -5.851
  714    HH   TYR  92           HH       TYR  92  13.805 -13.128  -7.082
  715    H    HIS  93           H        HIS  93   5.692 -12.687  -2.880
  716    HA   HIS  93           HA       HIS  93   5.309 -14.933  -1.123
  717   1HB   HIS  93          2HB       HIS  93   4.545 -12.237  -1.343
  718   2HB   HIS  93          1HB       HIS  93   3.027 -13.133  -1.375
  719    HD1  HIS  93           1HD      HIS  93   6.154 -12.752   0.746
  720    HD2  HIS  93           2HD      HIS  93   2.255 -14.186   1.093
  721    HE1  HIS  93           1HE      HIS  93   5.808 -13.298   3.194
  722    H    GLN  94           H        GLN  94   3.107 -13.597  -3.628
  723    HA   GLN  94           HA       GLN  94   2.436 -16.218  -4.672
  724   1HB   GLN  94          2HB       GLN  94  -0.072 -15.723  -3.777
  725   2HB   GLN  94          1HB       GLN  94   1.080 -16.709  -2.882
  726   1HG   GLN  94          2HG       GLN  94   1.493 -15.052  -1.316
  727   2HG   GLN  94          1HG       GLN  94   1.115 -13.746  -2.439
  728   1HE2  GLN  94          1HE2      GLN  94  -0.892 -16.626  -1.684
  729   2HE2  GLN  94          2HE2      GLN  94  -2.207 -15.741  -1.077
  730    H    HIS  95           H        HIS  95   0.289 -13.416  -4.125
  731    HA   HIS  95           HA       HIS  95  -0.826 -12.038  -5.687
  732   1HB   HIS  95          2HB       HIS  95   2.046 -12.246  -6.364
  733   2HB   HIS  95          1HB       HIS  95   1.027 -11.618  -7.659
  734    HD1  HIS  95           1HD      HIS  95   0.340 -11.039  -3.990
  735    HD2  HIS  95           2HD      HIS  95   1.687  -8.901  -7.305
  736    HE1  HIS  95           1HE      HIS  95   0.400  -8.605  -3.295
  737    H    ASN  96           H        ASN  96  -2.198 -14.025  -6.217
  738    HA   ASN  96           HA       ASN  96  -1.679 -14.951  -9.025
  739   1HB   ASN  96          2HB       ASN  96  -1.521 -16.598  -7.074
  740   2HB   ASN  96          1HB       ASN  96  -3.258 -16.369  -6.864
  741   1HD2  ASN  96          1HD2      ASN  96  -4.687 -17.144  -8.593
  742   2HD2  ASN  96          2HD2      ASN  96  -4.130 -18.240  -9.764
  743    H    SER  97           H        SER  97  -3.080 -13.855 -10.350
  744    HA   SER  97           HA       SER  97  -5.863 -13.337  -9.355
  745   1HB   SER  97          2HB       SER  97  -3.834 -11.815 -10.878
  746   2HB   SER  97          1HB       SER  97  -5.475 -11.684 -11.502
  747    HG   SER  97           HG       SER  97  -4.482 -10.374  -9.507
  748    H    ALA  98           H        ALA  98  -4.845 -15.827 -10.673
  749    HA   ALA  98           HA       ALA  98  -6.781 -15.858 -12.944
  750   1HB   ALA  98          1HB       ALA  98  -4.073 -17.153 -13.180
  751   2HB   ALA  98          2HB       ALA  98  -4.254 -15.431 -13.516
  752   3HB   ALA  98          3HB       ALA  98  -5.156 -16.614 -14.463
  753    H    GLY  99           H        GLY  99  -6.760 -16.979 -10.166
  754   1HA   GLY  99          2HA       GLY  99  -6.860 -19.886 -10.873
  755   2HA   GLY  99          1HA       GLY  99  -6.402 -19.308  -9.270
  756    H    LEU 100           H        LEU 100  -8.027 -18.650  -7.833
  757    HA   LEU 100           HA       LEU 100 -10.759 -19.559  -8.513
  758   1HB   LEU 100          2HB       LEU 100  -9.343 -19.985  -6.366
  759   2HB   LEU 100          1HB       LEU 100  -9.817 -18.347  -5.915
  760    HG   LEU 100           HG       LEU 100 -12.234 -19.138  -6.471
  761   1HD1  LEU 100          1HD1      LEU 100 -12.317 -21.685  -5.801
  762   2HD1  LEU 100          2HD1      LEU 100 -10.661 -21.695  -6.409
  763   3HD1  LEU 100          3HD1      LEU 100 -11.988 -21.229  -7.473
  764   1HD2  LEU 100          1HD2      LEU 100 -12.553 -19.787  -4.189
  765   2HD2  LEU 100          2HD2      LEU 100 -11.191 -18.669  -4.184
  766   3HD2  LEU 100          3HD2      LEU 100 -10.907 -20.405  -4.064
  767    H    ILE 101           H        ILE 101  -9.277 -16.598  -7.127
  768    HA   ILE 101           HA       ILE 101 -11.018 -14.869  -8.724
  769    HB   ILE 101           HB       ILE 101 -12.544 -15.706  -6.973
  770   1HG1  ILE 101          2HG1      ILE 101 -11.806 -12.881  -6.208
  771   2HG1  ILE 101          1HG1      ILE 101 -12.498 -13.243  -7.791
  772   1HG2  ILE 101          1HG2      ILE 101 -10.473 -14.549  -5.080
  773   2HG2  ILE 101          2HG2      ILE 101 -10.895 -16.252  -5.255
  774   3HG2  ILE 101          3HG2      ILE 101 -12.071 -15.116  -4.595
  775   1HD1  ILE 101          1HD1      ILE 101 -13.767 -14.074  -5.168
  776   2HD1  ILE 101          2HD1      ILE 101 -14.476 -14.201  -6.778
  777   3HD1  ILE 101          3HD1      ILE 101 -14.210 -12.615  -6.054
  778    H    SER 102           H        SER 102 -10.584 -12.531  -8.172
  779    HA   SER 102           HA       SER 102  -7.760 -12.053  -7.782
  780   1HB   SER 102          2HB       SER 102 -10.258 -10.541  -8.297
  781   2HB   SER 102          1HB       SER 102  -8.962  -9.621  -7.538
  782    HG   SER 102           HG       SER 102  -8.760 -11.191  -9.901
  783    H    ARG 103           H        ARG 103  -6.752 -12.050  -5.819
  784    HA   ARG 103           HA       ARG 103  -8.253 -11.885  -3.311
  785   1HB   ARG 103          2HB       ARG 103  -6.243 -13.323  -3.768
  786   2HB   ARG 103          1HB       ARG 103  -5.269 -11.856  -3.867
  787   1HG   ARG 103          2HG       ARG 103  -6.211 -11.298  -1.528
  788   2HG   ARG 103          1HG       ARG 103  -6.702 -12.992  -1.468
  789   1HD   ARG 103          2HD       ARG 103  -4.265 -13.554  -2.093
  790   2HD   ARG 103          1HD       ARG 103  -3.900 -11.870  -1.670
  791    HE   ARG 103           HE       ARG 103  -4.724 -12.321   0.599
  792   1HH1  ARG 103          1HH2      ARG 103  -5.930 -14.896  -1.071
  793   2HH1  ARG 103          2HH2      ARG 103  -5.320 -16.127  -0.017
  794   1HH2  ARG 103          1HH1      ARG 103  -3.297 -13.959   1.779
  795   2HH2  ARG 103          2HH1      ARG 103  -3.830 -15.598   1.598
  796    H    LEU 104           H        LEU 104  -6.005  -9.793  -5.117
  797    HA   LEU 104           HA       LEU 104  -7.118  -7.377  -3.939
  798   1HB   LEU 104          2HB       LEU 104  -5.858  -8.101  -2.019
  799   2HB   LEU 104          1HB       LEU 104  -4.457  -8.497  -3.012
  800    HG   LEU 104           HG       LEU 104  -5.442  -5.695  -3.171
  801   1HD1  LEU 104          1HD1      LEU 104  -3.767  -5.452  -1.058
  802   2HD1  LEU 104          2HD1      LEU 104  -4.524  -6.994  -0.666
  803   3HD1  LEU 104          3HD1      LEU 104  -5.519  -5.555  -0.891
  804   1HD2  LEU 104          1HD2      LEU 104  -3.472  -5.691  -4.286
  805   2HD2  LEU 104          2HD2      LEU 104  -3.008  -7.257  -3.619
  806   3HD2  LEU 104          3HD2      LEU 104  -2.695  -5.782  -2.706
  807    H    LYS 105           H        LYS 105  -7.098  -6.246  -5.869
  808    HA   LYS 105           HA       LYS 105  -4.600  -5.349  -7.012
  809   1HB   LYS 105          2HB       LYS 105  -4.705  -7.753  -7.747
  810   2HB   LYS 105          1HB       LYS 105  -6.195  -7.376  -8.612
  811   1HG   LYS 105          2HG       LYS 105  -4.463  -7.195 -10.239
  812   2HG   LYS 105          1HG       LYS 105  -4.863  -5.535  -9.797
  813   1HD   LYS 105          2HD       LYS 105  -2.978  -5.520  -8.191
  814   2HD   LYS 105          1HD       LYS 105  -2.562  -7.163  -8.680
  815   1HE   LYS 105          2HE       LYS 105  -1.497  -6.430 -10.549
  816   2HE   LYS 105          1HE       LYS 105  -2.840  -5.349 -10.972
  817   1HZ   LYS 105          1HZ       LYS 105  -0.948  -4.806  -8.752
  818   2HZ   LYS 105          2HZ       LYS 105  -2.103  -3.748  -9.410
  819   3HZ   LYS 105          3HZ       LYS 105  -0.737  -4.188 -10.318
  820    H    TYR 106           H        TYR 106  -6.410  -3.597  -6.342
  821    HA   TYR 106           HA       TYR 106  -8.055  -3.054  -8.802
  822   1HB   TYR 106          2HB       TYR 106  -9.380  -3.495  -6.781
  823   2HB   TYR 106          1HB       TYR 106  -8.484  -2.251  -5.912
  824    HD1  TYR 106           1HD      TYR 106  -8.650   0.134  -6.607
  825    HD2  TYR 106           2HD      TYR 106 -11.143  -2.914  -8.311
  826    HE1  TYR 106           1HE      TYR 106 -10.170   1.880  -7.490
  827    HE2  TYR 106           2HE      TYR 106 -12.670  -1.171  -9.194
  828    HH   TYR 106           HH       TYR 106 -12.240   2.239  -8.386
  829    HA   PRO 107           HA       PRO 107  -4.939   0.221  -8.996
  830   1HB   PRO 107          2HB       PRO 107  -6.137   1.050 -11.466
  831   2HB   PRO 107          1HB       PRO 107  -4.619   0.182 -11.225
  832   1HG   PRO 107          2HG       PRO 107  -7.051  -0.845 -12.316
  833   2HG   PRO 107          1HG       PRO 107  -5.555  -1.729 -11.997
  834   1HD   PRO 107          2HD       PRO 107  -8.073  -1.867 -10.549
  835   2HD   PRO 107          1HD       PRO 107  -6.604  -2.844 -10.309
  836    H    VAL 108           H        VAL 108  -5.600   1.730  -7.470
  837    HA   VAL 108           HA       VAL 108  -7.706   3.675  -8.328
  838    HB   VAL 108           HB       VAL 108  -8.261   1.969  -6.457
  839   1HG1  VAL 108          1HG1      VAL 108  -6.522   3.858  -4.862
  840   2HG1  VAL 108          2HG1      VAL 108  -6.029   2.233  -5.334
  841   3HG1  VAL 108          3HG1      VAL 108  -7.403   2.459  -4.251
  842   1HG2  VAL 108          1HG2      VAL 108  -9.746   3.781  -6.685
  843   2HG2  VAL 108          2HG2      VAL 108  -8.517   4.963  -6.235
  844   3HG2  VAL 108          3HG2      VAL 108  -9.219   3.909  -5.008
  845    H    SER 109           H        SER 109  -6.928   5.829  -8.238
  846    HA   SER 109           HA       SER 109  -4.126   6.173  -7.318
  847   1HB   SER 109          2HB       SER 109  -6.048   7.642  -9.103
  848   2HB   SER 109          1HB       SER 109  -4.614   8.465  -8.491
  849    HG   SER 109           HG       SER 109  -3.359   6.797  -9.394
  850    H    GLN 110           H        GLN 110  -6.745   8.573  -7.306
  851    HA   GLN 110           HA       GLN 110  -6.376   8.903  -4.387
  852   1HB   GLN 110          2HB       GLN 110  -6.377  11.212  -6.330
  853   2HB   GLN 110          1HB       GLN 110  -5.798  11.193  -4.665
  854   1HG   GLN 110          2HG       GLN 110  -4.053   9.492  -5.429
  855   2HG   GLN 110          1HG       GLN 110  -4.531   9.884  -7.080
  856   1HE2  GLN 110          1HE2      GLN 110  -1.887  10.449  -5.978
  857   2HE2  GLN 110          2HE2      GLN 110  -1.692  12.134  -5.970
  858    H    GLN 111           H        GLN 111  -7.915  11.536  -4.797
  859    HA   GLN 111           HA       GLN 111 -10.549  10.506  -4.312
  860   1HB   GLN 111          2HB       GLN 111 -11.126  12.936  -4.366
  861   2HB   GLN 111          1HB       GLN 111  -9.698  12.603  -3.382
  862   1HG   GLN 111          2HG       GLN 111  -8.259  13.598  -4.884
  863   2HG   GLN 111          1HG       GLN 111  -9.267  13.201  -6.276
  864   1HE2  GLN 111          1HE2      GLN 111 -10.573  14.868  -7.074
  865   2HE2  GLN 111          2HE2      GLN 111 -10.907  16.311  -6.245
  866    H    ASN 112           H        ASN 112 -10.215   9.229  -6.567
  867    HA   ASN 112           HA       ASN 112 -11.770  10.739  -8.595
  868   1HB   ASN 112          2HB       ASN 112  -9.234  10.468  -8.997
  869   2HB   ASN 112          1HB       ASN 112  -9.586   8.756  -9.238
  870   1HD2  ASN 112          1HD2      ASN 112 -11.422   8.334 -10.919
  871   2HD2  ASN 112          2HD2      ASN 112 -11.453   9.346 -12.282
  872    H    LYS 113           H        LYS 113 -10.789   7.613  -7.255
  873    HA   LYS 113           HA       LYS 113 -11.899   5.540  -7.182
  874   1HB   LYS 113          2HB       LYS 113 -14.358   7.214  -7.744
  875   2HB   LYS 113          1HB       LYS 113 -14.260   5.729  -6.798
  876   1HG   LYS 113          2HG       LYS 113 -13.000   8.392  -6.063
  877   2HG   LYS 113          1HG       LYS 113 -14.422   7.676  -5.306
  878   1HD   LYS 113          2HD       LYS 113 -13.097   6.529  -3.903
  879   2HD   LYS 113          1HD       LYS 113 -12.351   5.710  -5.271
  880   1HE   LYS 113          2HE       LYS 113 -11.268   8.364  -5.150
  881   2HE   LYS 113          1HE       LYS 113 -11.157   7.643  -3.532
  882   1HZ   LYS 113          1HZ       LYS 113  -9.310   7.068  -5.152
  883   2HZ   LYS 113          2HZ       LYS 113 -10.458   6.127  -5.978
  884   3HZ   LYS 113          3HZ       LYS 113 -10.060   5.766  -4.366
  885    H    ASN 114           H        ASN 114 -11.065   4.602  -9.082
  886    HA   ASN 114           HA       ASN 114 -12.955   3.998 -11.167
  887   1HB   ASN 114          2HB       ASN 114 -11.874   5.307 -12.957
  888   2HB   ASN 114          1HB       ASN 114 -12.457   6.370 -11.679
  889   1HD2  ASN 114          1HD2      ASN 114  -9.846   5.999 -13.654
  890   2HD2  ASN 114          2HD2      ASN 114  -8.625   6.613 -12.648
  891    H    ALA 115           H        ALA 115 -11.324   3.294 -13.233
  892    HA   ALA 115           HA       ALA 115  -8.764   2.225 -12.641
  893   1HB   ALA 115          1HB       ALA 115  -9.323   0.591 -11.182
  894   2HB   ALA 115          2HB       ALA 115 -10.086  -0.239 -12.538
  895   3HB   ALA 115          3HB       ALA 115 -11.043   0.814 -11.496
  896    HA   PRO 116           HA       PRO 116 -10.547  -0.193 -16.452
  897   1HB   PRO 116          2HB       PRO 116 -13.172   0.848 -17.000
  898   2HB   PRO 116          1HB       PRO 116 -12.724  -0.808 -16.583
  899   1HG   PRO 116          2HG       PRO 116 -14.107   1.103 -14.952
  900   2HG   PRO 116          1HG       PRO 116 -13.655  -0.554 -14.538
  901   1HD   PRO 116          2HD       PRO 116 -12.515   1.889 -13.528
  902   2HD   PRO 116          1HD       PRO 116 -12.051   0.220 -13.127
  903    H    SER 117           H        SER 117  -9.714   0.747 -18.299
  904    HA   SER 117           HA       SER 117 -10.680   3.331 -19.289
  905   1HB   SER 117          2HB       SER 117  -9.196   3.978 -17.432
  906   2HB   SER 117          1HB       SER 117  -7.896   3.011 -18.123
  907    HG   SER 117           HG       SER 117  -8.126   5.430 -18.595
  908    H    THR 118           H        THR 118  -7.783   1.212 -19.419
  909    HA   THR 118           HA       THR 118  -8.090   1.159 -22.406
  910    HB   THR 118           HB       THR 118  -5.570   1.026 -22.385
  911    HG1  THR 118           1HG      THR 118  -4.637   0.779 -20.539
  912   1HG2  THR 118          1HG2      THR 118  -7.007   3.180 -22.533
  913   2HG2  THR 118          2HG2      THR 118  -5.288   3.353 -22.175
  914   3HG2  THR 118          3HG2      THR 118  -6.476   3.469 -20.877
  Start of MODEL   15
    1    H    THR   1           1H       THR   1  20.478  -9.485 -11.335
    2    HA   THR   1           HA       THR   1  20.626  -7.212  -9.418
    3    HB   THR   1           HB       THR   1  21.202  -6.128 -11.746
    4    HG1  THR   1           1HG      THR   1  22.124  -8.766 -12.164
    5   1HG2  THR   1          1HG2      THR   1  22.855  -7.575  -9.775
    6   2HG2  THR   1          2HG2      THR   1  23.006  -5.925 -10.379
    7   3HG2  THR   1          3HG2      THR   1  23.647  -7.270 -11.322
    8    H    GLU   2           H        GLU   2  18.556  -6.474  -9.139
    9    HA   GLU   2           HA       GLU   2  16.717  -6.510 -11.511
   10   1HB   GLU   2          2HB       GLU   2  16.447  -7.499  -8.716
   11   2HB   GLU   2          1HB       GLU   2  15.031  -6.705  -9.406
   12   1HG   GLU   2          2HG       GLU   2  15.767  -8.297 -11.489
   13   2HG   GLU   2          1HG       GLU   2  16.282  -9.291 -10.126
   14    H    ALA   3           H        ALA   3  15.077  -4.777 -11.438
   15    HA   ALA   3           HA       ALA   3  15.268  -2.640  -9.458
   16   1HB   ALA   3          1HB       ALA   3  16.829  -1.360 -10.484
   17   2HB   ALA   3          2HB       ALA   3  15.980  -1.480 -12.026
   18   3HB   ALA   3          3HB       ALA   3  17.146  -2.719 -11.561
   19    H    GLU   4           H        GLU   4  14.129  -0.567 -10.674
   20    HA   GLU   4           HA       GLU   4  12.099  -1.215 -12.645
   21   1HB   GLU   4          2HB       GLU   4  10.196  -1.113 -11.004
   22   2HB   GLU   4          1HB       GLU   4  11.240  -2.514 -10.761
   23   1HG   GLU   4          2HG       GLU   4  11.633  -1.852  -8.646
   24   2HG   GLU   4          1HG       GLU   4  12.345  -0.357  -9.253
   25    H    ASP   5           H        ASP   5  13.640   0.900 -12.895
   26    HA   ASP   5           HA       ASP   5  12.513   3.238 -11.468
   27   1HB   ASP   5          2HB       ASP   5  14.376   4.402 -12.618
   28   2HB   ASP   5          1HB       ASP   5  14.947   2.959 -11.781
   29    H    SER   6           H        SER   6  10.612   1.993 -13.158
   30    HA   SER   6           HA       SER   6  10.552   3.513 -15.699
   31   1HB   SER   6          2HB       SER   6   8.510   1.614 -14.516
   32   2HB   SER   6          1HB       SER   6   8.723   2.036 -16.213
   33    HG   SER   6           HG       SER   6   9.704  -0.018 -15.226
   34    H    ILE   7           H        ILE   7   8.002   4.187 -16.103
   35    HA   ILE   7           HA       ILE   7   7.403   6.136 -13.912
   36    HB   ILE   7           HB       ILE   7   6.678   6.056 -16.861
   37   1HG1  ILE   7          2HG1      ILE   7   8.616   7.844 -15.357
   38   2HG1  ILE   7          1HG1      ILE   7   9.100   6.441 -16.311
   39   1HG2  ILE   7          1HG2      ILE   7   6.255   8.204 -14.759
   40   2HG2  ILE   7          2HG2      ILE   7   4.989   7.253 -15.535
   41   3HG2  ILE   7          3HG2      ILE   7   5.940   8.396 -16.483
   42   1HD1  ILE   7          1HD1      ILE   7   7.918   7.488 -18.286
   43   2HD1  ILE   7          2HD1      ILE   7   9.332   8.381 -17.725
   44   3HD1  ILE   7          3HD1      ILE   7   7.711   8.942 -17.309
   45    H    GLU   8           H        GLU   8   5.506   4.458 -16.448
   46    HA   GLU   8           HA       GLU   8   3.410   3.394 -16.355
   47   1HB   GLU   8          2HB       GLU   8   4.339   2.989 -13.491
   48   2HB   GLU   8          1HB       GLU   8   3.048   2.084 -14.280
   49   1HG   GLU   8          2HG       GLU   8   4.852   1.576 -16.099
   50   2HG   GLU   8          1HG       GLU   8   6.003   2.032 -14.842
   51    H    MET   9           H        MET   9   3.404   4.579 -12.989
   52    HA   MET   9           HA       MET   9   1.867   5.988 -11.885
   53   1HB   MET   9          2HB       MET   9   2.128   7.292 -14.611
   54   2HB   MET   9          1HB       MET   9   1.416   8.077 -13.201
   55   1HG   MET   9          2HG       MET   9   4.229   6.951 -13.272
   56   2HG   MET   9          1HG       MET   9   3.838   8.649 -13.546
   57   1HE   MET   9          1HE       MET   9   4.223   5.774 -11.642
   58   2HE   MET   9          2HE       MET   9   3.237   5.894 -10.188
   59   3HE   MET   9          3HE       MET   9   4.912   6.439 -10.156
   60    H    TYR  10           H        TYR  10   0.789   3.673 -13.532
   61    HA   TYR  10           HA       TYR  10  -1.571   4.302 -14.941
   62   1HB   TYR  10          2HB       TYR  10  -0.558   2.031 -13.270
   63   2HB   TYR  10          1HB       TYR  10  -2.244   1.992 -13.784
   64    HD1  TYR  10           1HD      TYR  10  -2.517   0.605 -15.635
   65    HD2  TYR  10           2HD      TYR  10   0.936   3.148 -15.414
   66    HE1  TYR  10           1HE      TYR  10  -1.813  -0.154 -17.887
   67    HE2  TYR  10           2HE      TYR  10   1.641   2.391 -17.664
   68    HH   TYR  10           HH       TYR  10   1.287   0.434 -19.139
   69    H    GLU  11           H        GLU  11  -1.845   2.920 -11.672
   70    HA   GLU  11           HA       GLU  11  -3.506   5.216 -10.785
   71   1HB   GLU  11          2HB       GLU  11  -4.649   3.001 -11.998
   72   2HB   GLU  11          1HB       GLU  11  -4.764   2.606 -10.286
   73   1HG   GLU  11          2HG       GLU  11  -6.699   3.837 -10.534
   74   2HG   GLU  11          1HG       GLU  11  -5.571   5.115 -10.103
   75    H    TRP  12           H        TRP  12  -2.840   1.834  -9.844
   76    HA   TRP  12           HA       TRP  12  -2.852   2.280  -7.062
   77   1HB   TRP  12          2HB       TRP  12  -1.733   0.079  -7.000
   78   2HB   TRP  12          1HB       TRP  12  -3.027   0.097  -8.195
   79    HD1  TRP  12           HD       TRP  12  -2.347   0.070 -10.761
   80    HE1  TRP  12           1HE      TRP  12  -0.162  -0.572 -11.964
   81    HE3  TRP  12           3HE      TRP  12   0.879   0.104  -6.802
   82    HZ2  TRP  12           2HZ      TRP  12   2.592  -1.013 -11.332
   83    HZ3  TRP  12           3HZ      TRP  12   3.277  -0.431  -7.133
   84    HH2  TRP  12           HH       TRP  12   4.136  -0.988  -9.389
   85    H    TYR  13           H        TYR  13  -0.125   2.388  -9.369
   86    HA   TYR  13           HA       TYR  13   1.830   2.877  -7.234
   87   1HB   TYR  13          2HB       TYR  13   2.204   1.585  -9.370
   88   2HB   TYR  13          1HB       TYR  13   2.110   3.117 -10.241
   89    HD1  TYR  13           1HD      TYR  13   4.227   3.856 -10.876
   90    HD2  TYR  13           2HD      TYR  13   3.711   2.054  -7.012
   91    HE1  TYR  13           1HE      TYR  13   6.607   4.310 -10.345
   92    HE2  TYR  13           2HE      TYR  13   6.088   2.507  -6.480
   93    HH   TYR  13           HH       TYR  13   7.884   3.941  -7.159
   94    H    SER  14           H        SER  14   2.513   4.842  -6.530
   95    HA   SER  14           HA       SER  14   2.293   7.250  -8.220
   96   1HB   SER  14          2HB       SER  14   1.036   7.413  -5.518
   97   2HB   SER  14          1HB       SER  14   0.679   8.336  -6.973
   98    HG   SER  14           HG       SER  14  -0.895   6.962  -7.212
   99    H    LYS  15           H        LYS  15   4.241   8.167  -7.900
  100    HA   LYS  15           HA       LYS  15   5.889   7.585  -5.585
  101   1HB   LYS  15          2HB       LYS  15   7.580   8.624  -6.841
  102   2HB   LYS  15          1HB       LYS  15   6.505   7.977  -8.072
  103   1HG   LYS  15          2HG       LYS  15   6.707  10.852  -7.131
  104   2HG   LYS  15          1HG       LYS  15   7.047  10.219  -8.736
  105   1HD   LYS  15          2HD       LYS  15   4.676   9.592  -8.992
  106   2HD   LYS  15          1HD       LYS  15   4.330  10.254  -7.395
  107   1HE   LYS  15          2HE       LYS  15   5.699  12.318  -8.721
  108   2HE   LYS  15          1HE       LYS  15   4.582  11.661  -9.932
  109   1HZ   LYS  15          1HZ       LYS  15   3.317  13.179  -8.682
  110   2HZ   LYS  15          2HZ       LYS  15   3.952  12.632  -7.205
  111   3HZ   LYS  15          3HZ       LYS  15   2.878  11.653  -8.086
  112    H    HIS  16           H        HIS  16   3.567   8.828  -4.604
  113    HA   HIS  16           HA       HIS  16   4.641  10.935  -3.003
  114   1HB   HIS  16          2HB       HIS  16   3.726  12.881  -4.056
  115   2HB   HIS  16          1HB       HIS  16   4.526  11.975  -5.334
  116    HD1  HIS  16           1HD      HIS  16   2.131   9.806  -5.532
  117    HD2  HIS  16           2HD      HIS  16   1.764  13.949  -5.809
  118    HE1  HIS  16           1HE      HIS  16  -0.012  10.251  -6.802
  119    H    MET  17           H        MET  17   2.564   8.572  -3.131
  120    HA   MET  17           HA       MET  17   0.089   9.899  -2.247
  121   1HB   MET  17          2HB       MET  17   0.338   7.741  -3.607
  122   2HB   MET  17          1HB       MET  17   0.835   6.974  -2.099
  123   1HG   MET  17          2HG       MET  17  -1.356   8.074  -1.148
  124   2HG   MET  17          1HG       MET  17  -1.837   8.123  -2.844
  125   1HE   MET  17          1HE       MET  17  -0.974   4.912   0.045
  126   2HE   MET  17          2HE       MET  17   0.053   6.272  -0.402
  127   3HE   MET  17          3HE       MET  17   0.273   4.714  -1.193
  128    H    THR  18           H        THR  18  -0.709   9.847  -0.096
  129    HA   THR  18           HA       THR  18   1.369   9.358   1.997
  130    HB   THR  18           HB       THR  18  -1.257  10.842   2.225
  131    HG1  THR  18           1HG      THR  18   1.288  11.839   1.470
  132   1HG2  THR  18          1HG2      THR  18  -0.440  10.681   4.370
  133   2HG2  THR  18          2HG2      THR  18   0.446  12.112   3.846
  134   3HG2  THR  18          3HG2      THR  18   1.233  10.533   3.835
  135    H    ARG  19           H        ARG  19   0.819   8.122   3.865
  136    HA   ARG  19           HA       ARG  19  -0.764   5.805   3.553
  137   1HB   ARG  19          2HB       ARG  19  -0.399   5.557   5.950
  138   2HB   ARG  19          1HB       ARG  19   1.043   6.285   5.246
  139   1HG   ARG  19          2HG       ARG  19   0.078   8.555   5.876
  140   2HG   ARG  19          1HG       ARG  19  -1.163   7.692   6.787
  141   1HD   ARG  19          2HD       ARG  19   1.677   6.903   7.297
  142   2HD   ARG  19          1HD       ARG  19   1.128   8.458   7.952
  143    HE   ARG  19           HE       ARG  19   0.183   5.826   8.802
  144   1HH1  ARG  19          1HH2      ARG  19   0.477   8.742  10.080
  145   2HH1  ARG  19          2HH2      ARG  19  -1.158   8.955  10.610
  146   1HH2  ARG  19          1HH1      ARG  19  -2.381   6.274   8.783
  147   2HH2  ARG  19          2HH1      ARG  19  -2.775   7.557   9.877
  148    H    SER  20           H        SER  20  -1.578   8.906   5.064
  149    HA   SER  20           HA       SER  20  -4.246   8.138   5.870
  150   1HB   SER  20          2HB       SER  20  -3.653   9.944   7.102
  151   2HB   SER  20          1HB       SER  20  -2.386  10.382   5.964
  152    HG   SER  20           HG       SER  20  -3.819  12.013   5.802
  153    H    GLN  21           H        GLN  21  -2.873   9.926   3.106
  154    HA   GLN  21           HA       GLN  21  -5.344  10.622   1.845
  155   1HB   GLN  21          2HB       GLN  21  -2.523  10.098   0.883
  156   2HB   GLN  21          1HB       GLN  21  -3.795  10.661  -0.202
  157   1HG   GLN  21          2HG       GLN  21  -2.993  12.071   2.359
  158   2HG   GLN  21          1HG       GLN  21  -2.423  12.524   0.753
  159   1HE2  GLN  21          1HE2      GLN  21  -4.168  14.118   2.605
  160   2HE2  GLN  21          2HE2      GLN  21  -5.593  14.424   1.736
  161    H    ALA  22           H        ALA  22  -3.206   7.778   1.486
  162    HA   ALA  22           HA       ALA  22  -4.715   6.423  -0.507
  163   1HB   ALA  22          1HB       ALA  22  -3.177   4.766  -0.100
  164   2HB   ALA  22          2HB       ALA  22  -3.467   4.802   1.639
  165   3HB   ALA  22          3HB       ALA  22  -2.405   5.999   0.898
  166    H    GLU  23           H        GLU  23  -4.923   6.305   3.049
  167    HA   GLU  23           HA       GLU  23  -6.988   4.396   3.326
  168   1HB   GLU  23          2HB       GLU  23  -6.098   6.844   4.843
  169   2HB   GLU  23          1HB       GLU  23  -7.493   5.921   5.400
  170   1HG   GLU  23          2HG       GLU  23  -5.844   3.870   5.079
  171   2HG   GLU  23          1HG       GLU  23  -4.617   5.119   5.278
  172    H    GLN  24           H        GLN  24  -7.375   7.967   3.201
  173    HA   GLN  24           HA       GLN  24 -10.219   7.874   3.074
  174   1HB   GLN  24          2HB       GLN  24  -9.965  10.251   2.348
  175   2HB   GLN  24          1HB       GLN  24  -8.980   9.857   3.753
  176   1HG   GLN  24          2HG       GLN  24  -7.025   9.522   2.243
  177   2HG   GLN  24          1HG       GLN  24  -8.025  10.030   0.882
  178   1HE2  GLN  24          1HE2      GLN  24  -6.331  11.163   3.759
  179   2HE2  GLN  24          2HE2      GLN  24  -6.562  12.818   3.465
  180    H    LEU  25           H        LEU  25  -7.826   8.246   0.365
  181    HA   LEU  25           HA       LEU  25  -9.952   8.243  -1.596
  182   1HB   LEU  25          2HB       LEU  25  -8.100   7.939  -3.205
  183   2HB   LEU  25          1HB       LEU  25  -7.716   9.183  -2.023
  184    HG   LEU  25           HG       LEU  25  -6.687   7.078  -0.721
  185   1HD1  LEU  25          1HD1      LEU  25  -7.478   5.852  -3.039
  186   2HD1  LEU  25          2HD1      LEU  25  -6.186   5.264  -1.992
  187   3HD1  LEU  25          3HD1      LEU  25  -5.798   6.245  -3.405
  188   1HD2  LEU  25          1HD2      LEU  25  -5.697   9.271  -2.065
  189   2HD2  LEU  25          2HD2      LEU  25  -4.903   7.943  -2.910
  190   3HD2  LEU  25          3HD2      LEU  25  -4.703   8.123  -1.173
  191    H    LEU  26           H        LEU  26  -8.320   5.719   0.178
  192    HA   LEU  26           HA       LEU  26  -9.069   3.558  -1.645
  193   1HB   LEU  26          2HB       LEU  26  -7.910   3.910   1.080
  194   2HB   LEU  26          1HB       LEU  26  -8.754   2.399   0.793
  195    HG   LEU  26           HG       LEU  26  -6.590   3.476  -1.032
  196   1HD1  LEU  26          1HD1      LEU  26  -6.172   2.551   1.520
  197   2HD1  LEU  26          2HD1      LEU  26  -4.999   2.428   0.211
  198   3HD1  LEU  26          3HD1      LEU  26  -6.050   1.063   0.581
  199   1HD2  LEU  26          1HD2      LEU  26  -8.498   1.700  -1.671
  200   2HD2  LEU  26          2HD2      LEU  26  -7.381   0.600  -0.865
  201   3HD2  LEU  26          3HD2      LEU  26  -6.843   1.535  -2.258
  202    H    LYS  27           H        LYS  27 -10.210   4.495   1.629
  203    HA   LYS  27           HA       LYS  27 -12.618   3.018   1.682
  204   1HB   LYS  27          2HB       LYS  27 -11.265   4.790   3.266
  205   2HB   LYS  27          1HB       LYS  27 -12.654   5.763   2.786
  206   1HG   LYS  27          2HG       LYS  27 -13.291   2.985   3.579
  207   2HG   LYS  27          1HG       LYS  27 -12.683   4.012   4.878
  208   1HD   LYS  27          2HD       LYS  27 -14.479   5.461   4.766
  209   2HD   LYS  27          1HD       LYS  27 -14.765   5.139   3.055
  210   1HE   LYS  27          2HE       LYS  27 -16.561   3.997   4.050
  211   2HE   LYS  27          1HE       LYS  27 -15.349   2.704   3.940
  212   1HZ   LYS  27          1HZ       LYS  27 -15.762   4.498   6.274
  213   2HZ   LYS  27          2HZ       LYS  27 -14.579   3.284   6.158
  214   3HZ   LYS  27          3HZ       LYS  27 -16.226   2.869   6.190
  215    H    GLN  28           H        GLN  28 -11.923   6.213   0.315
  216    HA   GLN  28           HA       GLN  28 -14.567   7.001  -0.374
  217   1HB   GLN  28          2HB       GLN  28 -12.509   8.404  -0.360
  218   2HB   GLN  28          1HB       GLN  28 -11.954   7.563  -1.807
  219   1HG   GLN  28          2HG       GLN  28 -13.091   9.090  -3.016
  220   2HG   GLN  28          1HG       GLN  28 -14.576   8.356  -2.409
  221   1HE2  GLN  28          1HE2      GLN  28 -15.749  10.360  -2.177
  222   2HE2  GLN  28          2HE2      GLN  28 -15.313  11.539  -1.037
  223    H    GLU  29           H        GLU  29 -12.128   5.340  -2.478
  224    HA   GLU  29           HA       GLU  29 -13.841   5.090  -4.749
  225   1HB   GLU  29          2HB       GLU  29 -11.236   4.493  -4.150
  226   2HB   GLU  29          1HB       GLU  29 -11.931   2.872  -4.213
  227   1HG   GLU  29          2HG       GLU  29 -11.755   4.951  -6.384
  228   2HG   GLU  29          1HG       GLU  29 -11.281   3.256  -6.436
  229    H    GLY  30           H        GLY  30 -13.407   3.011  -1.901
  230   1HA   GLY  30          2HA       GLY  30 -15.065   1.651  -0.913
  231   2HA   GLY  30          1HA       GLY  30 -16.093   2.001  -2.292
  232    H    LYS  31           H        LYS  31 -12.977   0.877  -3.188
  233    HA   LYS  31           HA       LYS  31 -14.141  -1.619  -4.225
  234   1HB   LYS  31          2HB       LYS  31 -11.298  -0.560  -4.226
  235   2HB   LYS  31          1HB       LYS  31 -11.943  -1.815  -5.282
  236   1HG   LYS  31          2HG       LYS  31 -12.607   1.133  -5.261
  237   2HG   LYS  31          1HG       LYS  31 -11.992   0.168  -6.597
  238   1HD   LYS  31          2HD       LYS  31 -14.755  -0.028  -5.360
  239   2HD   LYS  31          1HD       LYS  31 -14.366   0.612  -6.955
  240   1HE   LYS  31          2HE       LYS  31 -13.787  -1.532  -7.803
  241   2HE   LYS  31          1HE       LYS  31 -13.661  -2.231  -6.177
  242   1HZ   LYS  31          1HZ       LYS  31 -16.007  -1.816  -5.837
  243   2HZ   LYS  31          2HZ       LYS  31 -15.791  -2.773  -7.223
  244   3HZ   LYS  31          3HZ       LYS  31 -16.142  -1.118  -7.377
  245    H    GLU  32           H        GLU  32 -14.207  -3.476  -2.972
  246    HA   GLU  32           HA       GLU  32 -12.793  -3.688  -0.469
  247   1HB   GLU  32          2HB       GLU  32 -13.614  -6.057  -0.575
  248   2HB   GLU  32          1HB       GLU  32 -14.872  -4.841  -0.783
  249   1HG   GLU  32          2HG       GLU  32 -15.415  -5.770  -2.766
  250   2HG   GLU  32          1HG       GLU  32 -13.803  -5.385  -3.369
  251    H    GLY  33           H        GLY  33 -10.558  -3.482  -0.850
  252   1HA   GLY  33          2HA       GLY  33  -8.616  -5.024  -0.891
  253   2HA   GLY  33          1HA       GLY  33  -9.332  -5.734  -2.337
  254    H    GLY  34           H        GLY  34  -9.457  -2.258  -1.955
  255   1HA   GLY  34          2HA       GLY  34  -8.262  -1.711  -4.447
  256   2HA   GLY  34          1HA       GLY  34  -8.337  -0.547  -3.119
  257    H    PHE  35           H        PHE  35  -6.115  -1.074  -5.018
  258    HA   PHE  35           HA       PHE  35  -4.011  -1.719  -2.982
  259   1HB   PHE  35          2HB       PHE  35  -4.500  -3.643  -4.445
  260   2HB   PHE  35          1HB       PHE  35  -4.236  -2.634  -5.867
  261    HD1  PHE  35           1HD      PHE  35  -1.963  -1.622  -6.262
  262    HD2  PHE  35           2HD      PHE  35  -2.673  -4.606  -3.258
  263    HE1  PHE  35           1HE      PHE  35   0.471  -2.099  -6.163
  264    HE2  PHE  35           2HE      PHE  35  -0.241  -5.085  -3.157
  265    HZ   PHE  35           HZ       PHE  35   1.331  -3.831  -4.610
  266    H    ILE  36           H        ILE  36  -2.569  -0.022  -2.844
  267    HA   ILE  36           HA       ILE  36  -1.895   1.479  -5.336
  268    HB   ILE  36           HB       ILE  36  -2.547   2.830  -2.708
  269   1HG1  ILE  36          2HG1      ILE  36  -4.364   2.390  -5.101
  270   2HG1  ILE  36          1HG1      ILE  36  -4.568   1.656  -3.510
  271   1HG2  ILE  36          1HG2      ILE  36  -2.333   3.801  -5.574
  272   2HG2  ILE  36          2HG2      ILE  36  -1.160   4.094  -4.290
  273   3HG2  ILE  36          3HG2      ILE  36  -2.771   4.806  -4.195
  274   1HD1  ILE  36          1HD1      ILE  36  -5.945   3.474  -3.217
  275   2HD1  ILE  36          2HD1      ILE  36  -5.058   4.466  -4.374
  276   3HD1  ILE  36          3HD1      ILE  36  -4.420   4.224  -2.747
  277    H    VAL  37           H        VAL  37   0.307   1.610  -5.470
  278    HA   VAL  37           HA       VAL  37   1.901   1.325  -2.955
  279    HB   VAL  37           HB       VAL  37   2.623   0.911  -5.873
  280   1HG1  VAL  37          1HG1      VAL  37   4.701   1.268  -4.953
  281   2HG1  VAL  37          2HG1      VAL  37   4.510  -0.421  -4.482
  282   3HG1  VAL  37          3HG1      VAL  37   4.162   0.863  -3.324
  283   1HG2  VAL  37          1HG2      VAL  37   0.979  -0.693  -4.535
  284   2HG2  VAL  37          2HG2      VAL  37   2.485  -1.278  -3.831
  285   3HG2  VAL  37          3HG2      VAL  37   2.236  -1.362  -5.575
  286    H    ARG  38           H        ARG  38   3.561   2.904  -2.534
  287    HA   ARG  38           HA       ARG  38   3.783   5.153  -4.465
  288   1HB   ARG  38          2HB       ARG  38   3.303   6.753  -2.607
  289   2HB   ARG  38          1HB       ARG  38   1.933   5.707  -2.975
  290   1HG   ARG  38          2HG       ARG  38   1.995   5.522  -0.661
  291   2HG   ARG  38          1HG       ARG  38   3.021   4.163  -1.116
  292   1HD   ARG  38          2HD       ARG  38   4.990   5.279  -0.506
  293   2HD   ARG  38          1HD       ARG  38   4.244   6.882  -0.671
  294    HE   ARG  38           HE       ARG  38   3.091   5.095   1.387
  295   1HH1  ARG  38          1HH2      ARG  38   5.955   6.107   1.954
  296   2HH1  ARG  38          2HH2      ARG  38   5.608   7.504   2.917
  297   1HH2  ARG  38          1HH1      ARG  38   2.258   7.609   2.026
  298   2HH2  ARG  38          2HH1      ARG  38   3.513   8.356   2.959
  299    H    ASP  39           H        ASP  39   5.442   6.823  -3.545
  300    HA   ASP  39           HA       ASP  39   7.897   5.329  -2.918
  301   1HB   ASP  39          2HB       ASP  39   7.704   7.199  -4.565
  302   2HB   ASP  39          1HB       ASP  39   7.359   8.298  -3.229
  303    H    SER  40           H        SER  40   9.264   5.791  -1.075
  304    HA   SER  40           HA       SER  40   7.735   6.689   1.335
  305   1HB   SER  40          2HB       SER  40   8.696   4.374   1.186
  306   2HB   SER  40          1HB       SER  40  10.302   5.091   1.075
  307    HG   SER  40           HG       SER  40   8.592   4.831   3.233
  308    H    SER  41           H        SER  41  10.283   6.979   2.842
  309    HA   SER  41           HA       SER  41  11.607   9.292   1.525
  310   1HB   SER  41          2HB       SER  41   9.710  10.298   2.617
  311   2HB   SER  41          1HB       SER  41   9.977   9.352   4.079
  312    HG   SER  41           HG       SER  41  11.609  11.406   2.994
  313    H    LYS  42           H        LYS  42  11.335   7.685   4.731
  314    HA   LYS  42           HA       LYS  42  13.965   8.151   5.641
  315   1HB   LYS  42          2HB       LYS  42  12.051   5.831   6.032
  316   2HB   LYS  42          1HB       LYS  42  13.504   6.067   7.004
  317   1HG   LYS  42          2HG       LYS  42  12.699   8.171   7.845
  318   2HG   LYS  42          1HG       LYS  42  11.352   8.174   6.707
  319   1HD   LYS  42          2HD       LYS  42  10.218   7.325   8.509
  320   2HD   LYS  42          1HD       LYS  42  10.897   5.806   7.924
  321   1HE   LYS  42          2HE       LYS  42  12.625   5.815   9.548
  322   2HE   LYS  42          1HE       LYS  42  12.401   7.541   9.895
  323   1HZ   LYS  42          1HZ       LYS  42  11.306   6.273  11.596
  324   2HZ   LYS  42          2HZ       LYS  42  10.466   5.353  10.441
  325   3HZ   LYS  42          3HZ       LYS  42  10.121   7.006  10.630
  326    H    ALA  43           H        ALA  43  12.890   4.976   4.390
  327    HA   ALA  43           HA       ALA  43  15.664   4.316   3.599
  328   1HB   ALA  43          1HB       ALA  43  13.559   2.458   2.812
  329   2HB   ALA  43          2HB       ALA  43  13.372   2.954   4.494
  330   3HB   ALA  43          3HB       ALA  43  14.880   2.214   3.955
  331    H    GLY  44           H        GLY  44  12.844   5.649   2.162
  332   1HA   GLY  44          2HA       GLY  44  12.488   6.346  -0.068
  333   2HA   GLY  44          1HA       GLY  44  14.097   5.721  -0.472
  334    H    LYS  45           H        LYS  45  11.791   3.771   1.257
  335    HA   LYS  45           HA       LYS  45  11.835   1.769  -0.897
  336   1HB   LYS  45          2HB       LYS  45  10.810   0.370   0.844
  337   2HB   LYS  45          1HB       LYS  45  12.203   1.227   1.501
  338   1HG   LYS  45          2HG       LYS  45   9.845   2.863   1.794
  339   2HG   LYS  45          1HG       LYS  45   9.540   1.267   2.474
  340   1HD   LYS  45          2HD       LYS  45  11.868   1.548   3.600
  341   2HD   LYS  45          1HD       LYS  45  11.661   3.262   3.237
  342   1HE   LYS  45          2HE       LYS  45  10.571   3.299   5.256
  343   2HE   LYS  45          1HE       LYS  45   9.212   2.642   4.322
  344   1HZ   LYS  45          1HZ       LYS  45  10.084   0.407   4.727
  345   2HZ   LYS  45          2HZ       LYS  45   9.708   1.197   6.184
  346   3HZ   LYS  45          3HZ       LYS  45  11.325   1.056   5.684
  347    H    TYR  46           H        TYR  46   9.376   0.581  -0.768
  348    HA   TYR  46           HA       TYR  46   7.509   2.780  -1.600
  349   1HB   TYR  46          2HB       TYR  46   7.543  -0.140  -2.419
  350   2HB   TYR  46          1HB       TYR  46   6.564   1.136  -3.132
  351    HD1  TYR  46           1HD      TYR  46   9.031   3.182  -2.843
  352    HD2  TYR  46           2HD      TYR  46   8.478  -0.666  -4.663
  353    HE1  TYR  46           1HE      TYR  46  10.858   3.678  -4.436
  354    HE2  TYR  46           2HE      TYR  46  10.309  -0.171  -6.255
  355    HH   TYR  46           HH       TYR  46  11.340   2.119  -7.218
  356    H    THR  47           H        THR  47   5.187   2.337  -1.163
  357    HA   THR  47           HA       THR  47   4.748   0.516   1.178
  358    HB   THR  47           HB       THR  47   3.733   3.343   0.722
  359    HG1  THR  47           1HG      THR  47   5.038   3.765   2.542
  360   1HG2  THR  47          1HG2      THR  47   2.932   1.174   2.576
  361   2HG2  THR  47          2HG2      THR  47   2.011   2.565   2.004
  362   3HG2  THR  47          3HG2      THR  47   3.170   2.756   3.319
  363    H    VAL  48           H        VAL  48   3.014  -0.848   0.861
  364    HA   VAL  48           HA       VAL  48   1.334  -0.398  -1.562
  365    HB   VAL  48           HB       VAL  48   1.651  -2.753   0.321
  366   1HG1  VAL  48          1HG1      VAL  48  -0.460  -2.945  -0.786
  367   2HG1  VAL  48          2HG1      VAL  48   0.656  -3.981  -1.677
  368   3HG1  VAL  48          3HG1      VAL  48   0.220  -2.396  -2.318
  369   1HG2  VAL  48          1HG2      VAL  48   2.750  -3.493  -2.065
  370   2HG2  VAL  48          2HG2      VAL  48   3.683  -2.837  -0.720
  371   3HG2  VAL  48          3HG2      VAL  48   3.162  -1.779  -2.032
  372    H    SER  49           H        SER  49  -0.308   1.023  -0.974
  373    HA   SER  49           HA       SER  49  -1.751   0.721   1.583
  374   1HB   SER  49          2HB       SER  49  -1.517   2.638  -0.674
  375   2HB   SER  49          1HB       SER  49  -3.071   2.612   0.151
  376    HG   SER  49           HG       SER  49  -0.507   2.946   1.335
  377    H    VAL  50           H        VAL  50  -3.116  -1.101   1.543
  378    HA   VAL  50           HA       VAL  50  -4.959  -1.298  -0.821
  379    HB   VAL  50           HB       VAL  50  -4.986  -3.761  -0.213
  380   1HG1  VAL  50          1HG1      VAL  50  -2.414  -3.968  -0.886
  381   2HG1  VAL  50          2HG1      VAL  50  -2.601  -2.239  -1.174
  382   3HG1  VAL  50          3HG1      VAL  50  -3.620  -3.392  -2.036
  383   1HG2  VAL  50          1HG2      VAL  50  -3.906  -2.957   2.149
  384   2HG2  VAL  50          2HG2      VAL  50  -2.443  -3.407   1.279
  385   3HG2  VAL  50          3HG2      VAL  50  -3.728  -4.591   1.513
  386    H    PHE  51           H        PHE  51  -7.183  -1.283  -0.338
  387    HA   PHE  51           HA       PHE  51  -7.935  -1.659   2.547
  388   1HB   PHE  51          2HB       PHE  51  -8.520   0.526   2.627
  389   2HB   PHE  51          1HB       PHE  51  -7.916   0.723   0.987
  390    HD1  PHE  51           1HD      PHE  51  -9.465   0.177  -0.962
  391    HD2  PHE  51           2HD      PHE  51 -10.859   0.591   3.079
  392    HE1  PHE  51           1HE      PHE  51 -11.778   0.467  -1.787
  393    HE2  PHE  51           2HE      PHE  51 -13.175   0.875   2.250
  394    HZ   PHE  51           HZ       PHE  51 -13.633   0.812  -0.182
  395    H    ALA  52           H        ALA  52 -10.427  -1.879   2.722
  396    HA   ALA  52           HA       ALA  52 -11.866  -2.813   0.370
  397   1HB   ALA  52          1HB       ALA  52 -10.274  -4.696   1.056
  398   2HB   ALA  52          2HB       ALA  52 -11.978  -5.132   0.933
  399   3HB   ALA  52          3HB       ALA  52 -11.254  -4.851   2.515
  400    H    LYS  53           H        LYS  53 -14.084  -3.656   1.035
  401    HA   LYS  53           HA       LYS  53 -14.953  -2.419   3.632
  402   1HB   LYS  53          2HB       LYS  53 -15.980  -2.357   0.809
  403   2HB   LYS  53          1HB       LYS  53 -17.121  -2.168   2.140
  404   1HG   LYS  53          2HG       LYS  53 -15.442  -0.394   3.033
  405   2HG   LYS  53          1HG       LYS  53 -14.796  -0.407   1.392
  406   1HD   LYS  53          2HD       LYS  53 -16.904   0.260   0.463
  407   2HD   LYS  53          1HD       LYS  53 -17.733  -0.004   1.997
  408   1HE   LYS  53          2HE       LYS  53 -16.962   1.975   2.909
  409   2HE   LYS  53          1HE       LYS  53 -15.446   1.926   1.987
  410   1HZ   LYS  53          1HZ       LYS  53 -16.822   3.585   1.003
  411   2HZ   LYS  53          2HZ       LYS  53 -18.161   2.541   0.950
  412   3HZ   LYS  53          3HZ       LYS  53 -16.816   2.254  -0.048
  413    H    SER  54           H        SER  54 -14.275  -5.098   3.781
  414    HA   SER  54           HA       SER  54 -16.817  -6.378   4.390
  415   1HB   SER  54          2HB       SER  54 -15.626  -6.624   1.748
  416   2HB   SER  54          1HB       SER  54 -15.798  -8.200   2.514
  417    HG   SER  54           HG       SER  54 -17.837  -8.041   2.084
  418    H    THR  55           H        THR  55 -15.223  -6.315   6.339
  419    HA   THR  55           HA       THR  55 -14.324  -8.953   6.943
  420    HB   THR  55           HB       THR  55 -12.575  -8.619   5.316
  421    HG1  THR  55           1HG      THR  55 -11.097  -9.248   6.644
  422   1HG2  THR  55          1HG2      THR  55 -11.914  -6.013   6.708
  423   2HG2  THR  55          2HG2      THR  55 -12.829  -6.129   5.206
  424   3HG2  THR  55          3HG2      THR  55 -11.148  -6.660   5.259
  425    H    GLY  56           H        GLY  56 -11.875  -7.120   8.256
  426   1HA   GLY  56          2HA       GLY  56 -12.894  -7.015  10.869
  427   2HA   GLY  56          1HA       GLY  56 -11.646  -5.913  10.273
  428    H    ASP  57           H        ASP  57 -13.260  -4.763   8.199
  429    HA   ASP  57           HA       ASP  57 -15.390  -3.324   9.724
  430   1HB   ASP  57          2HB       ASP  57 -12.940  -2.314   9.203
  431   2HB   ASP  57          1HB       ASP  57 -13.751  -1.922   7.689
  432    HA   PRO  58           HA       PRO  58 -17.239  -5.186   5.961
  433   1HB   PRO  58          2HB       PRO  58 -19.732  -4.119   6.921
  434   2HB   PRO  58          1HB       PRO  58 -19.205  -5.803   6.868
  435   1HG   PRO  58          2HG       PRO  58 -19.457  -4.092   9.165
  436   2HG   PRO  58          1HG       PRO  58 -18.983  -5.792   9.118
  437   1HD   PRO  58          2HD       PRO  58 -17.312  -3.552   9.704
  438   2HD   PRO  58          1HD       PRO  58 -16.806  -5.247   9.502
  439    H    GLN  59           H        GLN  59 -17.301  -1.914   7.136
  440    HA   GLN  59           HA       GLN  59 -18.200  -1.005   4.420
  441   1HB   GLN  59          2HB       GLN  59 -19.050   1.003   5.720
  442   2HB   GLN  59          1HB       GLN  59 -19.862  -0.521   6.083
  443   1HG   GLN  59          2HG       GLN  59 -18.686  -0.791   8.125
  444   2HG   GLN  59          1HG       GLN  59 -17.490   0.431   7.690
  445   1HE2  GLN  59          1HE2      GLN  59 -20.173  -0.013   9.623
  446   2HE2  GLN  59          2HE2      GLN  59 -20.704   1.595   9.733
  447    H    GLY  60           H        GLY  60 -15.319  -1.400   5.502
  448   1HA   GLY  60          2HA       GLY  60 -13.964   0.531   4.166
  449   2HA   GLY  60          1HA       GLY  60 -14.378   1.366   5.656
  450    H    VAL  61           H        VAL  61 -12.179  -0.789   4.174
  451    HA   VAL  61           HA       VAL  61 -10.746  -1.113   6.784
  452    HB   VAL  61           HB       VAL  61 -11.143  -3.186   4.597
  453   1HG1  VAL  61          1HG1      VAL  61  -9.110  -3.827   5.457
  454   2HG1  VAL  61          2HG1      VAL  61 -10.151  -4.579   6.666
  455   3HG1  VAL  61          3HG1      VAL  61  -9.390  -3.023   7.001
  456   1HG2  VAL  61          1HG2      VAL  61 -13.100  -2.630   6.141
  457   2HG2  VAL  61          2HG2      VAL  61 -12.125  -3.299   7.448
  458   3HG2  VAL  61          3HG2      VAL  61 -12.601  -4.314   6.089
  459    H    ILE  62           H        ILE  62  -8.566  -0.817   6.635
  460    HA   ILE  62           HA       ILE  62  -7.325  -0.593   3.934
  461    HB   ILE  62           HB       ILE  62  -6.594   1.487   5.903
  462   1HG1  ILE  62          2HG1      ILE  62  -9.373   1.334   4.690
  463   2HG1  ILE  62          1HG1      ILE  62  -8.985   1.308   6.401
  464   1HG2  ILE  62          1HG2      ILE  62  -5.843   2.316   3.946
  465   2HG2  ILE  62          2HG2      ILE  62  -7.515   2.528   3.431
  466   3HG2  ILE  62          3HG2      ILE  62  -6.658   1.036   3.052
  467   1HD1  ILE  62          1HD1      ILE  62  -8.467   3.607   4.517
  468   2HD1  ILE  62          2HD1      ILE  62  -8.049   3.570   6.231
  469   3HD1  ILE  62          3HD1      ILE  62  -9.740   3.528   5.734
  470    H    ARG  63           H        ARG  63  -4.956  -0.534   4.030
  471    HA   ARG  63           HA       ARG  63  -3.482  -1.078   6.463
  472   1HB   ARG  63          2HB       ARG  63  -4.966  -3.197   5.451
  473   2HB   ARG  63          1HB       ARG  63  -3.367  -3.476   4.761
  474   1HG   ARG  63          2HG       ARG  63  -2.339  -3.463   6.942
  475   2HG   ARG  63          1HG       ARG  63  -3.836  -2.918   7.701
  476   1HD   ARG  63          2HD       ARG  63  -4.806  -5.136   6.572
  477   2HD   ARG  63          1HD       ARG  63  -3.110  -5.644   6.698
  478    HE   ARG  63           HE       ARG  63  -3.555  -4.558   9.168
  479   1HH1  ARG  63          1HH1      ARG  63  -4.130  -7.469   7.680
  480   2HH1  ARG  63          2HH1      ARG  63  -5.319  -8.032   8.807
  481   1HH2  ARG  63          1HH2      ARG  63  -5.601  -4.985  10.438
  482   2HH2  ARG  63          2HH2      ARG  63  -6.151  -6.626  10.370
  483    H    HIS  64           H        HIS  64  -1.676   0.088   5.820
  484    HA   HIS  64           HA       HIS  64  -0.791  -0.067   2.989
  485   1HB   HIS  64          2HB       HIS  64   0.510   1.606   5.116
  486   2HB   HIS  64          1HB       HIS  64   0.277   1.968   3.407
  487    HD1  HIS  64           1HD      HIS  64  -2.369   2.310   2.711
  488    HD2  HIS  64           2HD      HIS  64  -1.408   2.761   6.743
  489    HE1  HIS  64           1HE      HIS  64  -4.297   3.563   3.772
  490    H    TYR  65           H        TYR  65   0.420  -1.924   2.704
  491    HA   TYR  65           HA       TYR  65   2.343  -2.861   4.723
  492   1HB   TYR  65          2HB       TYR  65   2.111  -3.650   1.819
  493   2HB   TYR  65          1HB       TYR  65   2.692  -4.626   3.162
  494    HD1  TYR  65           1HD      TYR  65   0.533  -3.886   5.182
  495    HD2  TYR  65           2HD      TYR  65   0.302  -5.027   1.047
  496    HE1  TYR  65           1HE      TYR  65  -1.751  -4.761   5.552
  497    HE2  TYR  65           2HE      TYR  65  -1.984  -5.902   1.419
  498    HH   TYR  65           HH       TYR  65  -3.260  -6.493   4.449
  499    H    VAL  66           H        VAL  66   4.376  -1.990   4.859
  500    HA   VAL  66           HA       VAL  66   5.408  -0.515   2.471
  501    HB   VAL  66           HB       VAL  66   6.185  -0.322   5.400
  502   1HG1  VAL  66          1HG1      VAL  66   6.941   1.224   2.911
  503   2HG1  VAL  66          2HG1      VAL  66   8.012   0.435   4.070
  504   3HG1  VAL  66          3HG1      VAL  66   7.143   1.900   4.527
  505   1HG2  VAL  66          1HG2      VAL  66   3.809   0.510   4.281
  506   2HG2  VAL  66          2HG2      VAL  66   4.817   1.943   4.086
  507   3HG2  VAL  66          3HG2      VAL  66   4.564   1.256   5.690
  508    H    VAL  67           H        VAL  67   7.854  -0.623   2.257
  509    HA   VAL  67           HA       VAL  67   8.813  -3.366   2.993
  510    HB   VAL  67           HB       VAL  67   9.317  -1.642   0.552
  511   1HG1  VAL  67          1HG1      VAL  67  10.172  -4.347   0.226
  512   2HG1  VAL  67          2HG1      VAL  67  10.888  -3.735   1.717
  513   3HG1  VAL  67          3HG1      VAL  67  11.155  -2.883   0.197
  514   1HG2  VAL  67          1HG2      VAL  67   7.608  -4.048   1.150
  515   2HG2  VAL  67          2HG2      VAL  67   8.227  -3.792  -0.482
  516   3HG2  VAL  67          3HG2      VAL  67   7.186  -2.581   0.267
  517    H    CYS  68           H        CYS  68  10.616  -3.373   4.247
  518    HA   CYS  68           HA       CYS  68  12.067  -0.855   4.743
  519   1HB   CYS  68          2HB       CYS  68  11.321  -2.556   6.491
  520   2HB   CYS  68          1HB       CYS  68  12.543  -3.645   5.835
  521    HG   CYS  68           HG       CYS  68  14.213  -2.429   7.190
  522    H    SER  69           H        SER  69  14.532  -0.942   4.620
  523    HA   SER  69           HA       SER  69  15.495  -2.858   2.539
  524   1HB   SER  69          2HB       SER  69  16.697  -0.638   1.702
  525   2HB   SER  69          1HB       SER  69  15.055  -1.030   1.191
  526    HG   SER  69           HG       SER  69  14.703   0.900   2.005
  527    H    THR  70           H        THR  70  17.471  -3.673   3.025
  528    HA   THR  70           HA       THR  70  19.012  -2.464   5.278
  529    HB   THR  70           HB       THR  70  18.288  -4.852   5.364
  530    HG1  THR  70           1HG      THR  70  21.074  -4.783   4.950
  531   1HG2  THR  70          1HG2      THR  70  20.213  -5.810   3.400
  532   2HG2  THR  70          2HG2      THR  70  18.941  -4.839   2.660
  533   3HG2  THR  70          3HG2      THR  70  18.523  -6.256   3.625
  534    HA   PRO  71           HA       PRO  71  22.082  -0.941   2.533
  535   1HB   PRO  71          2HB       PRO  71  24.322  -1.800   4.121
  536   2HB   PRO  71          1HB       PRO  71  23.593  -0.193   4.037
  537   1HG   PRO  71          2HG       PRO  71  23.464  -2.038   6.208
  538   2HG   PRO  71          1HG       PRO  71  22.656  -0.473   6.078
  539   1HD   PRO  71          2HD       PRO  71  21.486  -3.127   5.909
  540   2HD   PRO  71          1HD       PRO  71  20.655  -1.554   5.918
  541    H    GLN  72           H        GLN  72  21.656  -4.222   2.880
  542    HA   GLN  72           HA       GLN  72  24.061  -4.963   1.295
  543   1HB   GLN  72          2HB       GLN  72  23.378  -6.327   3.226
  544   2HB   GLN  72          1HB       GLN  72  21.777  -6.540   2.531
  545   1HG   GLN  72          2HG       GLN  72  23.259  -8.511   2.157
  546   2HG   GLN  72          1HG       GLN  72  22.714  -7.784   0.650
  547   1HE2  GLN  72          1HE2      GLN  72  24.603  -8.481  -0.566
  548   2HE2  GLN  72          2HE2      GLN  72  26.141  -7.819  -0.288
  549    H    SER  73           H        SER  73  21.691  -3.279   0.316
  550    HA   SER  73           HA       SER  73  20.473  -3.064  -1.695
  551   1HB   SER  73          2HB       SER  73  22.822  -4.464  -2.225
  552   2HB   SER  73          1HB       SER  73  21.575  -5.492  -2.924
  553    HG   SER  73           HG       SER  73  22.222  -2.804  -3.493
  554    H    GLN  74           H        GLN  74  19.193  -4.352   0.411
  555    HA   GLN  74           HA       GLN  74  17.585  -6.431  -1.020
  556   1HB   GLN  74          2HB       GLN  74  18.025  -6.745   1.893
  557   2HB   GLN  74          1HB       GLN  74  18.005  -7.970   0.631
  558   1HG   GLN  74          2HG       GLN  74  20.246  -6.959  -0.133
  559   2HG   GLN  74          1HG       GLN  74  20.272  -6.142   1.429
  560   1HE2  GLN  74          1HE2      GLN  74  20.654  -9.241  -0.178
  561   2HE2  GLN  74          2HE2      GLN  74  21.069 -10.129   1.207
  562    H    TYR  75           H        TYR  75  15.429  -6.780   0.131
  563    HA   TYR  75           HA       TYR  75  14.505  -4.420   1.718
  564   1HB   TYR  75          2HB       TYR  75  13.148  -5.404  -0.802
  565   2HB   TYR  75          1HB       TYR  75  12.726  -3.979   0.137
  566    HD1  TYR  75           1HD      TYR  75  13.872  -1.911  -0.154
  567    HD2  TYR  75           2HD      TYR  75  15.352  -5.487  -2.004
  568    HE1  TYR  75           1HE      TYR  75  15.478  -0.568  -1.471
  569    HE2  TYR  75           2HE      TYR  75  16.963  -4.150  -3.316
  570    HH   TYR  75           HH       TYR  75  18.079  -1.949  -3.171
  571    H    TYR  76           H        TYR  76  12.368  -4.787   2.703
  572    HA   TYR  76           HA       TYR  76  10.846  -7.196   2.521
  573   1HB   TYR  76          2HB       TYR  76  11.639  -8.342   4.575
  574   2HB   TYR  76          1HB       TYR  76  12.946  -8.195   3.412
  575    HD1  TYR  76           1HD      TYR  76  14.914  -6.891   3.911
  576    HD2  TYR  76           2HD      TYR  76  11.492  -6.737   6.490
  577    HE1  TYR  76           1HE      TYR  76  16.252  -5.706   5.621
  578    HE2  TYR  76           2HE      TYR  76  12.822  -5.550   8.201
  579    HH   TYR  76           HH       TYR  76  14.888  -4.884   8.798
  580    H    LEU  77           H        LEU  77   9.159  -7.285   4.172
  581    HA   LEU  77           HA       LEU  77   8.717  -4.667   5.559
  582   1HB   LEU  77          2HB       LEU  77   6.921  -5.431   4.089
  583   2HB   LEU  77          1HB       LEU  77   6.955  -7.038   4.811
  584    HG   LEU  77           HG       LEU  77   6.272  -6.017   6.996
  585   1HD1  LEU  77          1HD1      LEU  77   5.419  -3.544   5.560
  586   2HD1  LEU  77          2HD1      LEU  77   7.118  -3.668   6.013
  587   3HD1  LEU  77          3HD1      LEU  77   5.865  -3.762   7.251
  588   1HD2  LEU  77          1HD2      LEU  77   4.703  -6.821   4.990
  589   2HD2  LEU  77          2HD2      LEU  77   4.229  -5.123   4.999
  590   3HD2  LEU  77          3HD2      LEU  77   4.022  -6.103   6.450
  591    H    ALA  78           H        ALA  78   9.861  -7.757   5.940
  592    HA   ALA  78           HA       ALA  78  10.003  -7.581   8.870
  593   1HB   ALA  78          1HB       ALA  78   8.272  -9.418   7.302
  594   2HB   ALA  78          2HB       ALA  78   8.145  -8.943   8.996
  595   3HB   ALA  78          3HB       ALA  78   9.270 -10.214   8.519
  596    H    GLU  79           H        GLU  79  12.190  -7.963   9.164
  597    HA   GLU  79           HA       GLU  79  14.062  -8.675   7.246
  598   1HB   GLU  79          2HB       GLU  79  13.861  -8.883  10.224
  599   2HB   GLU  79          1HB       GLU  79  15.248  -9.645   9.444
  600   1HG   GLU  79          2HG       GLU  79  15.640  -7.463   8.227
  601   2HG   GLU  79          1HG       GLU  79  14.411  -6.745   9.268
  602    H    LYS  80           H        LYS  80  11.810 -10.786   8.797
  603    HA   LYS  80           HA       LYS  80  12.877 -13.327   8.833
  604   1HB   LYS  80          2HB       LYS  80  10.284 -12.092   8.074
  605   2HB   LYS  80          1HB       LYS  80  10.495 -13.784   7.622
  606   1HG   LYS  80          2HG       LYS  80  10.693 -14.495   9.834
  607   2HG   LYS  80          1HG       LYS  80  11.231 -12.912  10.399
  608   1HD   LYS  80          2HD       LYS  80   8.759 -12.272   9.476
  609   2HD   LYS  80          1HD       LYS  80   8.479 -13.936   9.987
  610   1HE   LYS  80          2HE       LYS  80  10.059 -12.514  11.975
  611   2HE   LYS  80          1HE       LYS  80   8.523 -11.681  11.660
  612   1HZ   LYS  80          1HZ       LYS  80   7.441 -13.908  11.777
  613   2HZ   LYS  80          2HZ       LYS  80   8.086 -13.373  13.254
  614   3HZ   LYS  80          3HZ       LYS  80   8.908 -14.545  12.339
  615    H    HIS  81           H        HIS  81  11.975 -11.482   5.928
  616    HA   HIS  81           HA       HIS  81  13.758 -13.160   4.279
  617   1HB   HIS  81          2HB       HIS  81  11.691 -13.450   2.674
  618   2HB   HIS  81          1HB       HIS  81  11.872 -14.541   4.043
  619    HD1  HIS  81           1HD      HIS  81  10.533 -10.970   4.064
  620    HD2  HIS  81           2HD      HIS  81   9.241 -14.851   4.872
  621    HE1  HIS  81           1HE      HIS  81   8.202 -10.762   5.028
  622    H    LEU  82           H        LEU  82  14.604 -11.875   2.613
  623    HA   LEU  82           HA       LEU  82  13.104  -9.417   1.889
  624   1HB   LEU  82          2HB       LEU  82  15.062  -8.050   2.394
  625   2HB   LEU  82          1HB       LEU  82  14.640  -8.993   3.819
  626    HG   LEU  82           HG       LEU  82  16.683  -9.932   1.816
  627   1HD1  LEU  82          1HD1      LEU  82  16.966  -7.615   3.256
  628   2HD1  LEU  82          2HD1      LEU  82  18.309  -8.638   2.751
  629   3HD1  LEU  82          3HD1      LEU  82  17.640  -8.803   4.371
  630   1HD2  LEU  82          1HD2      LEU  82  16.496 -11.768   3.146
  631   2HD2  LEU  82          2HD2      LEU  82  15.569 -10.886   4.359
  632   3HD2  LEU  82          3HD2      LEU  82  17.330 -10.817   4.375
  633    H    PHE  83           H        PHE  83  13.378  -8.826  -0.245
  634    HA   PHE  83           HA       PHE  83  15.210 -10.531  -1.882
  635   1HB   PHE  83          2HB       PHE  83  12.508  -9.309  -2.185
  636   2HB   PHE  83          1HB       PHE  83  13.493  -9.427  -3.648
  637    HD1  PHE  83           1HD      PHE  83  11.605 -11.268  -1.129
  638    HD2  PHE  83           2HD      PHE  83  14.376 -11.635  -4.388
  639    HE1  PHE  83           1HE      PHE  83  11.101 -13.692  -1.284
  640    HE2  PHE  83           2HE      PHE  83  13.873 -14.059  -4.547
  641    HZ   PHE  83           HZ       PHE  83  12.235 -15.088  -2.993
  642    H    SER  84           H        SER  84  15.063  -8.736  -4.192
  643    HA   SER  84           HA       SER  84  16.933  -6.629  -3.183
  644   1HB   SER  84          2HB       SER  84  17.950  -8.106  -4.740
  645   2HB   SER  84          1HB       SER  84  16.538  -8.099  -5.794
  646    HG   SER  84           HG       SER  84  18.269  -5.911  -5.245
  647    H    THR  85           H        THR  85  13.721  -6.742  -3.893
  648    HA   THR  85           HA       THR  85  13.583  -3.880  -4.454
  649    HB   THR  85           HB       THR  85  12.462  -5.694  -6.599
  650    HG1  THR  85           1HG      THR  85  14.338  -5.469  -7.725
  651   1HG2  THR  85          1HG2      THR  85  13.412  -3.134  -7.467
  652   2HG2  THR  85          2HG2      THR  85  12.409  -2.909  -6.034
  653   3HG2  THR  85          3HG2      THR  85  11.758  -3.742  -7.446
  654    H    ILE  86           H        ILE  86  11.312  -3.113  -4.400
  655    HA   ILE  86           HA       ILE  86   9.668  -4.565  -2.553
  656    HB   ILE  86           HB       ILE  86   9.476  -2.131  -4.274
  657   1HG1  ILE  86          2HG1      ILE  86   8.734  -1.462  -1.745
  658   2HG1  ILE  86          1HG1      ILE  86   9.737  -2.874  -1.426
  659   1HG2  ILE  86          1HG2      ILE  86   7.225  -3.105  -4.478
  660   2HG2  ILE  86          2HG2      ILE  86   7.182  -1.695  -3.422
  661   3HG2  ILE  86          3HG2      ILE  86   7.148  -3.316  -2.729
  662   1HD1  ILE  86          1HD1      ILE  86  11.654  -1.857  -2.171
  663   2HD1  ILE  86          2HD1      ILE  86  10.775  -0.406  -1.689
  664   3HD1  ILE  86          3HD1      ILE  86  10.799  -0.901  -3.380
  665    HA   PRO  87           HA       PRO  87   6.702  -5.337  -6.384
  666   1HB   PRO  87          2HB       PRO  87   8.460  -5.593  -8.652
  667   2HB   PRO  87          1HB       PRO  87   7.130  -4.452  -8.419
  668   1HG   PRO  87          2HG       PRO  87   9.983  -3.950  -8.282
  669   2HG   PRO  87          1HG       PRO  87   8.654  -2.789  -8.221
  670   1HD   PRO  87          2HD       PRO  87  10.339  -3.514  -6.071
  671   2HD   PRO  87          1HD       PRO  87   8.824  -2.591  -5.951
  672    H    GLU  88           H        GLU  88  10.007  -6.608  -7.086
  673    HA   GLU  88           HA       GLU  88   9.184  -9.273  -7.605
  674   1HB   GLU  88          2HB       GLU  88  11.532  -9.770  -7.405
  675   2HB   GLU  88          1HB       GLU  88  11.412  -8.136  -8.050
  676   1HG   GLU  88          2HG       GLU  88  11.697  -7.254  -5.727
  677   2HG   GLU  88          1HG       GLU  88  11.963  -8.908  -5.173
  678    H    LEU  89           H        LEU  89  10.202  -7.760  -4.523
  679    HA   LEU  89           HA       LEU  89  10.121 -10.074  -2.881
  680   1HB   LEU  89          2HB       LEU  89  10.918  -7.656  -2.441
  681   2HB   LEU  89          1HB       LEU  89   9.235  -7.298  -2.058
  682    HG   LEU  89           HG       LEU  89  10.720  -9.579  -0.752
  683   1HD1  LEU  89          1HD1      LEU  89  10.339  -6.878   0.531
  684   2HD1  LEU  89          2HD1      LEU  89  11.771  -7.210  -0.445
  685   3HD1  LEU  89          3HD1      LEU  89  11.439  -8.176   0.993
  686   1HD2  LEU  89          1HD2      LEU  89   8.432  -9.834  -0.344
  687   2HD2  LEU  89          2HD2      LEU  89   8.141  -8.095  -0.331
  688   3HD2  LEU  89          3HD2      LEU  89   8.932  -8.867   1.042
  689    H    ILE  90           H        ILE  90   7.517  -7.629  -3.355
  690    HA   ILE  90           HA       ILE  90   5.490  -8.947  -1.885
  691    HB   ILE  90           HB       ILE  90   5.349  -7.258  -4.407
  692   1HG1  ILE  90          2HG1      ILE  90   4.813  -6.269  -1.627
  693   2HG1  ILE  90          1HG1      ILE  90   6.488  -6.473  -2.142
  694   1HG2  ILE  90          1HG2      ILE  90   3.270  -8.232  -2.464
  695   2HG2  ILE  90          2HG2      ILE  90   3.184  -8.124  -4.223
  696   3HG2  ILE  90          3HG2      ILE  90   3.069  -6.662  -3.244
  697   1HD1  ILE  90          1HD1      ILE  90   6.269  -4.904  -3.889
  698   2HD1  ILE  90          2HD1      ILE  90   5.363  -4.175  -2.565
  699   3HD1  ILE  90          3HD1      ILE  90   4.509  -4.997  -3.870
  700    H    ASN  91           H        ASN  91   6.638  -9.487  -5.189
  701    HA   ASN  91           HA       ASN  91   4.501 -11.286  -5.976
  702   1HB   ASN  91          2HB       ASN  91   6.524  -9.908  -7.198
  703   2HB   ASN  91          1HB       ASN  91   7.190 -11.542  -7.197
  704   1HD2  ASN  91          1HD2      ASN  91   4.754 -13.027  -7.472
  705   2HD2  ASN  91          2HD2      ASN  91   4.095 -12.695  -9.000
  706    H    TYR  92           H        TYR  92   7.767 -11.731  -4.620
  707    HA   TYR  92           HA       TYR  92   7.821 -14.601  -4.772
  708   1HB   TYR  92          2HB       TYR  92   9.183 -12.575  -2.970
  709   2HB   TYR  92          1HB       TYR  92   9.636 -14.276  -3.048
  710    HD1  TYR  92           1HD      TYR  92  10.926 -11.371  -3.983
  711    HD2  TYR  92           2HD      TYR  92   9.403 -14.897  -5.898
  712    HE1  TYR  92           1HE      TYR  92  12.342 -10.906  -5.962
  713    HE2  TYR  92           2HE      TYR  92  10.815 -14.432  -7.882
  714    HH   TYR  92           HH       TYR  92  12.435 -11.433  -8.319
  715    H    HIS  93           H        HIS  93   6.418 -12.351  -2.462
  716    HA   HIS  93           HA       HIS  93   6.033 -14.311  -0.340
  717   1HB   HIS  93          2HB       HIS  93   5.144 -11.509  -0.982
  718   2HB   HIS  93          1HB       HIS  93   4.417 -12.367   0.377
  719    HD1  HIS  93           1HD      HIS  93   8.019 -12.859  -0.597
  720    HD2  HIS  93           2HD      HIS  93   5.823 -10.899   2.355
  721    HE1  HIS  93           1HE      HIS  93   9.687 -12.101   1.153
  722    H    GLN  94           H        GLN  94   3.873 -12.804  -2.774
  723    HA   GLN  94           HA       GLN  94   1.530 -14.299  -1.977
  724   1HB   GLN  94          2HB       GLN  94   2.371 -12.785  -4.464
  725   2HB   GLN  94          1HB       GLN  94   0.757 -13.470  -4.266
  726   1HG   GLN  94          2HG       GLN  94   0.357 -12.122  -2.295
  727   2HG   GLN  94          1HG       GLN  94   2.024 -11.545  -2.298
  728   1HE2  GLN  94          1HE2      GLN  94   1.432  -9.298  -2.620
  729   2HE2  GLN  94          2HE2      GLN  94   0.772  -8.746  -4.083
  730    H    HIS  95           H        HIS  95   3.063 -14.524  -5.189
  731    HA   HIS  95           HA       HIS  95   3.398 -16.380  -6.602
  732   1HB   HIS  95          2HB       HIS  95   4.232 -17.083  -3.851
  733   2HB   HIS  95          1HB       HIS  95   3.970 -18.465  -4.915
  734    HD1  HIS  95           1HD      HIS  95   5.148 -15.198  -6.323
  735    HD2  HIS  95           2HD      HIS  95   6.777 -18.886  -5.261
  736    HE1  HIS  95           1HE      HIS  95   7.494 -15.246  -7.277
  737    H    ASN  96           H        ASN  96   2.199 -18.424  -3.982
  738    HA   ASN  96           HA       ASN  96   0.239 -19.720  -3.787
  739   1HB   ASN  96          2HB       ASN  96  -0.529 -17.204  -4.468
  740   2HB   ASN  96          1HB       ASN  96  -1.182 -18.106  -5.835
  741   1HD2  ASN  96          1HD2      ASN  96  -3.403 -18.186  -5.276
  742   2HD2  ASN  96          2HD2      ASN  96  -3.986 -18.876  -3.838
  743    H    SER  97           H        SER  97   0.068 -18.657  -7.210
  744    HA   SER  97           HA       SER  97   0.811 -21.362  -8.138
  745   1HB   SER  97          2HB       SER  97  -1.941 -20.142  -8.527
  746   2HB   SER  97          1HB       SER  97  -1.382 -21.627  -9.292
  747    HG   SER  97           HG       SER  97  -2.315 -22.363  -7.496
  748    H    ALA  98           H        ALA  98   0.665 -21.390 -10.635
  749    HA   ALA  98           HA       ALA  98   2.121 -19.188 -11.738
  750   1HB   ALA  98          1HB       ALA  98   1.226 -20.426 -13.913
  751   2HB   ALA  98          2HB       ALA  98   0.673 -21.618 -12.736
  752   3HB   ALA  98          3HB       ALA  98   2.388 -21.218 -12.848
  753    H    GLY  99           H        GLY  99   1.122 -17.171 -11.704
  754   1HA   GLY  99          2HA       GLY  99  -1.636 -16.998 -12.845
  755   2HA   GLY  99          1HA       GLY  99  -0.957 -15.824 -11.715
  756    H    LEU 100           H        LEU 100  -1.919 -15.822 -14.706
  757    HA   LEU 100           HA       LEU 100   0.510 -14.506 -15.865
  758   1HB   LEU 100          2HB       LEU 100  -1.732 -16.170 -16.854
  759   2HB   LEU 100          1HB       LEU 100  -1.272 -14.835 -17.912
  760    HG   LEU 100           HG       LEU 100   1.183 -15.822 -17.211
  761   1HD1  LEU 100          1HD1      LEU 100   0.686 -18.381 -17.782
  762   2HD1  LEU 100          2HD1      LEU 100  -0.850 -18.004 -17.000
  763   3HD1  LEU 100          3HD1      LEU 100   0.664 -17.792 -16.119
  764   1HD2  LEU 100          1HD2      LEU 100  -0.685 -16.263 -19.513
  765   2HD2  LEU 100          2HD2      LEU 100   0.821 -17.178 -19.471
  766   3HD2  LEU 100          3HD2      LEU 100   0.861 -15.415 -19.474
  767    H    ILE 101           H        ILE 101  -3.009 -14.130 -15.420
  768    HA   ILE 101           HA       ILE 101  -3.254 -11.543 -16.625
  769    HB   ILE 101           HB       ILE 101  -5.375 -11.507 -15.306
  770   1HG1  ILE 101          2HG1      ILE 101  -4.552 -14.171 -14.158
  771   2HG1  ILE 101          1HG1      ILE 101  -4.161 -12.676 -13.310
  772   1HG2  ILE 101          1HG2      ILE 101  -4.969 -12.929 -17.423
  773   2HG2  ILE 101          2HG2      ILE 101  -6.367 -13.340 -16.430
  774   3HG2  ILE 101          3HG2      ILE 101  -4.896 -14.307 -16.327
  775   1HD1  ILE 101          1HD1      ILE 101  -6.373 -12.187 -12.858
  776   2HD1  ILE 101          2HD1      ILE 101  -6.460 -13.949 -12.868
  777   3HD1  ILE 101          3HD1      ILE 101  -6.961 -13.034 -14.290
  778    H    SER 102           H        SER 102  -4.319  -9.825 -14.786
  779    HA   SER 102           HA       SER 102  -1.959  -8.833 -13.385
  780   1HB   SER 102          2HB       SER 102  -4.182  -7.750 -14.528
  781   2HB   SER 102          1HB       SER 102  -4.654  -7.720 -12.831
  782    HG   SER 102           HG       SER 102  -2.618  -6.675 -12.426
  783    H    ARG 103           H        ARG 103  -1.386  -9.461 -11.345
  784    HA   ARG 103           HA       ARG 103  -3.241 -11.026  -9.683
  785   1HB   ARG 103          2HB       ARG 103  -0.353 -10.247  -9.724
  786   2HB   ARG 103          1HB       ARG 103  -1.044 -10.753  -8.180
  787   1HG   ARG 103          2HG       ARG 103  -2.013 -12.617 -10.042
  788   2HG   ARG 103          1HG       ARG 103  -0.324 -12.372 -10.486
  789   1HD   ARG 103          2HD       ARG 103  -0.365 -14.143  -8.839
  790   2HD   ARG 103          1HD       ARG 103   0.236 -12.696  -8.005
  791    HE   ARG 103           HE       ARG 103  -2.402 -12.409  -7.565
  792   1HH1  ARG 103          1HH1      ARG 103  -2.301 -15.463  -8.362
  793   2HH1  ARG 103          2HH1      ARG 103  -2.423 -16.166  -6.784
  794   1HH2  ARG 103          1HH2      ARG 103  -1.744 -13.199  -5.121
  795   2HH2  ARG 103          2HH2      ARG 103  -2.108 -14.884  -4.949
  796    H    LEU 104           H        LEU 104  -2.702  -7.721 -10.121
  797    HA   LEU 104           HA       LEU 104  -2.823  -6.803  -7.371
  798   1HB   LEU 104          2HB       LEU 104  -2.054  -5.660  -9.601
  799   2HB   LEU 104          1HB       LEU 104  -3.763  -5.261  -9.783
  800    HG   LEU 104           HG       LEU 104  -2.820  -4.711  -7.080
  801   1HD1  LEU 104          1HD1      LEU 104  -1.623  -2.552  -8.233
  802   2HD1  LEU 104          2HD1      LEU 104  -1.170  -3.820  -9.371
  803   3HD1  LEU 104          3HD1      LEU 104  -0.745  -3.972  -7.666
  804   1HD2  LEU 104          1HD2      LEU 104  -4.363  -3.420  -9.275
  805   2HD2  LEU 104          2HD2      LEU 104  -3.618  -2.337  -8.099
  806   3HD2  LEU 104          3HD2      LEU 104  -4.757  -3.571  -7.563
  807    H    LYS 105           H        LYS 105  -4.778  -5.348  -6.719
  808    HA   LYS 105           HA       LYS 105  -7.261  -6.930  -7.175
  809   1HB   LYS 105          2HB       LYS 105  -6.256  -5.005  -5.080
  810   2HB   LYS 105          1HB       LYS 105  -7.950  -5.493  -5.140
  811   1HG   LYS 105          2HG       LYS 105  -5.893  -7.651  -5.277
  812   2HG   LYS 105          1HG       LYS 105  -6.150  -6.868  -3.717
  813   1HD   LYS 105          2HD       LYS 105  -8.436  -7.493  -3.651
  814   2HD   LYS 105          1HD       LYS 105  -8.461  -7.886  -5.371
  815   1HE   LYS 105          2HE       LYS 105  -6.486  -9.409  -3.762
  816   2HE   LYS 105          1HE       LYS 105  -8.192  -9.777  -3.436
  817   1HZ   LYS 105          1HZ       LYS 105  -6.965  -9.633  -6.140
  818   2HZ   LYS 105          2HZ       LYS 105  -8.578 -10.036  -5.790
  819   3HZ   LYS 105          3HZ       LYS 105  -7.319 -11.072  -5.314
  820    H    TYR 106           H        TYR 106  -6.992  -3.460  -6.310
  821    HA   TYR 106           HA       TYR 106  -8.484  -2.839  -8.843
  822   1HB   TYR 106          2HB       TYR 106  -9.983  -3.021  -6.876
  823   2HB   TYR 106          1HB       TYR 106  -9.025  -1.794  -6.051
  824    HD1  TYR 106           1HD      TYR 106  -8.880   0.522  -6.989
  825    HD2  TYR 106           2HD      TYR 106 -11.590  -2.419  -8.550
  826    HE1  TYR 106           1HE      TYR 106 -10.169   2.314  -8.121
  827    HE2  TYR 106           2HE      TYR 106 -12.882  -0.628  -9.682
  828    HH   TYR 106           HH       TYR 106 -11.720   2.659  -9.842
  829    HA   PRO 107           HA       PRO 107  -4.889  -0.037  -8.772
  830   1HB   PRO 107          2HB       PRO 107  -5.556   0.637 -11.475
  831   2HB   PRO 107          1HB       PRO 107  -4.223  -0.366 -10.899
  832   1HG   PRO 107          2HG       PRO 107  -6.557  -1.226 -12.303
  833   2HG   PRO 107          1HG       PRO 107  -5.259  -2.232 -11.655
  834   1HD   PRO 107          2HD       PRO 107  -7.973  -1.930 -10.656
  835   2HD   PRO 107          1HD       PRO 107  -6.700  -3.035 -10.083
  836    H    VAL 108           H        VAL 108  -5.777   1.608  -7.448
  837    HA   VAL 108           HA       VAL 108  -7.539   3.600  -8.826
  838    HB   VAL 108           HB       VAL 108  -8.530   2.389  -6.906
  839   1HG1  VAL 108          1HG1      VAL 108  -6.955   1.749  -5.387
  840   2HG1  VAL 108          2HG1      VAL 108  -7.360   3.293  -4.639
  841   3HG1  VAL 108          3HG1      VAL 108  -5.950   3.164  -5.686
  842   1HG2  VAL 108          1HG2      VAL 108  -9.386   4.306  -5.792
  843   2HG2  VAL 108          2HG2      VAL 108  -8.937   4.888  -7.395
  844   3HG2  VAL 108          3HG2      VAL 108  -7.883   5.202  -6.016
  845    H    SER 109           H        SER 109  -6.967   5.914  -8.263
  846    HA   SER 109           HA       SER 109  -4.031   6.175  -7.870
  847   1HB   SER 109          2HB       SER 109  -6.206   8.083  -8.787
  848   2HB   SER 109          1HB       SER 109  -4.496   8.501  -8.693
  849    HG   SER 109           HG       SER 109  -4.936   7.819 -10.768
  850    H    GLN 110           H        GLN 110  -6.722   8.312  -6.939
  851    HA   GLN 110           HA       GLN 110  -6.353   8.059  -4.115
  852   1HB   GLN 110          2HB       GLN 110  -5.148  10.320  -3.914
  853   2HB   GLN 110          1HB       GLN 110  -4.182   8.987  -4.540
  854   1HG   GLN 110          2HG       GLN 110  -4.434   9.734  -6.797
  855   2HG   GLN 110          1HG       GLN 110  -5.674  10.904  -6.340
  856   1HE2  GLN 110          1HE2      GLN 110  -2.408  10.176  -4.973
  857   2HE2  GLN 110          2HE2      GLN 110  -1.855  11.779  -5.060
  858    H    GLN 111           H        GLN 111  -6.728  11.055  -3.763
  859    HA   GLN 111           HA       GLN 111  -9.515  11.251  -3.658
  860   1HB   GLN 111          2HB       GLN 111  -7.230  13.181  -3.933
  861   2HB   GLN 111          1HB       GLN 111  -8.888  13.793  -3.913
  862   1HG   GLN 111          2HG       GLN 111  -9.164  12.297  -1.800
  863   2HG   GLN 111          1HG       GLN 111  -7.401  12.306  -1.759
  864   1HE2  GLN 111          1HE2      GLN 111  -7.238  13.670   0.135
  865   2HE2  GLN 111          2HE2      GLN 111  -7.701  15.303   0.113
  866    H    ASN 112           H        ASN 112 -10.401  10.358  -5.588
  867    HA   ASN 112           HA       ASN 112 -11.209  12.124  -7.641
  868   1HB   ASN 112          2HB       ASN 112  -8.534  10.980  -7.903
  869   2HB   ASN 112          1HB       ASN 112  -9.560  10.519  -9.261
  870   1HD2  ASN 112          1HD2      ASN 112  -7.283  12.488  -9.230
  871   2HD2  ASN 112          2HD2      ASN 112  -7.949  13.954  -9.767
  872    H    LYS 113           H        LYS 113 -10.262   8.815  -6.826
  873    HA   LYS 113           HA       LYS 113 -11.391   6.760  -7.066
  874   1HB   LYS 113          2HB       LYS 113 -13.792   8.574  -7.442
  875   2HB   LYS 113          1HB       LYS 113 -13.790   6.925  -6.815
  876   1HG   LYS 113          2HG       LYS 113 -12.436   9.304  -5.501
  877   2HG   LYS 113          1HG       LYS 113 -13.954   8.573  -4.978
  878   1HD   LYS 113          2HD       LYS 113 -12.735   7.186  -3.697
  879   2HD   LYS 113          1HD       LYS 113 -12.171   6.419  -5.175
  880   1HE   LYS 113          2HE       LYS 113 -10.588   8.722  -4.944
  881   2HE   LYS 113          1HE       LYS 113 -10.691   8.085  -3.298
  882   1HZ   LYS 113          1HZ       LYS 113  -8.930   7.074  -4.807
  883   2HZ   LYS 113          2HZ       LYS 113 -10.214   6.318  -5.622
  884   3HZ   LYS 113          3HZ       LYS 113  -9.941   5.996  -3.977
  885    H    ASN 114           H        ASN 114 -10.836   5.746  -8.945
  886    HA   ASN 114           HA       ASN 114 -12.561   5.865 -11.256
  887   1HB   ASN 114          2HB       ASN 114 -10.938   6.959 -12.768
  888   2HB   ASN 114          1HB       ASN 114 -11.380   8.034 -11.444
  889   1HD2  ASN 114          1HD2      ASN 114  -9.794   8.186  -9.601
  890   2HD2  ASN 114          2HD2      ASN 114  -8.149   7.895  -9.902
  891    H    ALA 115           H        ALA 115 -10.914   4.911 -13.217
  892    HA   ALA 115           HA       ALA 115  -8.844   3.115 -12.490
  893   1HB   ALA 115          1HB       ALA 115 -10.756   1.114 -12.812
  894   2HB   ALA 115          2HB       ALA 115 -11.564   2.305 -11.794
  895   3HB   ALA 115          3HB       ALA 115 -10.027   1.609 -11.284
  896    HA   PRO 116           HA       PRO 116 -10.685   1.640 -16.729
  897   1HB   PRO 116          2HB       PRO 116 -12.839   3.420 -17.413
  898   2HB   PRO 116          1HB       PRO 116 -12.910   1.674 -17.159
  899   1HG   PRO 116          2HG       PRO 116 -13.932   3.745 -15.455
  900   2HG   PRO 116          1HG       PRO 116 -14.006   1.997 -15.208
  901   1HD   PRO 116          2HD       PRO 116 -12.396   3.910 -13.784
  902   2HD   PRO 116          1HD       PRO 116 -12.452   2.146 -13.557
  903    H    SER 117           H        SER 117  -9.960   2.575 -18.738
  904    HA   SER 117           HA       SER 117  -9.711   5.477 -19.051
  905   1HB   SER 117          2HB       SER 117  -7.921   5.146 -17.492
  906   2HB   SER 117          1HB       SER 117  -7.379   3.690 -18.320
  907    HG   SER 117           HG       SER 117  -7.070   6.387 -19.007
  908    H    THR 118           H        THR 118  -7.872   2.583 -20.105
  909    HA   THR 118           HA       THR 118  -7.667   3.412 -22.846
  910    HB   THR 118           HB       THR 118  -7.647   0.561 -21.846
  911    HG1  THR 118           1HG      THR 118  -5.941   0.969 -20.688
  912   1HG2  THR 118          1HG2      THR 118  -5.882   2.047 -23.809
  913   2HG2  THR 118          2HG2      THR 118  -7.270   1.059 -24.266
  914   3HG2  THR 118          3HG2      THR 118  -5.873   0.313 -23.490
  Start of MODEL   16
    1    H    THR   1           1H       THR   1  17.049  -8.721 -15.409
    2    HA   THR   1           HA       THR   1  17.016  -6.268 -16.089
    3    HB   THR   1           HB       THR   1  14.405  -7.174 -17.311
    4    HG1  THR   1           1HG      THR   1  15.449  -7.788 -19.005
    5   1HG2  THR   1          1HG2      THR   1  16.012  -4.662 -17.139
    6   2HG2  THR   1          2HG2      THR   1  14.268  -4.889 -17.022
    7   3HG2  THR   1          3HG2      THR   1  15.059  -4.938 -18.598
    8    H    GLU   2           H        GLU   2  16.095  -5.123 -14.393
    9    HA   GLU   2           HA       GLU   2  13.618  -5.976 -13.090
   10   1HB   GLU   2          2HB       GLU   2  14.752  -6.543 -10.943
   11   2HB   GLU   2          1HB       GLU   2  15.229  -7.631 -12.245
   12   1HG   GLU   2          2HG       GLU   2  17.095  -5.651 -12.514
   13   2HG   GLU   2          1HG       GLU   2  16.838  -5.636 -10.770
   14    H    ALA   3           H        ALA   3  12.737  -3.979 -12.720
   15    HA   ALA   3           HA       ALA   3  14.168  -2.015 -11.074
   16   1HB   ALA   3          1HB       ALA   3  14.031  -1.903 -14.020
   17   2HB   ALA   3          2HB       ALA   3  15.144  -1.093 -12.918
   18   3HB   ALA   3          3HB       ALA   3  13.547  -0.409 -13.217
   19    H    GLU   4           H        GLU   4  12.693   0.135 -11.161
   20    HA   GLU   4           HA       GLU   4   9.866  -0.235 -11.712
   21   1HB   GLU   4          2HB       GLU   4   9.232  -0.301  -9.260
   22   2HB   GLU   4          1HB       GLU   4  10.037  -1.760  -9.837
   23   1HG   GLU   4          2HG       GLU   4  11.893  -1.398  -8.563
   24   2HG   GLU   4          1HG       GLU   4  11.855   0.345  -8.827
   25    H    ASP   5           H        ASP   5  11.998   1.792 -12.055
   26    HA   ASP   5           HA       ASP   5  11.613   3.973 -10.201
   27   1HB   ASP   5          2HB       ASP   5  13.231   3.293 -12.400
   28   2HB   ASP   5          1HB       ASP   5  12.381   4.760 -12.874
   29    H    SER   6           H        SER   6  10.398   3.453 -13.534
   30    HA   SER   6           HA       SER   6   7.847   4.753 -12.860
   31   1HB   SER   6          2HB       SER   6   8.234   6.565 -14.546
   32   2HB   SER   6          1HB       SER   6   9.341   6.661 -13.179
   33    HG   SER   6           HG       SER   6  10.884   6.474 -14.578
   34    H    ILE   7           H        ILE   7   7.281   2.512 -13.630
   35    HA   ILE   7           HA       ILE   7   7.218   2.384 -16.629
   36    HB   ILE   7           HB       ILE   7   7.546   0.173 -14.570
   37   1HG1  ILE   7          2HG1      ILE   7   9.501   0.867 -16.746
   38   2HG1  ILE   7          1HG1      ILE   7   9.494   1.809 -15.254
   39   1HG2  ILE   7          1HG2      ILE   7   7.115   0.165 -17.551
   40   2HG2  ILE   7          2HG2      ILE   7   6.362  -0.849 -16.320
   41   3HG2  ILE   7          3HG2      ILE   7   8.040  -1.126 -16.784
   42   1HD1  ILE   7          1HD1      ILE   7   9.414  -0.685 -14.212
   43   2HD1  ILE   7          2HD1      ILE   7  10.923   0.161 -14.555
   44   3HD1  ILE   7          3HD1      ILE   7  10.291  -1.017 -15.706
   45    H    GLU   8           H        GLU   8   5.698   0.501 -13.992
   46    HA   GLU   8           HA       GLU   8   3.180   0.257 -15.331
   47   1HB   GLU   8          2HB       GLU   8   3.993  -0.002 -12.420
   48   2HB   GLU   8          1HB       GLU   8   2.471  -0.589 -13.088
   49   1HG   GLU   8          2HG       GLU   8   3.487  -2.301 -14.272
   50   2HG   GLU   8          1HG       GLU   8   5.016  -1.432 -14.416
   51    H    MET   9           H        MET   9   1.674   1.862 -15.596
   52    HA   MET   9           HA       MET   9   1.514   4.004 -13.532
   53   1HB   MET   9          2HB       MET   9   1.063   4.223 -16.521
   54   2HB   MET   9          1HB       MET   9   1.061   5.555 -15.369
   55   1HG   MET   9          2HG       MET   9   3.332   5.657 -15.291
   56   2HG   MET   9          1HG       MET   9   3.508   3.905 -15.292
   57   1HE   MET   9          1HE       MET   9   1.744   3.329 -18.401
   58   2HE   MET   9          2HE       MET   9   2.638   2.565 -17.089
   59   3HE   MET   9          3HE       MET   9   3.369   2.689 -18.686
   60    H    TYR  10           H        TYR  10  -0.051   1.409 -14.027
   61    HA   TYR  10           HA       TYR  10  -2.606   1.825 -15.101
   62   1HB   TYR  10          2HB       TYR  10  -1.574   0.234 -12.746
   63   2HB   TYR  10          1HB       TYR  10  -3.246   0.105 -13.292
   64    HD1  TYR  10           1HD      TYR  10  -3.794  -0.846 -15.483
   65    HD2  TYR  10           2HD      TYR  10   0.271  -0.578 -14.122
   66    HE1  TYR  10           1HE      TYR  10  -3.090  -2.406 -17.278
   67    HE2  TYR  10           2HE      TYR  10   0.975  -2.137 -15.917
   68    HH   TYR  10           HH       TYR  10  -0.993  -4.102 -17.518
   69    H    GLU  11           H        GLU  11  -2.636   1.562 -11.583
   70    HA   GLU  11           HA       GLU  11  -3.688   4.328 -11.301
   71   1HB   GLU  11          2HB       GLU  11  -5.418   2.344 -11.874
   72   2HB   GLU  11          1HB       GLU  11  -5.308   2.114 -10.132
   73   1HG   GLU  11          2HG       GLU  11  -7.145   3.633 -10.653
   74   2HG   GLU  11          1HG       GLU  11  -5.874   4.496  -9.795
   75    H    TRP  12           H        TRP  12  -3.180   1.209  -9.664
   76    HA   TRP  12           HA       TRP  12  -3.142   2.055  -6.997
   77   1HB   TRP  12          2HB       TRP  12  -1.760   0.006  -6.667
   78   2HB   TRP  12          1HB       TRP  12  -3.128  -0.272  -7.744
   79    HD1  TRP  12           HD       TRP  12  -2.633  -0.976 -10.182
   80    HE1  TRP  12           1HE      TRP  12  -0.476  -1.461 -11.510
   81    HE3  TRP  12           3HE      TRP  12   0.844   0.779  -6.884
   82    HZ2  TRP  12           2HZ      TRP  12   2.351  -1.145 -11.209
   83    HZ3  TRP  12           3HZ      TRP  12   3.260   0.675  -7.427
   84    HH2  TRP  12           HH       TRP  12   4.017  -0.283  -9.584
   85    H    TYR  13           H        TYR  13  -0.746   2.703  -9.450
   86    HA   TYR  13           HA       TYR  13   1.421   3.179  -7.523
   87   1HB   TYR  13          2HB       TYR  13   1.585   2.366  -9.947
   88   2HB   TYR  13          1HB       TYR  13   1.247   4.031 -10.421
   89    HD1  TYR  13           1HD      TYR  13   3.262   4.926 -11.229
   90    HD2  TYR  13           2HD      TYR  13   3.272   2.668  -7.574
   91    HE1  TYR  13           1HE      TYR  13   5.641   5.517 -10.867
   92    HE2  TYR  13           2HE      TYR  13   5.649   3.262  -7.212
   93    HH   TYR  13           HH       TYR  13   7.639   3.941  -8.845
   94    H    SER  14           H        SER  14   2.047   5.166  -6.689
   95    HA   SER  14           HA       SER  14   0.834   7.659  -7.753
   96   1HB   SER  14          2HB       SER  14   0.586   6.865  -4.848
   97   2HB   SER  14          1HB       SER  14  -0.212   8.202  -5.669
   98    HG   SER  14           HG       SER  14  -1.524   6.798  -6.699
   99    H    LYS  15           H        LYS  15   2.323   9.270  -7.649
  100    HA   LYS  15           HA       LYS  15   4.955   8.839  -6.509
  101   1HB   LYS  15          2HB       LYS  15   3.484  10.799  -8.150
  102   2HB   LYS  15          1HB       LYS  15   4.755  11.510  -7.155
  103   1HG   LYS  15          2HG       LYS  15   5.670  10.846  -9.327
  104   2HG   LYS  15          1HG       LYS  15   6.359   9.840  -8.051
  105   1HD   LYS  15          2HD       LYS  15   4.427   8.204  -8.567
  106   2HD   LYS  15          1HD       LYS  15   4.238   9.116 -10.065
  107   1HE   LYS  15          2HE       LYS  15   5.748   7.419 -10.693
  108   2HE   LYS  15          1HE       LYS  15   6.843   8.752 -10.275
  109   1HZ   LYS  15          1HZ       LYS  15   5.884   6.790  -8.274
  110   2HZ   LYS  15          2HZ       LYS  15   7.158   7.902  -8.120
  111   3HZ   LYS  15          3HZ       LYS  15   7.319   6.560  -9.148
  112    H    HIS  16           H        HIS  16   5.164   8.889  -4.318
  113    HA   HIS  16           HA       HIS  16   5.130   9.700  -2.109
  114   1HB   HIS  16          2HB       HIS  16   4.830  12.187  -3.804
  115   2HB   HIS  16          1HB       HIS  16   5.046  12.256  -2.056
  116    HD1  HIS  16           1HD      HIS  16   7.152  10.258  -1.461
  117    HD2  HIS  16           2HD      HIS  16   7.325  12.612  -4.897
  118    HE1  HIS  16           1HE      HIS  16   9.577  10.281  -2.192
  119    H    MET  17           H        MET  17   2.695   8.577  -2.817
  120    HA   MET  17           HA       MET  17   0.494  10.435  -2.261
  121   1HB   MET  17          2HB       MET  17   0.233   8.490  -3.725
  122   2HB   MET  17          1HB       MET  17   0.714   7.408  -2.418
  123   1HG   MET  17          2HG       MET  17  -1.545   9.249  -1.831
  124   2HG   MET  17          1HG       MET  17  -1.873   7.962  -2.990
  125   1HE   MET  17          1HE       MET  17   0.114   5.312  -1.439
  126   2HE   MET  17          2HE       MET  17  -0.870   5.841  -2.801
  127   3HE   MET  17          3HE       MET  17  -1.580   4.816  -1.557
  128    H    THR  18           H        THR  18  -0.142  11.010  -0.227
  129    HA   THR  18           HA       THR  18   1.215  10.154   2.143
  130    HB   THR  18           HB       THR  18  -1.535  11.393   1.987
  131    HG1  THR  18           1HG      THR  18  -0.639  12.884   0.834
  132   1HG2  THR  18          1HG2      THR  18   0.739  12.168   3.792
  133   2HG2  THR  18          2HG2      THR  18  -0.255  10.763   4.177
  134   3HG2  THR  18          3HG2      THR  18  -0.995  12.359   4.048
  135    H    ARG  19           H        ARG  19   0.694   8.632   3.685
  136    HA   ARG  19           HA       ARG  19  -0.788   6.302   3.096
  137   1HB   ARG  19          2HB       ARG  19  -0.513   5.869   5.494
  138   2HB   ARG  19          1HB       ARG  19   0.939   6.663   4.884
  139   1HG   ARG  19          2HG       ARG  19  -0.110   8.877   5.628
  140   2HG   ARG  19          1HG       ARG  19  -1.323   7.915   6.475
  141   1HD   ARG  19          2HD       ARG  19   0.341   6.906   7.897
  142   2HD   ARG  19          1HD       ARG  19   1.665   7.562   6.914
  143    HE   ARG  19           HE       ARG  19   0.768   9.860   7.580
  144   1HH1  ARG  19          1HH2      ARG  19   2.199   8.510   9.858
  145   2HH1  ARG  19          2HH2      ARG  19   1.069   8.705  11.156
  146   1HH2  ARG  19          1HH1      ARG  19  -1.592   9.480   9.071
  147   2HH2  ARG  19          2HH1      ARG  19  -1.079   9.255  10.709
  148    H    SER  20           H        SER  20  -1.748   9.229   4.820
  149    HA   SER  20           HA       SER  20  -4.366   8.351   5.600
  150   1HB   SER  20          2HB       SER  20  -3.868  10.189   6.819
  151   2HB   SER  20          1HB       SER  20  -2.606  10.663   5.691
  152    HG   SER  20           HG       SER  20  -5.403  11.148   5.457
  153    H    GLN  21           H        GLN  21  -3.097  10.084   2.763
  154    HA   GLN  21           HA       GLN  21  -5.610  10.728   1.564
  155   1HB   GLN  21          2HB       GLN  21  -2.793  10.249   0.582
  156   2HB   GLN  21          1HB       GLN  21  -4.089  10.669  -0.540
  157   1HG   GLN  21          2HG       GLN  21  -3.883  12.357   1.894
  158   2HG   GLN  21          1HG       GLN  21  -2.576  12.527   0.723
  159   1HE2  GLN  21          1HE2      GLN  21  -5.973  11.734  -0.058
  160   2HE2  GLN  21          2HE2      GLN  21  -6.268  13.153  -0.941
  161    H    ALA  22           H        ALA  22  -3.531   7.853   1.437
  162    HA   ALA  22           HA       ALA  22  -5.018   6.416  -0.544
  163   1HB   ALA  22          1HB       ALA  22  -3.180   5.136  -0.195
  164   2HB   ALA  22          2HB       ALA  22  -3.889   4.609   1.332
  165   3HB   ALA  22          3HB       ALA  22  -2.821   6.012   1.293
  166    H    GLU  23           H        GLU  23  -5.166   6.407   3.024
  167    HA   GLU  23           HA       GLU  23  -7.244   4.515   3.359
  168   1HB   GLU  23          2HB       GLU  23  -6.478   7.029   4.871
  169   2HB   GLU  23          1HB       GLU  23  -7.639   5.852   5.487
  170   1HG   GLU  23          2HG       GLU  23  -5.801   4.095   5.105
  171   2HG   GLU  23          1HG       GLU  23  -4.698   5.460   4.933
  172    H    GLN  24           H        GLN  24  -7.564   8.089   3.105
  173    HA   GLN  24           HA       GLN  24 -10.429   8.021   3.091
  174   1HB   GLN  24          2HB       GLN  24 -10.188  10.381   2.393
  175   2HB   GLN  24          1HB       GLN  24  -9.078   9.989   3.702
  176   1HG   GLN  24          2HG       GLN  24  -7.278   9.623   2.004
  177   2HG   GLN  24          1HG       GLN  24  -8.401  10.164   0.754
  178   1HE2  GLN  24          1HE2      GLN  24  -7.252  11.322   3.984
  179   2HE2  GLN  24          2HE2      GLN  24  -7.131  12.948   3.514
  180    H    LEU  25           H        LEU  25  -8.068   8.277   0.369
  181    HA   LEU  25           HA       LEU  25 -10.202   8.305  -1.578
  182   1HB   LEU  25          2HB       LEU  25  -8.415   8.161  -3.190
  183   2HB   LEU  25          1HB       LEU  25  -7.851   9.184  -1.875
  184    HG   LEU  25           HG       LEU  25  -6.916   6.914  -0.912
  185   1HD1  LEU  25          1HD1      LEU  25  -8.050   6.035  -3.326
  186   2HD1  LEU  25          2HD1      LEU  25  -6.948   5.129  -2.292
  187   3HD1  LEU  25          3HD1      LEU  25  -6.314   6.083  -3.633
  188   1HD2  LEU  25          1HD2      LEU  25  -4.972   7.951  -1.433
  189   2HD2  LEU  25          2HD2      LEU  25  -5.881   9.039  -2.476
  190   3HD2  LEU  25          3HD2      LEU  25  -5.183   7.561  -3.138
  191    H    LEU  26           H        LEU  26  -8.645   5.799   0.247
  192    HA   LEU  26           HA       LEU  26  -9.374   3.625  -1.583
  193   1HB   LEU  26          2HB       LEU  26  -8.163   3.990   1.119
  194   2HB   LEU  26          1HB       LEU  26  -8.971   2.462   0.828
  195    HG   LEU  26           HG       LEU  26  -6.874   3.619  -1.025
  196   1HD1  LEU  26          1HD1      LEU  26  -6.228   1.196   0.531
  197   2HD1  LEU  26          2HD1      LEU  26  -6.380   2.659   1.503
  198   3HD1  LEU  26          3HD1      LEU  26  -5.227   2.603   0.170
  199   1HD2  LEU  26          1HD2      LEU  26  -8.749   1.794  -1.643
  200   2HD2  LEU  26          2HD2      LEU  26  -7.572   0.719  -0.889
  201   3HD2  LEU  26          3HD2      LEU  26  -7.109   1.697  -2.280
  202    H    LYS  27           H        LYS  27 -10.488   4.622   1.691
  203    HA   LYS  27           HA       LYS  27 -12.840   3.045   1.799
  204   1HB   LYS  27          2HB       LYS  27 -11.526   4.983   3.311
  205   2HB   LYS  27          1HB       LYS  27 -13.090   5.717   2.964
  206   1HG   LYS  27          2HG       LYS  27 -13.721   3.076   3.603
  207   2HG   LYS  27          1HG       LYS  27 -12.447   3.497   4.747
  208   1HD   LYS  27          2HD       LYS  27 -13.691   5.208   5.715
  209   2HD   LYS  27          1HD       LYS  27 -14.673   5.449   4.270
  210   1HE   LYS  27          2HE       LYS  27 -16.204   4.325   5.631
  211   2HE   LYS  27          1HE       LYS  27 -15.442   2.942   4.821
  212   1HZ   LYS  27          1HZ       LYS  27 -13.814   2.849   6.622
  213   2HZ   LYS  27          2HZ       LYS  27 -15.393   2.642   7.216
  214   3HZ   LYS  27          3HZ       LYS  27 -14.596   4.129   7.413
  215    H    GLN  28           H        GLN  28 -12.373   6.339   0.490
  216    HA   GLN  28           HA       GLN  28 -15.133   6.792  -0.193
  217   1HB   GLN  28          2HB       GLN  28 -13.038   8.355   0.040
  218   2HB   GLN  28          1HB       GLN  28 -12.809   7.998  -1.670
  219   1HG   GLN  28          2HG       GLN  28 -14.337   9.580  -2.145
  220   2HG   GLN  28          1HG       GLN  28 -15.557   8.566  -1.374
  221   1HE2  GLN  28          1HE2      GLN  28 -14.607  11.664  -1.313
  222   2HE2  GLN  28          2HE2      GLN  28 -14.808  12.033   0.332
  223    H    GLU  29           H        GLU  29 -12.412   5.420  -2.085
  224    HA   GLU  29           HA       GLU  29 -13.703   5.316  -4.624
  225   1HB   GLU  29          2HB       GLU  29 -11.264   4.854  -3.967
  226   2HB   GLU  29          1HB       GLU  29 -11.797   3.242  -3.498
  227   1HG   GLU  29          2HG       GLU  29 -11.081   2.946  -5.722
  228   2HG   GLU  29          1HG       GLU  29 -12.823   3.148  -5.894
  229    H    GLY  30           H        GLY  30 -13.844   3.181  -1.810
  230   1HA   GLY  30          2HA       GLY  30 -15.517   1.664  -1.186
  231   2HA   GLY  30          1HA       GLY  30 -16.432   2.209  -2.587
  232    H    LYS  31           H        LYS  31 -13.182   0.896  -2.766
  233    HA   LYS  31           HA       LYS  31 -14.255  -1.391  -4.378
  234   1HB   LYS  31          2HB       LYS  31 -11.440  -0.280  -4.244
  235   2HB   LYS  31          1HB       LYS  31 -12.137  -1.289  -5.512
  236   1HG   LYS  31          2HG       LYS  31 -13.068   1.518  -4.828
  237   2HG   LYS  31          1HG       LYS  31 -12.013   1.114  -6.174
  238   1HD   LYS  31          2HD       LYS  31 -14.823   0.053  -5.775
  239   2HD   LYS  31          1HD       LYS  31 -14.363   1.319  -6.913
  240   1HE   LYS  31          2HE       LYS  31 -12.758  -0.355  -7.966
  241   2HE   LYS  31          1HE       LYS  31 -13.539  -1.599  -6.971
  242   1HZ   LYS  31          1HZ       LYS  31 -14.648  -1.396  -9.114
  243   2HZ   LYS  31          2HZ       LYS  31 -14.927   0.257  -8.834
  244   3HZ   LYS  31          3HZ       LYS  31 -15.683  -0.911  -7.860
  245    H    GLU  32           H        GLU  32 -14.472  -3.124  -2.885
  246    HA   GLU  32           HA       GLU  32 -12.891  -3.539  -0.581
  247   1HB   GLU  32          2HB       GLU  32 -13.580  -5.962  -0.904
  248   2HB   GLU  32          1HB       GLU  32 -14.892  -4.786  -0.863
  249   1HG   GLU  32          2HG       GLU  32 -15.454  -5.155  -3.043
  250   2HG   GLU  32          1HG       GLU  32 -13.768  -5.256  -3.553
  251    H    GLY  33           H        GLY  33 -10.676  -3.221  -0.973
  252   1HA   GLY  33          2HA       GLY  33  -8.663  -4.627  -1.169
  253   2HA   GLY  33          1HA       GLY  33  -9.394  -5.325  -2.610
  254    H    GLY  34           H        GLY  34  -9.608  -1.863  -2.083
  255   1HA   GLY  34          2HA       GLY  34  -8.418  -1.261  -4.615
  256   2HA   GLY  34          1HA       GLY  34  -8.692  -0.084  -3.322
  257    H    PHE  35           H        PHE  35  -6.353  -1.877  -4.992
  258    HA   PHE  35           HA       PHE  35  -4.316  -1.734  -2.855
  259   1HB   PHE  35          2HB       PHE  35  -4.664  -3.714  -4.311
  260   2HB   PHE  35          1HB       PHE  35  -4.268  -2.731  -5.720
  261    HD1  PHE  35           1HD      PHE  35  -1.974  -1.785  -5.986
  262    HD2  PHE  35           2HD      PHE  35  -2.950  -4.538  -2.839
  263    HE1  PHE  35           1HE      PHE  35   0.438  -2.224  -5.623
  264    HE2  PHE  35           2HE      PHE  35  -0.538  -4.977  -2.475
  265    HZ   PHE  35           HZ       PHE  35   1.157  -3.820  -3.866
  266    H    ILE  36           H        ILE  36  -2.885  -0.042  -2.703
  267    HA   ILE  36           HA       ILE  36  -2.233   1.512  -5.178
  268    HB   ILE  36           HB       ILE  36  -2.945   2.581  -2.423
  269   1HG1  ILE  36          2HG1      ILE  36  -4.368   2.767  -5.100
  270   2HG1  ILE  36          1HG1      ILE  36  -4.903   1.824  -3.710
  271   1HG2  ILE  36          1HG2      ILE  36  -1.193   3.916  -3.530
  272   2HG2  ILE  36          2HG2      ILE  36  -2.717   4.802  -3.497
  273   3HG2  ILE  36          3HG2      ILE  36  -2.183   4.022  -4.986
  274   1HD1  ILE  36          1HD1      ILE  36  -6.153   3.822  -3.547
  275   2HD1  ILE  36          2HD1      ILE  36  -4.776   4.823  -4.006
  276   3HD1  ILE  36          3HD1      ILE  36  -4.824   4.067  -2.414
  277    H    VAL  37           H        VAL  37  -0.127   2.682  -4.924
  278    HA   VAL  37           HA       VAL  37   1.576   1.783  -2.665
  279    HB   VAL  37           HB       VAL  37   2.230   1.317  -5.592
  280   1HG1  VAL  37          1HG1      VAL  37   4.260   1.688  -4.387
  281   2HG1  VAL  37          2HG1      VAL  37   4.095  -0.064  -4.509
  282   3HG1  VAL  37          3HG1      VAL  37   3.691   0.757  -3.002
  283   1HG2  VAL  37          1HG2      VAL  37   1.336  -0.553  -3.378
  284   2HG2  VAL  37          2HG2      VAL  37   2.085  -1.116  -4.872
  285   3HG2  VAL  37          3HG2      VAL  37   0.540  -0.268  -4.925
  286    H    ARG  38           H        ARG  38   3.599   3.042  -2.546
  287    HA   ARG  38           HA       ARG  38   3.975   5.302  -4.391
  288   1HB   ARG  38          2HB       ARG  38   3.613   6.975  -2.552
  289   2HB   ARG  38          1HB       ARG  38   2.143   6.118  -3.014
  290   1HG   ARG  38          2HG       ARG  38   2.015   5.910  -0.710
  291   2HG   ARG  38          1HG       ARG  38   2.933   4.453  -1.088
  292   1HD   ARG  38          2HD       ARG  38   4.954   5.370  -0.338
  293   2HD   ARG  38          1HD       ARG  38   4.390   7.039  -0.563
  294    HE   ARG  38           HE       ARG  38   2.868   5.450   1.397
  295   1HH1  ARG  38          1HH2      ARG  38   5.989   6.472   1.554
  296   2HH1  ARG  38          2HH2      ARG  38   5.759   7.656   2.797
  297   1HH2  ARG  38          1HH1      ARG  38   2.297   7.512   2.666
  298   2HH2  ARG  38          2HH1      ARG  38   3.671   8.244   3.427
  299    H    ASP  39           H        ASP  39   5.931   6.558  -3.819
  300    HA   ASP  39           HA       ASP  39   8.056   4.871  -2.774
  301   1HB   ASP  39          2HB       ASP  39   7.967   6.809  -4.571
  302   2HB   ASP  39          1HB       ASP  39   8.280   7.840  -3.173
  303    H    SER  40           H        SER  40   9.572   5.779  -1.020
  304    HA   SER  40           HA       SER  40   7.942   6.926   1.225
  305   1HB   SER  40          2HB       SER  40   8.890   4.474   1.158
  306   2HB   SER  40          1HB       SER  40  10.419   5.251   1.558
  307    HG   SER  40           HG       SER  40   7.985   5.242   3.000
  308    H    SER  41           H        SER  41  10.427   7.147   2.853
  309    HA   SER  41           HA       SER  41  12.013   9.191   1.381
  310   1HB   SER  41          2HB       SER  41  11.506  10.872   3.077
  311   2HB   SER  41          1HB       SER  41   9.994  10.257   2.415
  312    HG   SER  41           HG       SER  41  10.865  10.216   4.939
  313    H    LYS  42           H        LYS  42  11.497   7.796   4.657
  314    HA   LYS  42           HA       LYS  42  14.100   8.178   5.682
  315   1HB   LYS  42          2HB       LYS  42  12.055   5.971   6.077
  316   2HB   LYS  42          1HB       LYS  42  13.464   6.192   7.117
  317   1HG   LYS  42          2HG       LYS  42  12.715   8.392   7.781
  318   2HG   LYS  42          1HG       LYS  42  11.404   8.353   6.600
  319   1HD   LYS  42          2HD       LYS  42  10.159   6.811   7.828
  320   2HD   LYS  42          1HD       LYS  42  11.577   6.187   8.671
  321   1HE   LYS  42          2HE       LYS  42  11.761   8.438   9.835
  322   2HE   LYS  42          1HE       LYS  42  10.174   8.834   9.148
  323   1HZ   LYS  42          1HZ       LYS  42  10.813   6.460  10.819
  324   2HZ   LYS  42          2HZ       LYS  42   9.306   6.770  10.098
  325   3HZ   LYS  42          3HZ       LYS  42   9.901   7.803  11.308
  326    H    ALA  43           H        ALA  43  12.901   5.037   4.445
  327    HA   ALA  43           HA       ALA  43  15.680   4.195   3.842
  328   1HB   ALA  43          1HB       ALA  43  13.255   2.994   4.664
  329   2HB   ALA  43          2HB       ALA  43  14.770   2.168   4.299
  330   3HB   ALA  43          3HB       ALA  43  13.558   2.384   3.037
  331    H    GLY  44           H        GLY  44  13.005   5.612   2.237
  332   1HA   GLY  44          2HA       GLY  44  12.767   6.223  -0.033
  333   2HA   GLY  44          1HA       GLY  44  14.352   5.493  -0.348
  334    H    LYS  45           H        LYS  45  11.887   3.742   1.373
  335    HA   LYS  45           HA       LYS  45  11.891   1.659  -0.704
  336   1HB   LYS  45          2HB       LYS  45  10.755   0.373   1.052
  337   2HB   LYS  45          1HB       LYS  45  12.163   1.193   1.724
  338   1HG   LYS  45          2HG       LYS  45   9.873   2.939   1.884
  339   2HG   LYS  45          1HG       LYS  45   9.474   1.383   2.604
  340   1HD   LYS  45          2HD       LYS  45  11.797   1.612   3.778
  341   2HD   LYS  45          1HD       LYS  45  11.634   3.324   3.383
  342   1HE   LYS  45          2HE       LYS  45  10.512   3.394   5.390
  343   2HE   LYS  45          1HE       LYS  45   9.153   2.800   4.416
  344   1HZ   LYS  45          1HZ       LYS  45  11.171   1.081   5.760
  345   2HZ   LYS  45          2HZ       LYS  45   9.836   0.541   4.860
  346   3HZ   LYS  45          3HZ       LYS  45   9.598   1.356   6.332
  347    H    TYR  46           H        TYR  46   9.316   0.617  -0.405
  348    HA   TYR  46           HA       TYR  46   7.579   2.844  -1.440
  349   1HB   TYR  46          2HB       TYR  46   7.726  -0.090  -2.201
  350   2HB   TYR  46          1HB       TYR  46   6.563   1.052  -2.857
  351    HD1  TYR  46           1HD      TYR  46  10.291   0.836  -2.324
  352    HD2  TYR  46           2HD      TYR  46   7.066   1.990  -4.913
  353    HE1  TYR  46           1HE      TYR  46  11.927   1.503  -4.054
  354    HE2  TYR  46           2HE      TYR  46   8.706   2.663  -6.646
  355    HH   TYR  46           HH       TYR  46  11.486   3.449  -6.341
  356    H    THR  47           H        THR  47   5.240   2.507  -1.008
  357    HA   THR  47           HA       THR  47   4.712   0.720   1.346
  358    HB   THR  47           HB       THR  47   3.737   3.549   0.803
  359    HG1  THR  47           1HG      THR  47   5.863   3.456   1.541
  360   1HG2  THR  47          1HG2      THR  47   2.915   1.435   2.737
  361   2HG2  THR  47          2HG2      THR  47   1.964   2.741   2.027
  362   3HG2  THR  47          3HG2      THR  47   3.059   3.076   3.367
  363    H    VAL  48           H        VAL  48   2.968  -0.620   1.014
  364    HA   VAL  48           HA       VAL  48   1.334  -0.171  -1.446
  365    HB   VAL  48           HB       VAL  48   2.028  -2.501   0.338
  366   1HG1  VAL  48          1HG1      VAL  48   0.570  -3.857  -1.259
  367   2HG1  VAL  48          2HG1      VAL  48  -0.159  -2.326  -1.744
  368   3HG1  VAL  48          3HG1      VAL  48  -0.295  -2.879  -0.074
  369   1HG2  VAL  48          1HG2      VAL  48   3.281  -3.224  -1.445
  370   2HG2  VAL  48          2HG2      VAL  48   3.303  -1.498  -1.808
  371   3HG2  VAL  48          3HG2      VAL  48   2.161  -2.558  -2.634
  372    H    SER  49           H        SER  49  -0.446   1.078  -0.956
  373    HA   SER  49           HA       SER  49  -1.858   0.758   1.634
  374   1HB   SER  49          2HB       SER  49  -1.797   2.668  -0.673
  375   2HB   SER  49          1HB       SER  49  -3.230   2.641   0.352
  376    HG   SER  49           HG       SER  49  -0.547   3.215   1.027
  377    H    VAL  50           H        VAL  50  -3.341  -0.942   1.670
  378    HA   VAL  50           HA       VAL  50  -5.094  -1.219  -0.751
  379    HB   VAL  50           HB       VAL  50  -5.022  -3.626  -0.426
  380   1HG1  VAL  50          1HG1      VAL  50  -3.118  -2.569  -1.637
  381   2HG1  VAL  50          2HG1      VAL  50  -2.649  -4.059  -0.819
  382   3HG1  VAL  50          3HG1      VAL  50  -2.225  -2.497  -0.119
  383   1HG2  VAL  50          1HG2      VAL  50  -4.976  -3.584   2.062
  384   2HG2  VAL  50          2HG2      VAL  50  -3.296  -3.051   2.005
  385   3HG2  VAL  50          3HG2      VAL  50  -3.740  -4.646   1.397
  386    H    PHE  51           H        PHE  51  -7.312  -1.169  -0.301
  387    HA   PHE  51           HA       PHE  51  -8.099  -1.516   2.577
  388   1HB   PHE  51          2HB       PHE  51  -8.769   0.649   2.581
  389   2HB   PHE  51          1HB       PHE  51  -8.066   0.820   0.980
  390    HD1  PHE  51           1HD      PHE  51 -11.122   0.770   2.872
  391    HD2  PHE  51           2HD      PHE  51  -9.487   0.113  -1.042
  392    HE1  PHE  51           1HE      PHE  51 -13.382   1.009   1.885
  393    HE2  PHE  51           2HE      PHE  51 -11.735   0.364  -2.026
  394    HZ   PHE  51           HZ       PHE  51 -13.692   0.808  -0.567
  395    H    ALA  52           H        ALA  52 -10.607  -1.762   2.689
  396    HA   ALA  52           HA       ALA  52 -12.018  -2.712   0.360
  397   1HB   ALA  52          1HB       ALA  52 -11.461  -4.915   2.308
  398   2HB   ALA  52          2HB       ALA  52 -10.240  -4.523   1.097
  399   3HB   ALA  52          3HB       ALA  52 -11.857  -5.017   0.593
  400    H    LYS  53           H        LYS  53 -14.202  -3.494   0.917
  401    HA   LYS  53           HA       LYS  53 -15.078  -2.514   3.623
  402   1HB   LYS  53          2HB       LYS  53 -16.219  -2.455   0.833
  403   2HB   LYS  53          1HB       LYS  53 -17.276  -2.266   2.232
  404   1HG   LYS  53          2HG       LYS  53 -15.520  -0.482   2.993
  405   2HG   LYS  53          1HG       LYS  53 -15.047  -0.479   1.294
  406   1HD   LYS  53          2HD       LYS  53 -17.421  -0.035   0.671
  407   2HD   LYS  53          1HD       LYS  53 -17.822   0.070   2.386
  408   1HE   LYS  53          2HE       LYS  53 -16.691   2.090   2.665
  409   2HE   LYS  53          1HE       LYS  53 -15.584   1.772   1.314
  410   1HZ   LYS  53          1HZ       LYS  53 -17.245   3.371   0.637
  411   2HZ   LYS  53          2HZ       LYS  53 -18.498   2.325   1.107
  412   3HZ   LYS  53          3HZ       LYS  53 -17.492   1.916  -0.199
  413    H    SER  54           H        SER  54 -14.293  -5.130   3.769
  414    HA   SER  54           HA       SER  54 -16.804  -6.558   4.220
  415   1HB   SER  54          2HB       SER  54 -16.499  -6.709   1.763
  416   2HB   SER  54          1HB       SER  54 -14.921  -7.452   2.015
  417    HG   SER  54           HG       SER  54 -17.476  -8.487   2.337
  418    H    THR  55           H        THR  55 -15.301  -6.302   6.279
  419    HA   THR  55           HA       THR  55 -14.316  -8.906   6.991
  420    HB   THR  55           HB       THR  55 -12.504  -8.240   5.437
  421    HG1  THR  55           1HG      THR  55 -10.885  -8.737   6.814
  422   1HG2  THR  55          1HG2      THR  55 -12.858  -5.711   6.764
  423   2HG2  THR  55          2HG2      THR  55 -11.910  -6.078   5.323
  424   3HG2  THR  55          3HG2      THR  55 -11.180  -6.231   6.921
  425    H    GLY  56           H        GLY  56 -12.144  -7.212   8.664
  426   1HA   GLY  56          2HA       GLY  56 -13.558  -7.016  11.079
  427   2HA   GLY  56          1HA       GLY  56 -12.145  -6.023  10.704
  428    H    ASP  57           H        ASP  57 -13.313  -4.750   8.410
  429    HA   ASP  57           HA       ASP  57 -15.415  -3.034   9.679
  430   1HB   ASP  57          2HB       ASP  57 -12.837  -2.373   9.088
  431   2HB   ASP  57          1HB       ASP  57 -13.634  -1.978   7.567
  432    HA   PRO  58           HA       PRO  58 -17.206  -5.211   6.003
  433   1HB   PRO  58          2HB       PRO  58 -19.726  -4.186   6.940
  434   2HB   PRO  58          1HB       PRO  58 -19.150  -5.854   6.940
  435   1HG   PRO  58          2HG       PRO  58 -19.426  -4.058   9.180
  436   2HG   PRO  58          1HG       PRO  58 -18.941  -5.756   9.191
  437   1HD   PRO  58          2HD       PRO  58 -17.282  -3.504   9.713
  438   2HD   PRO  58          1HD       PRO  58 -16.755  -5.194   9.515
  439    H    GLN  59           H        GLN  59 -17.419  -1.900   7.088
  440    HA   GLN  59           HA       GLN  59 -18.366  -1.114   4.354
  441   1HB   GLN  59          2HB       GLN  59 -19.194   0.941   5.592
  442   2HB   GLN  59          1HB       GLN  59 -19.976  -0.572   6.052
  443   1HG   GLN  59          2HG       GLN  59 -18.875  -0.681   8.100
  444   2HG   GLN  59          1HG       GLN  59 -17.533   0.321   7.546
  445   1HE2  GLN  59          1HE2      GLN  59 -20.266   0.416   9.491
  446   2HE2  GLN  59          2HE2      GLN  59 -20.544   2.090   9.479
  447    H    GLY  60           H        GLY  60 -15.456  -1.371   5.624
  448   1HA   GLY  60          2HA       GLY  60 -14.148   0.460   4.042
  449   2HA   GLY  60          1HA       GLY  60 -14.535   1.378   5.489
  450    H    VAL  61           H        VAL  61 -12.367  -0.861   4.092
  451    HA   VAL  61           HA       VAL  61 -10.926  -1.098   6.715
  452    HB   VAL  61           HB       VAL  61 -10.985  -3.137   4.468
  453   1HG1  VAL  61          1HG1      VAL  61  -9.665  -2.904   7.116
  454   2HG1  VAL  61          2HG1      VAL  61  -9.114  -3.708   5.646
  455   3HG1  VAL  61          3HG1      VAL  61 -10.297  -4.494   6.691
  456   1HG2  VAL  61          1HG2      VAL  61 -13.172  -2.605   5.918
  457   2HG2  VAL  61          2HG2      VAL  61 -12.351  -3.668   7.058
  458   3HG2  VAL  61          3HG2      VAL  61 -12.744  -4.241   5.438
  459    H    ILE  62           H        ILE  62  -8.725  -0.793   6.597
  460    HA   ILE  62           HA       ILE  62  -7.453  -0.435   3.934
  461    HB   ILE  62           HB       ILE  62  -6.861   1.702   5.878
  462   1HG1  ILE  62          2HG1      ILE  62  -9.640   1.384   4.702
  463   2HG1  ILE  62          1HG1      ILE  62  -9.230   1.413   6.407
  464   1HG2  ILE  62          1HG2      ILE  62  -6.195   2.588   3.920
  465   2HG2  ILE  62          2HG2      ILE  62  -7.875   2.640   3.388
  466   3HG2  ILE  62          3HG2      ILE  62  -6.885   1.222   3.045
  467   1HD1  ILE  62          1HD1      ILE  62  -8.130   3.751   5.624
  468   2HD1  ILE  62          2HD1      ILE  62  -9.778   3.600   6.236
  469   3HD1  ILE  62          3HD1      ILE  62  -9.483   3.643   4.497
  470    H    ARG  63           H        ARG  63  -5.110  -0.374   4.053
  471    HA   ARG  63           HA       ARG  63  -3.657  -0.710   6.543
  472   1HB   ARG  63          2HB       ARG  63  -5.050  -2.939   5.608
  473   2HB   ARG  63          1HB       ARG  63  -3.406  -3.208   5.028
  474   1HG   ARG  63          2HG       ARG  63  -4.122  -2.516   7.892
  475   2HG   ARG  63          1HG       ARG  63  -3.790  -4.148   7.312
  476   1HD   ARG  63          2HD       ARG  63  -1.597  -2.780   6.368
  477   2HD   ARG  63          1HD       ARG  63  -1.902  -1.966   7.916
  478    HE   ARG  63           HE       ARG  63  -1.148  -4.785   7.581
  479   1HH1  ARG  63          1HH2      ARG  63  -3.692  -4.384   9.304
  480   2HH1  ARG  63          2HH2      ARG  63  -2.990  -4.356  10.887
  481   1HH2  ARG  63          1HH1      ARG  63   0.245  -3.880   9.733
  482   2HH2  ARG  63          2HH1      ARG  63  -0.762  -4.071  11.129
  483    H    HIS  64           H        HIS  64  -1.775   0.336   5.935
  484    HA   HIS  64           HA       HIS  64  -0.883   0.154   3.106
  485   1HB   HIS  64          2HB       HIS  64   0.415   1.804   5.263
  486   2HB   HIS  64          1HB       HIS  64   0.286   2.146   3.540
  487    HD1  HIS  64           1HD      HIS  64  -2.489   2.255   2.810
  488    HD2  HIS  64           2HD      HIS  64  -1.350   3.380   6.658
  489    HE1  HIS  64           1HE      HIS  64  -4.367   3.688   3.723
  490    H    TYR  65           H        TYR  65   0.311  -1.695   2.801
  491    HA   TYR  65           HA       TYR  65   2.175  -2.718   4.832
  492   1HB   TYR  65          2HB       TYR  65   1.953  -3.412   1.901
  493   2HB   TYR  65          1HB       TYR  65   2.547  -4.433   3.204
  494    HD1  TYR  65           1HD      TYR  65   0.169  -4.814   1.102
  495    HD2  TYR  65           2HD      TYR  65   0.371  -3.718   5.252
  496    HE1  TYR  65           1HE      TYR  65  -2.107  -5.720   1.455
  497    HE2  TYR  65           2HE      TYR  65  -1.908  -4.622   5.601
  498    HH   TYR  65           HH       TYR  65  -3.419  -6.249   4.554
  499    H    VAL  66           H        VAL  66   4.221  -1.880   5.028
  500    HA   VAL  66           HA       VAL  66   5.321  -0.359   2.698
  501    HB   VAL  66           HB       VAL  66   5.999  -0.256   5.657
  502   1HG1  VAL  66          1HG1      VAL  66   6.877   1.424   3.286
  503   2HG1  VAL  66          2HG1      VAL  66   7.902   0.409   4.301
  504   3HG1  VAL  66          3HG1      VAL  66   7.168   1.867   4.969
  505   1HG2  VAL  66          1HG2      VAL  66   4.726   2.016   4.197
  506   2HG2  VAL  66          2HG2      VAL  66   4.520   1.504   5.871
  507   3HG2  VAL  66          3HG2      VAL  66   3.695   0.637   4.576
  508    H    VAL  67           H        VAL  67   7.672  -0.584   2.340
  509    HA   VAL  67           HA       VAL  67   8.620  -3.319   3.096
  510    HB   VAL  67           HB       VAL  67   9.182  -1.535   0.713
  511   1HG1  VAL  67          1HG1      VAL  67  10.081  -4.110   0.157
  512   2HG1  VAL  67          2HG1      VAL  67  10.598  -3.845   1.822
  513   3HG1  VAL  67          3HG1      VAL  67  11.098  -2.725   0.555
  514   1HG2  VAL  67          1HG2      VAL  67   8.134  -3.960  -0.143
  515   2HG2  VAL  67          2HG2      VAL  67   7.229  -2.455   0.015
  516   3HG2  VAL  67          3HG2      VAL  67   7.220  -3.631   1.329
  517    H    CYS  68           H        CYS  68  10.380  -3.397   4.372
  518    HA   CYS  68           HA       CYS  68  11.874  -0.932   4.995
  519   1HB   CYS  68          2HB       CYS  68  11.058  -2.524   6.730
  520   2HB   CYS  68          1HB       CYS  68  12.058  -3.789   6.015
  521    HG   CYS  68           HG       CYS  68  13.458  -1.199   7.038
  522    H    SER  69           H        SER  69  14.287  -0.979   4.856
  523    HA   SER  69           HA       SER  69  15.303  -2.912   2.808
  524   1HB   SER  69          2HB       SER  69  16.605  -0.732   2.069
  525   2HB   SER  69          1HB       SER  69  14.951  -1.007   1.522
  526    HG   SER  69           HG       SER  69  15.120   1.064   2.371
  527    H    THR  70           H        THR  70  17.239  -3.793   3.343
  528    HA   THR  70           HA       THR  70  18.667  -2.753   5.744
  529    HB   THR  70           HB       THR  70  17.896  -5.138   5.559
  530    HG1  THR  70           1HG      THR  70  19.778  -5.952   6.346
  531   1HG2  THR  70          1HG2      THR  70  20.082  -5.746   3.651
  532   2HG2  THR  70          2HG2      THR  70  18.636  -5.004   2.973
  533   3HG2  THR  70          3HG2      THR  70  18.516  -6.526   3.857
  534    HA   PRO  71           HA       PRO  71  21.914  -1.035   3.353
  535   1HB   PRO  71          2HB       PRO  71  24.052  -2.096   4.959
  536   2HB   PRO  71          1HB       PRO  71  23.353  -0.476   5.002
  537   1HG   PRO  71          2HG       PRO  71  23.074  -2.534   6.958
  538   2HG   PRO  71          1HG       PRO  71  22.306  -0.944   6.952
  539   1HD   PRO  71          2HD       PRO  71  21.091  -3.531   6.454
  540   2HD   PRO  71          1HD       PRO  71  20.295  -1.946   6.568
  541    H    GLN  72           H        GLN  72  21.492  -4.356   3.394
  542    HA   GLN  72           HA       GLN  72  23.940  -4.935   1.815
  543   1HB   GLN  72          2HB       GLN  72  23.206  -6.490   3.565
  544   2HB   GLN  72          1HB       GLN  72  21.616  -6.609   2.825
  545   1HG   GLN  72          2HG       GLN  72  23.116  -8.548   2.293
  546   2HG   GLN  72          1HG       GLN  72  22.548  -7.696   0.862
  547   1HE2  GLN  72          1HE2      GLN  72  25.365  -8.755   2.521
  548   2HE2  GLN  72          2HE2      GLN  72  26.507  -7.906   1.596
  549    H    SER  73           H        SER  73  21.609  -3.156   0.919
  550    HA   SER  73           HA       SER  73  20.464  -2.744  -1.104
  551   1HB   SER  73          2HB       SER  73  22.833  -4.076  -1.685
  552   2HB   SER  73          1HB       SER  73  21.622  -5.049  -2.514
  553    HG   SER  73           HG       SER  73  20.841  -3.023  -3.396
  554    H    GLN  74           H        GLN  74  19.118  -4.237   0.821
  555    HA   GLN  74           HA       GLN  74  17.584  -6.180  -0.860
  556   1HB   GLN  74          2HB       GLN  74  17.883  -6.688   2.051
  557   2HB   GLN  74          1HB       GLN  74  17.876  -7.833   0.715
  558   1HG   GLN  74          2HG       GLN  74  20.164  -6.777   0.088
  559   2HG   GLN  74          1HG       GLN  74  20.159  -6.150   1.734
  560   1HE2  GLN  74          1HE2      GLN  74  20.160  -7.770   3.516
  561   2HE2  GLN  74          2HE2      GLN  74  20.665  -9.364   3.225
  562    H    TYR  75           H        TYR  75  15.371  -6.626   0.177
  563    HA   TYR  75           HA       TYR  75  14.350  -4.347   1.825
  564   1HB   TYR  75          2HB       TYR  75  13.138  -5.217  -0.810
  565   2HB   TYR  75          1HB       TYR  75  12.639  -3.847   0.177
  566    HD1  TYR  75           1HD      TYR  75  15.400  -5.210  -1.889
  567    HD2  TYR  75           2HD      TYR  75  13.781  -1.755   0.071
  568    HE1  TYR  75           1HE      TYR  75  17.069  -3.790  -3.030
  569    HE2  TYR  75           2HE      TYR  75  15.445  -0.328  -1.074
  570    HH   TYR  75           HH       TYR  75  17.756  -0.651  -2.096
  571    H    TYR  76           H        TYR  76  12.160  -4.749   2.664
  572    HA   TYR  76           HA       TYR  76  10.655  -7.150   2.319
  573   1HB   TYR  76          2HB       TYR  76  11.347  -8.367   4.374
  574   2HB   TYR  76          1HB       TYR  76  12.711  -8.182   3.283
  575    HD1  TYR  76           1HD      TYR  76  11.103  -6.833   6.335
  576    HD2  TYR  76           2HD      TYR  76  14.647  -6.888   3.921
  577    HE1  TYR  76           1HE      TYR  76  12.345  -5.706   8.149
  578    HE2  TYR  76           2HE      TYR  76  15.895  -5.757   5.734
  579    HH   TYR  76           HH       TYR  76  15.779  -5.402   8.105
  580    H    LEU  77           H        LEU  77   8.900  -7.300   3.936
  581    HA   LEU  77           HA       LEU  77   8.393  -4.697   5.340
  582   1HB   LEU  77          2HB       LEU  77   6.767  -5.847   3.672
  583   2HB   LEU  77          1HB       LEU  77   6.517  -7.057   4.930
  584    HG   LEU  77           HG       LEU  77   6.293  -4.226   5.797
  585   1HD1  LEU  77          1HD1      LEU  77   5.155  -4.386   3.502
  586   2HD1  LEU  77          2HD1      LEU  77   4.138  -3.848   4.840
  587   3HD1  LEU  77          3HD1      LEU  77   4.025  -5.509   4.258
  588   1HD2  LEU  77          1HD2      LEU  77   4.909  -6.856   6.311
  589   2HD2  LEU  77          2HD2      LEU  77   4.208  -5.338   6.873
  590   3HD2  LEU  77          3HD2      LEU  77   5.799  -5.842   7.445
  591    H    ALA  78           H        ALA  78   9.404  -7.886   5.706
  592    HA   ALA  78           HA       ALA  78   9.508  -7.699   8.651
  593   1HB   ALA  78          1HB       ALA  78   7.988  -9.379   8.960
  594   2HB   ALA  78          2HB       ALA  78   8.757 -10.369   7.721
  595   3HB   ALA  78          3HB       ALA  78   7.541  -9.176   7.266
  596    H    GLU  79           H        GLU  79  11.668  -8.135   9.056
  597    HA   GLU  79           HA       GLU  79  13.613  -8.780   7.179
  598   1HB   GLU  79          2HB       GLU  79  13.302  -9.048  10.138
  599   2HB   GLU  79          1HB       GLU  79  14.707  -9.822   9.402
  600   1HG   GLU  79          2HG       GLU  79  15.162  -7.620   8.226
  601   2HG   GLU  79          1HG       GLU  79  13.927  -6.903   9.260
  602    H    LYS  80           H        LYS  80  11.274 -10.925   8.517
  603    HA   LYS  80           HA       LYS  80  12.338 -13.471   8.549
  604   1HB   LYS  80          2HB       LYS  80   9.801 -12.186   7.782
  605   2HB   LYS  80          1HB       LYS  80  10.021 -13.791   7.087
  606   1HG   LYS  80          2HG       LYS  80  10.804 -13.654   9.912
  607   2HG   LYS  80          1HG       LYS  80   9.102 -13.269   9.648
  608   1HD   LYS  80          2HD       LYS  80   8.596 -15.381   8.914
  609   2HD   LYS  80          1HD       LYS  80  10.172 -15.608   8.156
  610   1HE   LYS  80          2HE       LYS  80  10.574 -16.978   9.948
  611   2HE   LYS  80          1HE       LYS  80  10.850 -15.460  10.827
  612   1HZ   LYS  80          1HZ       LYS  80   8.148 -16.618  10.449
  613   2HZ   LYS  80          2HZ       LYS  80   8.616 -15.383  11.518
  614   3HZ   LYS  80          3HZ       LYS  80   9.108 -16.985  11.799
  615    H    HIS  81           H        HIS  81  11.628 -11.527   5.652
  616    HA   HIS  81           HA       HIS  81  13.537 -13.136   4.080
  617   1HB   HIS  81          2HB       HIS  81  11.816 -13.720   2.395
  618   2HB   HIS  81          1HB       HIS  81  11.416 -14.408   3.968
  619    HD1  HIS  81           1HD      HIS  81   9.408 -13.361   5.261
  620    HD2  HIS  81           2HD      HIS  81  10.074 -11.650   1.519
  621    HE1  HIS  81           1HE      HIS  81   7.366 -11.955   4.743
  622    H    LEU  82           H        LEU  82  14.408 -11.842   2.416
  623    HA   LEU  82           HA       LEU  82  12.968  -9.351   1.709
  624   1HB   LEU  82          2HB       LEU  82  14.893  -7.998   2.364
  625   2HB   LEU  82          1HB       LEU  82  14.400  -8.985   3.736
  626    HG   LEU  82           HG       LEU  82  16.539  -9.865   1.811
  627   1HD1  LEU  82          1HD1      LEU  82  18.105  -8.580   2.837
  628   2HD1  LEU  82          2HD1      LEU  82  17.402  -8.841   4.432
  629   3HD1  LEU  82          3HD1      LEU  82  16.740  -7.600   3.368
  630   1HD2  LEU  82          1HD2      LEU  82  16.268 -11.742   3.069
  631   2HD2  LEU  82          2HD2      LEU  82  15.304 -10.887   4.273
  632   3HD2  LEU  82          3HD2      LEU  82  17.065 -10.840   4.358
  633    H    PHE  83           H        PHE  83  13.447  -8.636  -0.382
  634    HA   PHE  83           HA       PHE  83  15.394 -10.326  -1.909
  635   1HB   PHE  83          2HB       PHE  83  12.689  -9.156  -2.458
  636   2HB   PHE  83          1HB       PHE  83  13.780  -9.433  -3.821
  637    HD1  PHE  83           1HD      PHE  83  15.165 -11.784  -3.498
  638    HD2  PHE  83           2HD      PHE  83  11.221 -10.932  -2.029
  639    HE1  PHE  83           1HE      PHE  83  14.666 -14.212  -3.425
  640    HE2  PHE  83           2HE      PHE  83  10.722 -13.357  -1.956
  641    HZ   PHE  83           HZ       PHE  83  12.445 -14.999  -2.653
  642    H    SER  84           H        SER  84  15.145  -8.375  -4.232
  643    HA   SER  84           HA       SER  84  17.023  -6.346  -3.078
  644   1HB   SER  84          2HB       SER  84  18.009  -7.807  -4.710
  645   2HB   SER  84          1HB       SER  84  16.661  -7.581  -5.821
  646    HG   SER  84           HG       SER  84  18.797  -5.895  -5.198
  647    H    THR  85           H        THR  85  13.821  -6.405  -3.930
  648    HA   THR  85           HA       THR  85  13.707  -3.505  -4.258
  649    HB   THR  85           HB       THR  85  12.720  -5.137  -6.606
  650    HG1  THR  85           1HG      THR  85  14.664  -4.596  -7.636
  651   1HG2  THR  85          1HG2      THR  85  13.648  -2.499  -7.208
  652   2HG2  THR  85          2HG2      THR  85  12.586  -2.414  -5.804
  653   3HG2  THR  85          3HG2      THR  85  12.006  -3.133  -7.305
  654    H    ILE  86           H        ILE  86  11.427  -2.745  -4.227
  655    HA   ILE  86           HA       ILE  86   9.711  -4.420  -2.648
  656    HB   ILE  86           HB       ILE  86   9.606  -1.779  -4.022
  657   1HG1  ILE  86          2HG1      ILE  86   8.620  -1.404  -1.572
  658   2HG1  ILE  86          1HG1      ILE  86   9.386  -2.963  -1.295
  659   1HG2  ILE  86          1HG2      ILE  86   7.418  -2.734  -4.650
  660   2HG2  ILE  86          2HG2      ILE  86   7.214  -1.489  -3.419
  661   3HG2  ILE  86          3HG2      ILE  86   7.130  -3.192  -2.971
  662   1HD1  ILE  86          1HD1      ILE  86  10.714  -0.628  -1.059
  663   2HD1  ILE  86          2HD1      ILE  86  11.005  -0.963  -2.766
  664   3HD1  ILE  86          3HD1      ILE  86  11.499  -2.132  -1.542
  665    HA   PRO  87           HA       PRO  87   7.033  -4.964  -6.686
  666   1HB   PRO  87          2HB       PRO  87   8.852  -4.677  -8.898
  667   2HB   PRO  87          1HB       PRO  87   7.407  -3.725  -8.549
  668   1HG   PRO  87          2HG       PRO  87  10.177  -2.949  -8.267
  669   2HG   PRO  87          1HG       PRO  87   8.730  -1.963  -8.034
  670   1HD   PRO  87          2HD       PRO  87  10.503  -2.896  -6.013
  671   2HD   PRO  87          1HD       PRO  87   8.939  -2.085  -5.768
  672    H    GLU  88           H        GLU  88  10.522  -5.651  -7.075
  673    HA   GLU  88           HA       GLU  88  10.244  -8.292  -8.157
  674   1HB   GLU  88          2HB       GLU  88  12.277  -6.862  -8.213
  675   2HB   GLU  88          1HB       GLU  88  12.434  -7.037  -6.466
  676   1HG   GLU  88          2HG       GLU  88  13.817  -8.758  -7.080
  677   2HG   GLU  88          1HG       GLU  88  12.289  -9.635  -7.134
  678    H    LEU  89           H        LEU  89  10.925  -7.199  -4.818
  679    HA   LEU  89           HA       LEU  89  10.995  -9.663  -3.481
  680   1HB   LEU  89          2HB       LEU  89  11.465  -7.379  -2.574
  681   2HB   LEU  89          1HB       LEU  89   9.737  -7.039  -2.580
  682    HG   LEU  89           HG       LEU  89  10.838  -9.428  -1.109
  683   1HD1  LEU  89          1HD1      LEU  89  10.330  -6.806   0.269
  684   2HD1  LEU  89          2HD1      LEU  89  11.897  -7.097  -0.486
  685   3HD1  LEU  89          3HD1      LEU  89  11.323  -8.166   0.794
  686   1HD2  LEU  89          1HD2      LEU  89   8.757  -8.587   0.328
  687   2HD2  LEU  89          2HD2      LEU  89   8.526  -9.588  -1.107
  688   3HD2  LEU  89          3HD2      LEU  89   8.303  -7.841  -1.204
  689    H    ILE  90           H        ILE  90   8.072  -7.603  -3.937
  690    HA   ILE  90           HA       ILE  90   6.201  -9.459  -2.842
  691    HB   ILE  90           HB       ILE  90   5.911  -7.337  -4.995
  692   1HG1  ILE  90          2HG1      ILE  90   5.135  -6.982  -2.123
  693   2HG1  ILE  90          1HG1      ILE  90   6.842  -6.866  -2.550
  694   1HG2  ILE  90          1HG2      ILE  90   3.983  -8.889  -4.904
  695   2HG2  ILE  90          2HG2      ILE  90   3.544  -7.284  -4.321
  696   3HG2  ILE  90          3HG2      ILE  90   3.833  -8.590  -3.172
  697   1HD1  ILE  90          1HD1      ILE  90   4.575  -5.243  -3.740
  698   2HD1  ILE  90          2HD1      ILE  90   6.246  -5.186  -4.300
  699   3HD1  ILE  90          3HD1      ILE  90   5.844  -4.648  -2.670
  700    H    ASN  91           H        ASN  91   7.166  -8.904  -6.248
  701    HA   ASN  91           HA       ASN  91   5.500 -10.898  -7.426
  702   1HB   ASN  91          2HB       ASN  91   7.152  -8.954  -8.300
  703   2HB   ASN  91          1HB       ASN  91   8.202 -10.348  -8.555
  704   1HD2  ASN  91          1HD2      ASN  91   6.086 -12.264  -9.160
  705   2HD2  ASN  91          2HD2      ASN  91   5.431 -11.832 -10.666
  706    H    TYR  92           H        TYR  92   8.792 -11.083  -6.090
  707    HA   TYR  92           HA       TYR  92   9.787 -13.512  -6.862
  708   1HB   TYR  92          2HB       TYR  92   9.850 -11.816  -4.498
  709   2HB   TYR  92          1HB       TYR  92  10.083 -13.509  -4.073
  710    HD1  TYR  92           1HD      TYR  92  11.670 -10.563  -5.245
  711    HD2  TYR  92           2HD      TYR  92  11.760 -14.840  -5.596
  712    HE1  TYR  92           1HE      TYR  92  14.006 -10.445  -6.064
  713    HE2  TYR  92           2HE      TYR  92  14.098 -14.725  -6.415
  714    HH   TYR  92           HH       TYR  92  16.024 -12.032  -6.100
  715    H    HIS  93           H        HIS  93   8.089 -13.551  -3.730
  716    HA   HIS  93           HA       HIS  93   7.342 -16.338  -4.032
  717   1HB   HIS  93          2HB       HIS  93   7.856 -15.196  -1.888
  718   2HB   HIS  93          1HB       HIS  93   6.427 -14.184  -2.096
  719    HD1  HIS  93           1HD      HIS  93   5.392 -15.237   0.092
  720    HD2  HIS  93           2HD      HIS  93   6.026 -17.957  -3.004
  721    HE1  HIS  93           1HE      HIS  93   4.097 -17.328   0.698
  722    H    GLN  94           H        GLN  94   5.216 -13.501  -3.508
  723    HA   GLN  94           HA       GLN  94   3.507 -14.077  -5.777
  724   1HB   GLN  94          2HB       GLN  94   3.122 -15.469  -3.225
  725   2HB   GLN  94          1HB       GLN  94   1.676 -14.603  -3.743
  726   1HG   GLN  94          2HG       GLN  94   2.486 -15.749  -6.097
  727   2HG   GLN  94          1HG       GLN  94   2.971 -16.977  -4.926
  728   1HE2  GLN  94          1HE2      GLN  94   1.287 -18.510  -5.233
  729   2HE2  GLN  94          2HE2      GLN  94  -0.356 -18.158  -4.991
  730    H    HIS  95           H        HIS  95   3.028 -12.970  -2.395
  731    HA   HIS  95           HA       HIS  95   2.612 -10.200  -3.348
  732   1HB   HIS  95          2HB       HIS  95   0.343 -10.104  -2.518
  733   2HB   HIS  95          1HB       HIS  95   0.453 -11.525  -3.553
  734    HD1  HIS  95           1HD      HIS  95   1.277 -13.783  -2.006
  735    HD2  HIS  95           2HD      HIS  95  -0.885 -10.745  -0.143
  736    HE1  HIS  95           1HE      HIS  95   0.289 -14.793   0.095
  737    H    ASN  96           H        ASN  96   4.566 -11.551  -1.605
  738    HA   ASN  96           HA       ASN  96   5.665 -11.102   0.437
  739   1HB   ASN  96          2HB       ASN  96   4.766  -8.775  -0.412
  740   2HB   ASN  96          1HB       ASN  96   3.634  -8.941   0.932
  741   1HD2  ASN  96          1HD2      ASN  96   4.832  -9.646   3.100
  742   2HD2  ASN  96          2HD2      ASN  96   6.288  -8.833   3.420
  743    H    SER  97           H        SER  97   5.433 -11.798   2.590
  744    HA   SER  97           HA       SER  97   4.410 -12.846   4.437
  745   1HB   SER  97          2HB       SER  97   2.620 -11.640   5.243
  746   2HB   SER  97          1HB       SER  97   3.095 -10.540   3.955
  747    HG   SER  97           HG       SER  97   1.201 -10.904   3.142
  748    H    ALA  98           H        ALA  98   4.076 -15.018   4.292
  749    HA   ALA  98           HA       ALA  98   2.506 -16.183   2.096
  750   1HB   ALA  98          1HB       ALA  98   3.606 -18.125   2.717
  751   2HB   ALA  98          2HB       ALA  98   3.513 -17.746   4.437
  752   3HB   ALA  98          3HB       ALA  98   4.708 -16.940   3.419
  753    H    GLY  99           H        GLY  99   0.673 -14.694   3.378
  754   1HA   GLY  99          2HA       GLY  99  -0.704 -16.480   5.331
  755   2HA   GLY  99          1HA       GLY  99  -1.026 -14.756   5.141
  756    H    LEU 100           H        LEU 100  -3.082 -14.575   4.380
  757    HA   LEU 100           HA       LEU 100  -4.302 -16.592   2.655
  758   1HB   LEU 100          2HB       LEU 100  -5.023 -13.981   3.937
  759   2HB   LEU 100          1HB       LEU 100  -6.037 -14.566   2.617
  760    HG   LEU 100           HG       LEU 100  -5.277 -16.355   4.926
  761   1HD1  LEU 100          1HD1      LEU 100  -6.461 -14.168   5.625
  762   2HD1  LEU 100          2HD1      LEU 100  -7.199 -15.686   6.138
  763   3HD1  LEU 100          3HD1      LEU 100  -7.861 -14.803   4.762
  764   1HD2  LEU 100          1HD2      LEU 100  -7.143 -16.402   2.602
  765   2HD2  LEU 100          2HD2      LEU 100  -7.723 -17.128   4.101
  766   3HD2  LEU 100          3HD2      LEU 100  -6.244 -17.724   3.348
  767    H    ILE 101           H        ILE 101  -4.876 -16.294   0.436
  768    HA   ILE 101           HA       ILE 101  -2.998 -14.923  -1.225
  769    HB   ILE 101           HB       ILE 101  -4.626 -15.536  -3.007
  770   1HG1  ILE 101          2HG1      ILE 101  -6.586 -16.987  -1.699
  771   2HG1  ILE 101          1HG1      ILE 101  -6.426 -15.557  -0.678
  772   1HG2  ILE 101          1HG2      ILE 101  -3.073 -17.203  -1.782
  773   2HG2  ILE 101          2HG2      ILE 101  -4.394 -17.872  -2.738
  774   3HG2  ILE 101          3HG2      ILE 101  -4.539 -17.771  -0.984
  775   1HD1  ILE 101          1HD1      ILE 101  -7.324 -15.769  -3.518
  776   2HD1  ILE 101          2HD1      ILE 101  -6.427 -14.325  -3.049
  777   3HD1  ILE 101          3HD1      ILE 101  -7.931 -14.737  -2.223
  778    H    SER 102           H        SER 102  -2.844 -12.733  -1.462
  779    HA   SER 102           HA       SER 102  -5.298 -11.134  -1.905
  780   1HB   SER 102          2HB       SER 102  -5.088 -11.083   0.496
  781   2HB   SER 102          1HB       SER 102  -3.353 -10.796   0.395
  782    HG   SER 102           HG       SER 102  -5.179  -8.991   0.596
  783    H    ARG 103           H        ARG 103  -3.340 -11.723  -3.792
  784    HA   ARG 103           HA       ARG 103  -1.237  -9.712  -3.880
  785   1HB   ARG 103          2HB       ARG 103  -1.019 -11.891  -4.955
  786   2HB   ARG 103          1HB       ARG 103  -2.458 -11.591  -5.929
  787   1HG   ARG 103          2HG       ARG 103  -0.421 -11.185  -7.252
  788   2HG   ARG 103          1HG       ARG 103  -1.316  -9.684  -7.019
  789   1HD   ARG 103          2HD       ARG 103   0.224  -8.879  -5.402
  790   2HD   ARG 103          1HD       ARG 103   0.919 -10.491  -5.144
  791    HE   ARG 103           HE       ARG 103   1.416 -10.162  -7.782
  792   1HH1  ARG 103          1HH1      ARG 103   1.012  -7.267  -6.272
  793   2HH1  ARG 103          2HH1      ARG 103   2.642  -6.709  -6.451
  794   1HH2  ARG 103          1HH2      ARG 103   3.854  -9.776  -7.521
  795   2HH2  ARG 103          2HH2      ARG 103   4.251  -8.129  -7.158
  796    H    LEU 104           H        LEU 104  -2.492  -7.724  -3.606
  797    HA   LEU 104           HA       LEU 104  -3.584  -5.804  -4.425
  798   1HB   LEU 104          2HB       LEU 104  -1.818  -6.087  -6.129
  799   2HB   LEU 104          1HB       LEU 104  -2.871  -7.165  -7.045
  800    HG   LEU 104           HG       LEU 104  -4.114  -4.586  -6.364
  801   1HD1  LEU 104          1HD1      LEU 104  -2.162  -4.399  -8.601
  802   2HD1  LEU 104          2HD1      LEU 104  -1.509  -4.280  -6.966
  803   3HD1  LEU 104          3HD1      LEU 104  -2.745  -3.143  -7.508
  804   1HD2  LEU 104          1HD2      LEU 104  -3.867  -6.447  -8.703
  805   2HD2  LEU 104          2HD2      LEU 104  -4.415  -4.793  -8.977
  806   3HD2  LEU 104          3HD2      LEU 104  -5.319  -5.855  -7.897
  807    H    LYS 105           H        LYS 105  -5.643  -5.105  -5.281
  808    HA   LYS 105           HA       LYS 105  -7.470  -7.295  -6.177
  809   1HB   LYS 105          2HB       LYS 105  -7.429  -5.794  -3.683
  810   2HB   LYS 105          1HB       LYS 105  -8.966  -5.590  -4.527
  811   1HG   LYS 105          2HG       LYS 105  -9.434  -7.549  -3.410
  812   2HG   LYS 105          1HG       LYS 105  -8.680  -8.236  -4.850
  813   1HD   LYS 105          2HD       LYS 105  -6.489  -8.230  -3.669
  814   2HD   LYS 105          1HD       LYS 105  -7.301  -7.643  -2.218
  815   1HE   LYS 105          2HE       LYS 105  -8.575 -10.029  -3.400
  816   2HE   LYS 105          1HE       LYS 105  -6.931 -10.306  -2.792
  817   1HZ   LYS 105          1HZ       LYS 105  -8.452 -10.536  -0.972
  818   2HZ   LYS 105          2HZ       LYS 105  -9.186  -9.045  -1.324
  819   3HZ   LYS 105          3HZ       LYS 105  -7.586  -9.094  -0.753
  820    H    TYR 106           H        TYR 106  -7.260  -3.711  -5.659
  821    HA   TYR 106           HA       TYR 106  -8.399  -3.420  -8.405
  822   1HB   TYR 106          2HB       TYR 106 -10.299  -3.344  -6.884
  823   2HB   TYR 106          1HB       TYR 106  -9.481  -2.154  -5.874
  824    HD1  TYR 106           1HD      TYR 106  -9.884   0.110  -6.252
  825    HD2  TYR 106           2HD      TYR 106 -10.467  -2.685  -9.454
  826    HE1  TYR 106           1HE      TYR 106 -10.665   1.953  -7.717
  827    HE2  TYR 106           2HE      TYR 106 -11.253  -0.846 -10.916
  828    HH   TYR 106           HH       TYR 106 -12.407   1.753 -10.144
  829    HA   PRO 107           HA       PRO 107  -5.119  -0.361  -8.462
  830   1HB   PRO 107          2HB       PRO 107  -6.165   0.604 -10.964
  831   2HB   PRO 107          1HB       PRO 107  -4.750  -0.417 -10.697
  832   1HG   PRO 107          2HG       PRO 107  -7.235  -1.172 -11.866
  833   2HG   PRO 107          1HG       PRO 107  -5.861  -2.218 -11.494
  834   1HD   PRO 107          2HD       PRO 107  -8.427  -2.058 -10.140
  835   2HD   PRO 107          1HD       PRO 107  -7.103  -3.212  -9.867
  836    H    VAL 108           H        VAL 108  -5.145   1.678  -7.620
  837    HA   VAL 108           HA       VAL 108  -7.407   3.539  -8.135
  838    HB   VAL 108           HB       VAL 108  -6.449   2.551  -5.422
  839   1HG1  VAL 108          1HG1      VAL 108  -8.473   4.717  -6.073
  840   2HG1  VAL 108          2HG1      VAL 108  -6.864   4.999  -5.409
  841   3HG1  VAL 108          3HG1      VAL 108  -8.070   4.130  -4.459
  842   1HG2  VAL 108          1HG2      VAL 108  -8.851   1.911  -5.187
  843   2HG2  VAL 108          2HG2      VAL 108  -8.049   1.059  -6.505
  844   3HG2  VAL 108          3HG2      VAL 108  -9.114   2.419  -6.853
  845    H    SER 109           H        SER 109  -6.662   5.753  -8.044
  846    HA   SER 109           HA       SER 109  -3.810   6.145  -7.203
  847   1HB   SER 109          2HB       SER 109  -5.205   7.589  -9.461
  848   2HB   SER 109          1HB       SER 109  -3.478   7.536  -9.115
  849    HG   SER 109           HG       SER 109  -3.346   5.613  -9.989
  850    H    GLN 110           H        GLN 110  -3.855   7.473  -5.455
  851    HA   GLN 110           HA       GLN 110  -4.517   9.218  -4.006
  852   1HB   GLN 110          2HB       GLN 110  -5.230  10.855  -6.377
  853   2HB   GLN 110          1HB       GLN 110  -4.056  11.181  -5.105
  854   1HG   GLN 110          2HG       GLN 110  -2.723   9.206  -6.234
  855   2HG   GLN 110          1HG       GLN 110  -3.724   9.595  -7.633
  856   1HE2  GLN 110          1HE2      GLN 110  -1.421  11.082  -5.311
  857   2HE2  GLN 110          2HE2      GLN 110  -0.920  12.316  -6.363
  858    H    GLN 111           H        GLN 111  -6.387  11.284  -4.412
  859    HA   GLN 111           HA       GLN 111  -8.860  10.037  -3.689
  860   1HB   GLN 111          2HB       GLN 111  -9.679  12.386  -3.805
  861   2HB   GLN 111          1HB       GLN 111  -8.126  12.277  -2.973
  862   1HG   GLN 111          2HG       GLN 111  -6.974  13.302  -4.690
  863   2HG   GLN 111          1HG       GLN 111  -8.081  12.716  -5.929
  864   1HE2  GLN 111          1HE2      GLN 111  -8.547  14.689  -2.934
  865   2HE2  GLN 111          2HE2      GLN 111  -9.398  15.932  -3.716
  866    H    ASN 112           H        ASN 112 -10.542  11.872  -5.404
  867    HA   ASN 112           HA       ASN 112 -11.712  11.775  -7.448
  868   1HB   ASN 112          2HB       ASN 112  -8.916  11.600  -7.978
  869   2HB   ASN 112          1HB       ASN 112  -9.709  10.433  -9.036
  870   1HD2  ASN 112          1HD2      ASN 112 -11.121  11.249 -10.703
  871   2HD2  ASN 112          2HD2      ASN 112 -11.256  12.906 -11.048
  872    H    LYS 113           H        LYS 113 -12.807  10.001  -6.063
  873    HA   LYS 113           HA       LYS 113 -12.239   7.226  -6.561
  874   1HB   LYS 113          2HB       LYS 113 -14.810   8.594  -5.708
  875   2HB   LYS 113          1HB       LYS 113 -14.392   6.906  -5.429
  876   1HG   LYS 113          2HG       LYS 113 -13.066   9.356  -4.237
  877   2HG   LYS 113          1HG       LYS 113 -13.929   8.079  -3.384
  878   1HD   LYS 113          2HD       LYS 113 -11.906   7.122  -3.068
  879   2HD   LYS 113          1HD       LYS 113 -11.970   6.686  -4.772
  880   1HE   LYS 113          2HE       LYS 113 -11.114   9.341  -4.820
  881   2HE   LYS 113          1HE       LYS 113 -10.255   8.642  -3.437
  882   1HZ   LYS 113          1HZ       LYS 113  -9.836   6.669  -4.949
  883   2HZ   LYS 113          2HZ       LYS 113  -8.959   8.083  -5.295
  884   3HZ   LYS 113          3HZ       LYS 113 -10.314   7.668  -6.233
  885    H    ASN 114           H        ASN 114 -12.056   7.339  -8.985
  886    HA   ASN 114           HA       ASN 114 -14.590   6.595 -10.253
  887   1HB   ASN 114          2HB       ASN 114 -13.679   9.298 -10.224
  888   2HB   ASN 114          1HB       ASN 114 -13.524   8.694 -11.871
  889   1HD2  ASN 114          1HD2      ASN 114 -15.369   9.647 -12.846
  890   2HD2  ASN 114          2HD2      ASN 114 -16.957   9.372 -12.313
  891    H    ALA 115           H        ALA 115 -11.435   7.940 -11.301
  892    HA   ALA 115           HA       ALA 115  -9.829   7.074 -12.803
  893   1HB   ALA 115          1HB       ALA 115  -9.988   5.454 -10.759
  894   2HB   ALA 115          2HB       ALA 115  -9.141   4.900 -12.204
  895   3HB   ALA 115          3HB       ALA 115 -10.793   4.366 -11.890
  896    HA   PRO 116           HA       PRO 116 -13.376   6.025 -15.742
  897   1HB   PRO 116          2HB       PRO 116 -12.332   8.108 -17.432
  898   2HB   PRO 116          1HB       PRO 116 -13.879   8.070 -16.580
  899   1HG   PRO 116          2HG       PRO 116 -11.575   9.673 -15.976
  900   2HG   PRO 116          1HG       PRO 116 -13.125   9.634 -15.129
  901   1HD   PRO 116          2HD       PRO 116 -10.589   8.604 -14.221
  902   2HD   PRO 116          1HD       PRO 116 -12.155   8.548 -13.376
  903    H    SER 117           H        SER 117 -12.772   6.065 -18.402
  904    HA   SER 117           HA       SER 117 -11.556   4.865 -20.037
  905   1HB   SER 117          2HB       SER 117 -10.096   6.861 -19.380
  906   2HB   SER 117          1HB       SER 117  -9.190   5.745 -18.363
  907    HG   SER 117           HG       SER 117  -8.671   6.177 -20.792
  908    H    THR 118           H        THR 118 -12.240   2.727 -19.419
  909    HA   THR 118           HA       THR 118 -10.261   1.220 -17.737
  910    HB   THR 118           HB       THR 118 -13.205   0.646 -18.188
  911    HG1  THR 118           1HG      THR 118 -13.082   2.546 -17.077
  912   1HG2  THR 118          1HG2      THR 118 -11.055  -0.471 -16.399
  913   2HG2  THR 118          2HG2      THR 118 -12.163  -1.338 -17.462
  914   3HG2  THR 118          3HG2      THR 118 -12.759  -0.614 -15.968
  Start of MODEL   17
    1    H    THR   1           1H       THR   1  18.784 -11.011  -6.607
    2    HA   THR   1           HA       THR   1  20.188  -9.149  -5.994
    3    HB   THR   1           HB       THR   1  22.129 -10.206  -8.051
    4    HG1  THR   1           1HG      THR   1  22.796 -11.631  -6.683
    5   1HG2  THR   1          1HG2      THR   1  23.568  -8.605  -7.222
    6   2HG2  THR   1          2HG2      THR   1  22.860  -8.656  -5.607
    7   3HG2  THR   1          3HG2      THR   1  22.029  -7.802  -6.908
    8    H    GLU   2           H        GLU   2  18.149  -8.535  -7.178
    9    HA   GLU   2           HA       GLU   2  18.775  -7.626  -9.968
   10   1HB   GLU   2          2HB       GLU   2  17.193  -9.687  -9.522
   11   2HB   GLU   2          1HB       GLU   2  16.019  -8.445  -9.083
   12   1HG   GLU   2          2HG       GLU   2  15.884  -7.613 -11.231
   13   2HG   GLU   2          1HG       GLU   2  17.541  -8.075 -11.626
   14    H    ALA   3           H        ALA   3  17.331  -5.769 -10.623
   15    HA   ALA   3           HA       ALA   3  16.176  -4.214  -8.362
   16   1HB   ALA   3          1HB       ALA   3  18.224  -3.064 -10.277
   17   2HB   ALA   3          2HB       ALA   3  18.669  -3.746  -8.713
   18   3HB   ALA   3          3HB       ALA   3  17.611  -2.336  -8.793
   19    H    GLU   4           H        GLU   4  14.985  -2.263  -9.233
   20    HA   GLU   4           HA       GLU   4  14.409  -1.997 -12.052
   21   1HB   GLU   4          2HB       GLU   4  12.026  -2.944 -11.779
   22   2HB   GLU   4          1HB       GLU   4  13.337  -4.119 -11.858
   23   1HG   GLU   4          2HG       GLU   4  13.375  -4.224  -9.375
   24   2HG   GLU   4          1HG       GLU   4  12.027  -3.087  -9.322
   25    H    ASP   5           H        ASP   5  13.500   0.010 -12.322
   26    HA   ASP   5           HA       ASP   5  12.160   1.268  -9.950
   27   1HB   ASP   5          2HB       ASP   5  14.486   1.968 -11.451
   28   2HB   ASP   5          1HB       ASP   5  13.259   3.197 -11.743
   29    H    SER   6           H        SER   6  12.445   1.540 -13.514
   30    HA   SER   6           HA       SER   6   9.854   2.875 -13.752
   31   1HB   SER   6          2HB       SER   6  12.092   1.949 -15.489
   32   2HB   SER   6          1HB       SER   6  10.524   2.156 -16.265
   33    HG   SER   6           HG       SER   6  11.803   4.093 -14.625
   34    H    ILE   7           H        ILE   7   8.388   1.299 -12.808
   35    HA   ILE   7           HA       ILE   7   8.118  -1.287 -14.285
   36    HB   ILE   7           HB       ILE   7   8.410  -1.332 -11.835
   37   1HG1  ILE   7          2HG1      ILE   7   5.507  -1.976 -12.290
   38   2HG1  ILE   7          1HG1      ILE   7   6.744  -2.866 -13.178
   39   1HG2  ILE   7          1HG2      ILE   7   6.517   0.861 -12.000
   40   2HG2  ILE   7          2HG2      ILE   7   7.520   0.358 -10.640
   41   3HG2  ILE   7          3HG2      ILE   7   5.936  -0.377 -10.886
   42   1HD1  ILE   7          1HD1      ILE   7   7.849  -3.099 -10.788
   43   2HD1  ILE   7          2HD1      ILE   7   6.548  -4.185 -11.273
   44   3HD1  ILE   7          3HD1      ILE   7   6.202  -2.806 -10.229
   45    H    GLU   8           H        GLU   8   6.876   1.784 -14.467
   46    HA   GLU   8           HA       GLU   8   4.900   2.686 -15.387
   47   1HB   GLU   8          2HB       GLU   8   4.640  -0.184 -16.354
   48   2HB   GLU   8          1HB       GLU   8   3.830   1.218 -17.051
   49   1HG   GLU   8          2HG       GLU   8   6.095   2.222 -17.491
   50   2HG   GLU   8          1HG       GLU   8   6.815   0.698 -16.966
   51    H    MET   9           H        MET   9   2.404   2.342 -15.353
   52    HA   MET   9           HA       MET   9   1.303   0.444 -13.473
   53   1HB   MET   9          2HB       MET   9   0.703   2.331 -11.818
   54   2HB   MET   9          1HB       MET   9   2.369   1.761 -11.813
   55   1HG   MET   9          2HG       MET   9   2.602   4.104 -11.833
   56   2HG   MET   9          1HG       MET   9   2.799   3.673 -13.527
   57   1HE   MET   9          1HE       MET   9   0.120   4.544 -15.447
   58   2HE   MET   9          2HE       MET   9   1.816   4.165 -15.166
   59   3HE   MET   9          3HE       MET   9   1.289   5.844 -15.181
   60    H    TYR  10           H        TYR  10  -0.976   1.664 -12.679
   61    HA   TYR  10           HA       TYR  10  -2.165   2.960 -15.068
   62   1HB   TYR  10          2HB       TYR  10  -3.395   0.645 -13.549
   63   2HB   TYR  10          1HB       TYR  10  -3.973   1.352 -15.057
   64    HD1  TYR  10           1HD      TYR  10  -1.820  -1.109 -13.568
   65    HD2  TYR  10           2HD      TYR  10  -2.421   1.251 -17.106
   66    HE1  TYR  10           1HE      TYR  10  -0.364  -2.654 -14.845
   67    HE2  TYR  10           2HE      TYR  10  -0.965  -0.295 -18.385
   68    HH   TYR  10           HH       TYR  10   0.816  -1.908 -17.969
   69    H    GLU  11           H        GLU  11  -2.749   1.927 -11.692
   70    HA   GLU  11           HA       GLU  11  -3.875   4.616 -11.108
   71   1HB   GLU  11          2HB       GLU  11  -5.543   2.618 -11.851
   72   2HB   GLU  11          1HB       GLU  11  -5.423   2.273 -10.128
   73   1HG   GLU  11          2HG       GLU  11  -7.201   3.768 -10.167
   74   2HG   GLU  11          1HG       GLU  11  -5.840   4.849  -9.869
   75    H    TRP  12           H        TRP  12  -3.327   1.360  -9.764
   76    HA   TRP  12           HA       TRP  12  -3.221   1.952  -7.038
   77   1HB   TRP  12          2HB       TRP  12  -1.802  -0.094  -6.932
   78   2HB   TRP  12          1HB       TRP  12  -3.187  -0.295  -8.001
   79    HD1  TRP  12           HD       TRP  12  -2.742  -0.580 -10.563
   80    HE1  TRP  12           1HE      TRP  12  -0.604  -0.974 -11.949
   81    HE3  TRP  12           3HE      TRP  12   0.802   0.487  -7.045
   82    HZ2  TRP  12           2HZ      TRP  12   2.233  -0.856 -11.610
   83    HZ3  TRP  12           3HZ      TRP  12   3.212   0.337  -7.603
   84    HH2  TRP  12           HH       TRP  12   3.932  -0.332  -9.879
   85    H    TYR  13           H        TYR  13  -0.850   2.780  -9.480
   86    HA   TYR  13           HA       TYR  13   1.304   3.198  -7.520
   87   1HB   TYR  13          2HB       TYR  13   1.572   2.481  -9.930
   88   2HB   TYR  13          1HB       TYR  13   1.096   4.114 -10.400
   89    HD1  TYR  13           1HD      TYR  13   2.437   6.085  -9.445
   90    HD2  TYR  13           2HD      TYR  13   3.799   2.015  -9.294
   91    HE1  TYR  13           1HE      TYR  13   4.755   6.876  -9.053
   92    HE2  TYR  13           2HE      TYR  13   6.118   2.805  -8.903
   93    HH   TYR  13           HH       TYR  13   7.083   5.199  -7.809
   94    H    SER  14           H        SER  14   1.558   5.031  -6.343
   95    HA   SER  14           HA       SER  14   0.350   7.579  -7.362
   96   1HB   SER  14          2HB       SER  14   0.443   6.824  -4.449
   97   2HB   SER  14          1HB       SER  14  -0.630   7.963  -5.259
   98    HG   SER  14           HG       SER  14  -1.928   6.373  -5.709
   99    H    LYS  15           H        LYS  15   1.800   9.234  -7.355
  100    HA   LYS  15           HA       LYS  15   4.522   8.814  -6.506
  101   1HB   LYS  15          2HB       LYS  15   4.923  10.838  -7.628
  102   2HB   LYS  15          1HB       LYS  15   3.519  10.183  -8.458
  103   1HG   LYS  15          2HG       LYS  15   3.569  12.385  -6.378
  104   2HG   LYS  15          1HG       LYS  15   3.076  12.508  -8.064
  105   1HD   LYS  15          2HD       LYS  15   1.091  11.274  -7.697
  106   2HD   LYS  15          1HD       LYS  15   1.657  10.664  -6.146
  107   1HE   LYS  15          2HE       LYS  15   1.531  13.615  -6.327
  108   2HE   LYS  15          1HE       LYS  15  -0.037  12.779  -6.352
  109   1HZ   LYS  15          1HZ       LYS  15   0.839  13.185  -4.069
  110   2HZ   LYS  15          2HZ       LYS  15   2.146  12.160  -4.431
  111   3HZ   LYS  15          3HZ       LYS  15   0.561  11.547  -4.411
  112    H    HIS  16           H        HIS  16   4.781   8.618  -4.299
  113    HA   HIS  16           HA       HIS  16   4.982   9.282  -2.055
  114   1HB   HIS  16          2HB       HIS  16   4.729  11.958  -3.463
  115   2HB   HIS  16          1HB       HIS  16   5.277  11.753  -1.801
  116    HD1  HIS  16           1HD      HIS  16   7.637  10.798  -1.421
  117    HD2  HIS  16           2HD      HIS  16   6.582  11.025  -5.448
  118    HE1  HIS  16           1HE      HIS  16   9.756  10.373  -2.742
  119    H    MET  17           H        MET  17   2.447   8.414  -2.643
  120    HA   MET  17           HA       MET  17   0.424  10.397  -1.883
  121   1HB   MET  17          2HB       MET  17  -0.033   8.556  -3.439
  122   2HB   MET  17          1HB       MET  17   0.401   7.377  -2.204
  123   1HG   MET  17          2HG       MET  17  -1.451   8.338  -0.772
  124   2HG   MET  17          1HG       MET  17  -1.951   9.286  -2.173
  125   1HE   MET  17          1HE       MET  17  -0.494   5.459  -2.387
  126   2HE   MET  17          2HE       MET  17  -1.915   4.765  -1.612
  127   3HE   MET  17          3HE       MET  17  -0.985   6.007  -0.778
  128    H    THR  18           H        THR  18   0.097  10.975   0.223
  129    HA   THR  18           HA       THR  18   1.413   9.900   2.478
  130    HB   THR  18           HB       THR  18  -1.319  11.195   2.464
  131    HG1  THR  18           1HG      THR  18   1.250  12.327   2.080
  132   1HG2  THR  18          1HG2      THR  18  -0.755  10.760   4.676
  133   2HG2  THR  18          2HG2      THR  18  -0.065  12.368   4.457
  134   3HG2  THR  18          3HG2      THR  18   0.974  10.944   4.378
  135    H    ARG  19           H        ARG  19   0.865   8.334   3.998
  136    HA   ARG  19           HA       ARG  19  -0.592   6.026   3.322
  137   1HB   ARG  19          2HB       ARG  19  -0.389   5.523   5.701
  138   2HB   ARG  19          1HB       ARG  19   1.060   6.392   5.195
  139   1HG   ARG  19          2HG       ARG  19  -0.070   8.533   5.981
  140   2HG   ARG  19          1HG       ARG  19  -1.333   7.523   6.688
  141   1HD   ARG  19          2HD       ARG  19   0.890   6.285   7.683
  142   2HD   ARG  19          1HD       ARG  19   1.450   7.967   7.611
  143    HE   ARG  19           HE       ARG  19  -0.994   8.331   8.691
  144   1HH1  ARG  19          1HH2      ARG  19   1.883   7.431   9.964
  145   2HH1  ARG  19          2HH2      ARG  19   1.258   6.587  11.341
  146   1HH2  ARG  19          1HH1      ARG  19  -2.016   6.611  10.201
  147   2HH2  ARG  19          2HH1      ARG  19  -0.949   6.122  11.475
  148    H    SER  20           H        SER  20  -1.646   8.940   5.001
  149    HA   SER  20           HA       SER  20  -4.307   8.003   5.629
  150   1HB   SER  20          2HB       SER  20  -3.893   9.767   6.981
  151   2HB   SER  20          1HB       SER  20  -2.558  10.299   5.970
  152    HG   SER  20           HG       SER  20  -3.830  11.757   5.150
  153    H    GLN  21           H        GLN  21  -2.860   9.863   2.960
  154    HA   GLN  21           HA       GLN  21  -5.284  10.632   1.653
  155   1HB   GLN  21          2HB       GLN  21  -2.439  10.080   0.795
  156   2HB   GLN  21          1HB       GLN  21  -3.661  10.580  -0.376
  157   1HG   GLN  21          2HG       GLN  21  -3.435  12.165   2.143
  158   2HG   GLN  21          1HG       GLN  21  -2.169  12.368   0.935
  159   1HE2  GLN  21          1HE2      GLN  21  -5.497  13.084   1.693
  160   2HE2  GLN  21          2HE2      GLN  21  -5.849  13.934   0.266
  161    H    ALA  22           H        ALA  22  -3.260   7.704   1.400
  162    HA   ALA  22           HA       ALA  22  -4.821   6.423  -0.636
  163   1HB   ALA  22          1HB       ALA  22  -3.366   4.658  -0.248
  164   2HB   ALA  22          2HB       ALA  22  -3.469   4.835   1.503
  165   3HB   ALA  22          3HB       ALA  22  -2.456   5.932   0.564
  166    H    GLU  23           H        GLU  23  -4.885   6.278   2.922
  167    HA   GLU  23           HA       GLU  23  -6.969   4.409   3.283
  168   1HB   GLU  23          2HB       GLU  23  -5.932   6.816   4.760
  169   2HB   GLU  23          1HB       GLU  23  -7.356   5.976   5.371
  170   1HG   GLU  23          2HG       GLU  23  -5.764   3.850   4.927
  171   2HG   GLU  23          1HG       GLU  23  -4.528   5.068   5.242
  172    H    GLN  24           H        GLN  24  -7.282   7.992   3.123
  173    HA   GLN  24           HA       GLN  24 -10.137   7.951   3.159
  174   1HB   GLN  24          2HB       GLN  24  -9.898  10.316   2.466
  175   2HB   GLN  24          1HB       GLN  24  -8.772   9.903   3.756
  176   1HG   GLN  24          2HG       GLN  24  -7.009   9.530   2.013
  177   2HG   GLN  24          1HG       GLN  24  -8.143  10.122   0.801
  178   1HE2  GLN  24          1HE2      GLN  24  -8.393  12.388   0.602
  179   2HE2  GLN  24          2HE2      GLN  24  -7.628  13.513   1.616
  180    H    LEU  25           H        LEU  25  -7.867   8.263   0.345
  181    HA   LEU  25           HA       LEU  25 -10.081   8.300  -1.513
  182   1HB   LEU  25          2HB       LEU  25  -8.345   8.011  -3.212
  183   2HB   LEU  25          1HB       LEU  25  -7.807   9.174  -2.007
  184    HG   LEU  25           HG       LEU  25  -6.778   7.009  -0.867
  185   1HD1  LEU  25          1HD1      LEU  25  -6.664   5.149  -2.145
  186   2HD1  LEU  25          2HD1      LEU  25  -6.146   6.066  -3.558
  187   3HD1  LEU  25          3HD1      LEU  25  -7.862   5.907  -3.190
  188   1HD2  LEU  25          1HD2      LEU  25  -5.827   9.096  -2.509
  189   2HD2  LEU  25          2HD2      LEU  25  -5.081   7.631  -3.143
  190   3HD2  LEU  25          3HD2      LEU  25  -4.862   8.070  -1.452
  191    H    LEU  26           H        LEU  26  -8.419   5.759   0.199
  192    HA   LEU  26           HA       LEU  26  -9.284   3.608  -1.584
  193   1HB   LEU  26          2HB       LEU  26  -7.965   3.942   1.073
  194   2HB   LEU  26          1HB       LEU  26  -8.791   2.421   0.795
  195    HG   LEU  26           HG       LEU  26  -6.728   3.594  -1.087
  196   1HD1  LEU  26          1HD1      LEU  26  -5.252   2.889   0.488
  197   2HD1  LEU  26          2HD1      LEU  26  -5.673   1.267  -0.059
  198   3HD1  LEU  26          3HD1      LEU  26  -6.480   1.961   1.346
  199   1HD2  LEU  26          1HD2      LEU  26  -7.508   0.712  -1.042
  200   2HD2  LEU  26          2HD2      LEU  26  -7.019   1.719  -2.404
  201   3HD2  LEU  26          3HD2      LEU  26  -8.652   1.849  -1.754
  202    H    LYS  27           H        LYS  27 -10.235   4.563   1.754
  203    HA   LYS  27           HA       LYS  27 -12.596   3.034   1.975
  204   1HB   LYS  27          2HB       LYS  27 -11.205   4.931   3.428
  205   2HB   LYS  27          1HB       LYS  27 -12.728   5.752   3.089
  206   1HG   LYS  27          2HG       LYS  27 -13.640   3.280   3.785
  207   2HG   LYS  27          1HG       LYS  27 -12.197   3.389   4.792
  208   1HD   LYS  27          2HD       LYS  27 -12.988   5.248   5.960
  209   2HD   LYS  27          1HD       LYS  27 -14.091   5.717   4.667
  210   1HE   LYS  27          2HE       LYS  27 -15.577   4.792   6.233
  211   2HE   LYS  27          1HE       LYS  27 -15.225   3.378   5.221
  212   1HZ   LYS  27          1HZ       LYS  27 -13.382   2.839   6.719
  213   2HZ   LYS  27          2HZ       LYS  27 -14.870   2.837   7.540
  214   3HZ   LYS  27          3HZ       LYS  27 -13.800   4.145   7.716
  215    H    GLN  28           H        GLN  28 -12.158   6.305   0.612
  216    HA   GLN  28           HA       GLN  28 -14.930   6.779   0.014
  217   1HB   GLN  28          2HB       GLN  28 -12.865   8.351   0.142
  218   2HB   GLN  28          1HB       GLN  28 -12.593   7.886  -1.538
  219   1HG   GLN  28          2HG       GLN  28 -14.457   8.999  -2.290
  220   2HG   GLN  28          1HG       GLN  28 -15.364   8.693  -0.809
  221   1HE2  GLN  28          1HE2      GLN  28 -14.654  10.017   1.151
  222   2HE2  GLN  28          2HE2      GLN  28 -14.042  11.578   0.884
  223    H    GLU  29           H        GLU  29 -12.283   5.345  -1.923
  224    HA   GLU  29           HA       GLU  29 -13.586   5.161  -4.432
  225   1HB   GLU  29          2HB       GLU  29 -11.176   4.486  -3.507
  226   2HB   GLU  29          1HB       GLU  29 -11.914   2.891  -3.396
  227   1HG   GLU  29          2HG       GLU  29 -11.303   2.699  -5.574
  228   2HG   GLU  29          1HG       GLU  29 -12.720   3.699  -5.891
  229    H    GLY  30           H        GLY  30 -13.816   3.133  -1.545
  230   1HA   GLY  30          2HA       GLY  30 -15.510   1.663  -0.880
  231   2HA   GLY  30          1HA       GLY  30 -16.449   2.260  -2.246
  232    H    LYS  31           H        LYS  31 -13.269   0.888  -2.642
  233    HA   LYS  31           HA       LYS  31 -14.458  -1.352  -4.225
  234   1HB   LYS  31          2HB       LYS  31 -11.600  -0.351  -4.131
  235   2HB   LYS  31          1HB       LYS  31 -12.360  -1.305  -5.403
  236   1HG   LYS  31          2HG       LYS  31 -13.139   1.533  -4.656
  237   2HG   LYS  31          1HG       LYS  31 -12.152   1.087  -6.041
  238   1HD   LYS  31          2HD       LYS  31 -14.751  -0.321  -5.802
  239   2HD   LYS  31          1HD       LYS  31 -14.833   1.397  -6.188
  240   1HE   LYS  31          2HE       LYS  31 -13.464   1.108  -8.151
  241   2HE   LYS  31          1HE       LYS  31 -13.076  -0.565  -7.700
  242   1HZ   LYS  31          1HZ       LYS  31 -15.369  -1.165  -7.879
  243   2HZ   LYS  31          2HZ       LYS  31 -14.924  -0.392  -9.324
  244   3HZ   LYS  31          3HZ       LYS  31 -15.833   0.443  -8.157
  245    H    GLU  32           H        GLU  32 -14.529  -3.292  -3.079
  246    HA   GLU  32           HA       GLU  32 -13.016  -3.764  -0.691
  247   1HB   GLU  32          2HB       GLU  32 -13.748  -6.141  -1.076
  248   2HB   GLU  32          1HB       GLU  32 -15.053  -4.957  -1.082
  249   1HG   GLU  32          2HG       GLU  32 -15.518  -5.297  -3.289
  250   2HG   GLU  32          1HG       GLU  32 -13.814  -5.414  -3.724
  251    H    GLY  33           H        GLY  33 -10.814  -3.251  -1.302
  252   1HA   GLY  33          2HA       GLY  33  -8.804  -4.734  -1.487
  253   2HA   GLY  33          1HA       GLY  33  -9.549  -5.361  -2.953
  254    H    GLY  34           H        GLY  34  -9.555  -1.908  -2.129
  255   1HA   GLY  34          2HA       GLY  34  -8.439  -1.235  -4.705
  256   2HA   GLY  34          1HA       GLY  34  -8.665  -0.106  -3.364
  257    H    PHE  35           H        PHE  35  -6.419  -2.082  -5.047
  258    HA   PHE  35           HA       PHE  35  -4.326  -1.970  -2.972
  259   1HB   PHE  35          2HB       PHE  35  -4.703  -3.929  -4.415
  260   2HB   PHE  35          1HB       PHE  35  -4.419  -2.943  -5.846
  261    HD1  PHE  35           1HD      PHE  35  -2.125  -1.787  -6.068
  262    HD2  PHE  35           2HD      PHE  35  -2.916  -4.969  -3.295
  263    HE1  PHE  35           1HE      PHE  35   0.307  -2.248  -5.905
  264    HE2  PHE  35           2HE      PHE  35  -0.485  -5.428  -3.128
  265    HZ   PHE  35           HZ       PHE  35   1.127  -4.069  -4.432
  266    H    ILE  36           H        ILE  36  -2.909  -0.274  -2.810
  267    HA   ILE  36           HA       ILE  36  -2.272   1.304  -5.276
  268    HB   ILE  36           HB       ILE  36  -2.923   2.359  -2.502
  269   1HG1  ILE  36          2HG1      ILE  36  -4.459   2.489  -5.118
  270   2HG1  ILE  36          1HG1      ILE  36  -4.918   1.555  -3.696
  271   1HG2  ILE  36          1HG2      ILE  36  -2.240   3.764  -5.103
  272   2HG2  ILE  36          2HG2      ILE  36  -1.264   3.748  -3.634
  273   3HG2  ILE  36          3HG2      ILE  36  -2.821   4.577  -3.650
  274   1HD1  ILE  36          1HD1      ILE  36  -5.048   4.504  -4.150
  275   2HD1  ILE  36          2HD1      ILE  36  -4.686   3.944  -2.517
  276   3HD1  ILE  36          3HD1      ILE  36  -6.182   3.446  -3.308
  277    H    VAL  37           H        VAL  37  -0.192   2.541  -4.988
  278    HA   VAL  37           HA       VAL  37   1.570   1.585  -2.800
  279    HB   VAL  37           HB       VAL  37   2.181   1.237  -5.754
  280   1HG1  VAL  37          1HG1      VAL  37   3.988   1.617  -3.783
  281   2HG1  VAL  37          2HG1      VAL  37   4.284   0.541  -5.147
  282   3HG1  VAL  37          3HG1      VAL  37   3.735  -0.119  -3.607
  283   1HG2  VAL  37          1HG2      VAL  37   1.326  -0.716  -3.601
  284   2HG2  VAL  37          2HG2      VAL  37   2.103  -1.230  -5.098
  285   3HG2  VAL  37          3HG2      VAL  37   0.543  -0.410  -5.151
  286    H    ARG  38           H        ARG  38   3.370   3.007  -2.458
  287    HA   ARG  38           HA       ARG  38   3.661   5.327  -4.302
  288   1HB   ARG  38          2HB       ARG  38   3.423   6.868  -2.355
  289   2HB   ARG  38          1HB       ARG  38   1.945   5.961  -2.672
  290   1HG   ARG  38          2HG       ARG  38   2.114   5.634  -0.389
  291   2HG   ARG  38          1HG       ARG  38   3.057   4.253  -0.949
  292   1HD   ARG  38          2HD       ARG  38   4.994   5.102  -0.104
  293   2HD   ARG  38          1HD       ARG  38   4.634   6.733  -0.704
  294    HE   ARG  38           HE       ARG  38   2.851   6.654   1.261
  295   1HH1  ARG  38          1HH1      ARG  38   6.018   7.189   1.476
  296   2HH1  ARG  38          2HH1      ARG  38   6.274   6.518   3.051
  297   1HH2  ARG  38          1HH2      ARG  38   3.171   4.976   3.188
  298   2HH2  ARG  38          2HH2      ARG  38   4.662   5.264   4.020
  299    H    ASP  39           H        ASP  39   5.657   6.542  -3.887
  300    HA   ASP  39           HA       ASP  39   7.859   4.817  -3.011
  301   1HB   ASP  39          2HB       ASP  39   7.658   6.586  -4.940
  302   2HB   ASP  39          1HB       ASP  39   8.051   7.749  -3.672
  303    H    SER  40           H        SER  40   9.423   5.497  -1.343
  304    HA   SER  40           HA       SER  40   8.094   6.961   0.904
  305   1HB   SER  40          2HB       SER  40   8.795   4.568   1.167
  306   2HB   SER  40          1HB       SER  40  10.461   5.059   0.870
  307    HG   SER  40           HG       SER  40   8.866   5.386   3.100
  308    H    SER  41           H        SER  41  10.690   7.267   2.285
  309    HA   SER  41           HA       SER  41  12.197   9.137   0.527
  310   1HB   SER  41          2HB       SER  41  10.983   9.918   3.194
  311   2HB   SER  41          1HB       SER  41  11.859  10.972   2.088
  312    HG   SER  41           HG       SER  41  10.202  10.763   0.615
  313    H    LYS  42           H        LYS  42  11.903   8.072   3.947
  314    HA   LYS  42           HA       LYS  42  14.607   8.429   4.703
  315   1HB   LYS  42          2HB       LYS  42  12.458   6.455   5.522
  316   2HB   LYS  42          1HB       LYS  42  13.990   6.605   6.383
  317   1HG   LYS  42          2HG       LYS  42  13.540   8.967   6.839
  318   2HG   LYS  42          1HG       LYS  42  12.039   8.878   5.914
  319   1HD   LYS  42          2HD       LYS  42  12.394   6.892   8.105
  320   2HD   LYS  42          1HD       LYS  42  12.089   8.563   8.581
  321   1HE   LYS  42          2HE       LYS  42  10.373   7.301   6.451
  322   2HE   LYS  42          1HE       LYS  42  10.033   6.986   8.165
  323   1HZ   LYS  42          1HZ       LYS  42   8.875   8.970   7.499
  324   2HZ   LYS  42          2HZ       LYS  42  10.300   9.649   6.871
  325   3HZ   LYS  42          3HZ       LYS  42  10.138   9.406   8.544
  326    H    ALA  43           H        ALA  43  13.159   5.234   3.991
  327    HA   ALA  43           HA       ALA  43  15.818   4.160   3.258
  328   1HB   ALA  43          1HB       ALA  43  13.570   2.397   2.808
  329   2HB   ALA  43          2HB       ALA  43  13.376   3.219   4.356
  330   3HB   ALA  43          3HB       ALA  43  14.831   2.275   4.035
  331    H    GLY  44           H        GLY  44  13.088   5.544   1.694
  332   1HA   GLY  44          2HA       GLY  44  12.698   5.907  -0.606
  333   2HA   GLY  44          1HA       GLY  44  14.239   5.102  -0.945
  334    H    LYS  45           H        LYS  45  11.826   3.630   1.098
  335    HA   LYS  45           HA       LYS  45  11.661   1.333  -0.730
  336   1HB   LYS  45          2HB       LYS  45  10.557   0.298   1.206
  337   2HB   LYS  45          1HB       LYS  45  12.039   1.108   1.710
  338   1HG   LYS  45          2HG       LYS  45   9.830   2.971   1.792
  339   2HG   LYS  45          1HG       LYS  45   9.428   1.528   2.719
  340   1HD   LYS  45          2HD       LYS  45  11.830   1.798   3.711
  341   2HD   LYS  45          1HD       LYS  45  11.701   3.456   3.121
  342   1HE   LYS  45          2HE       LYS  45  10.777   3.734   5.236
  343   2HE   LYS  45          1HE       LYS  45   9.309   3.277   4.349
  344   1HZ   LYS  45          1HZ       LYS  45  11.146   1.321   5.623
  345   2HZ   LYS  45          2HZ       LYS  45   9.627   1.005   4.930
  346   3HZ   LYS  45          3HZ       LYS  45   9.737   1.904   6.368
  347    H    TYR  46           H        TYR  46   9.253   0.343  -0.743
  348    HA   TYR  46           HA       TYR  46   7.426   2.570  -1.585
  349   1HB   TYR  46          2HB       TYR  46   7.512  -0.348  -2.418
  350   2HB   TYR  46          1HB       TYR  46   6.469   0.888  -3.108
  351    HD1  TYR  46           1HD      TYR  46   8.940   2.993  -2.778
  352    HD2  TYR  46           2HD      TYR  46   8.350  -0.779  -4.746
  353    HE1  TYR  46           1HE      TYR  46  10.708   3.570  -4.410
  354    HE2  TYR  46           2HE      TYR  46  10.122  -0.199  -6.379
  355    HH   TYR  46           HH       TYR  46  12.353   1.738  -6.060
  356    H    THR  47           H        THR  47   5.128   2.256  -1.100
  357    HA   THR  47           HA       THR  47   4.605   0.364   1.170
  358    HB   THR  47           HB       THR  47   3.689   3.234   0.771
  359    HG1  THR  47           1HG      THR  47   5.433   3.623   1.838
  360   1HG2  THR  47          1HG2      THR  47   2.689   1.045   2.467
  361   2HG2  THR  47          2HG2      THR  47   1.919   2.569   2.029
  362   3HG2  THR  47          3HG2      THR  47   3.073   2.517   3.361
  363    H    VAL  48           H        VAL  48   2.872  -0.966   0.764
  364    HA   VAL  48           HA       VAL  48   1.214  -0.385  -1.647
  365    HB   VAL  48           HB       VAL  48   1.601  -2.822   0.112
  366   1HG1  VAL  48          1HG1      VAL  48   0.418  -4.021  -1.733
  367   2HG1  VAL  48          2HG1      VAL  48   0.045  -2.459  -2.462
  368   3HG1  VAL  48          3HG1      VAL  48  -0.621  -2.877  -0.884
  369   1HG2  VAL  48          1HG2      VAL  48   3.462  -1.892  -1.479
  370   2HG2  VAL  48          2HG2      VAL  48   2.435  -2.530  -2.762
  371   3HG2  VAL  48          3HG2      VAL  48   3.077  -3.612  -1.528
  372    H    SER  49           H        SER  49  -0.522   0.903  -1.102
  373    HA   SER  49           HA       SER  49  -1.928   0.561   1.479
  374   1HB   SER  49          2HB       SER  49  -1.872   2.473  -0.826
  375   2HB   SER  49          1HB       SER  49  -3.318   2.438   0.179
  376    HG   SER  49           HG       SER  49  -0.691   3.167   0.809
  377    H    VAL  50           H        VAL  50  -3.281  -1.260   1.461
  378    HA   VAL  50           HA       VAL  50  -5.087  -1.548  -0.923
  379    HB   VAL  50           HB       VAL  50  -5.099  -3.990  -0.228
  380   1HG1  VAL  50          1HG1      VAL  50  -3.735  -3.631  -2.064
  381   2HG1  VAL  50          2HG1      VAL  50  -2.543  -4.213  -0.902
  382   3HG1  VAL  50          3HG1      VAL  50  -2.705  -2.483  -1.209
  383   1HG2  VAL  50          1HG2      VAL  50  -2.567  -3.549   1.263
  384   2HG2  VAL  50          2HG2      VAL  50  -3.830  -4.752   1.522
  385   3HG2  VAL  50          3HG2      VAL  50  -4.045  -3.105   2.111
  386    H    PHE  51           H        PHE  51  -7.243  -1.208  -0.449
  387    HA   PHE  51           HA       PHE  51  -8.099  -1.682   2.393
  388   1HB   PHE  51          2HB       PHE  51  -8.655   0.514   2.465
  389   2HB   PHE  51          1HB       PHE  51  -7.936   0.705   0.871
  390    HD1  PHE  51           1HD      PHE  51  -9.381   0.139  -1.175
  391    HD2  PHE  51           2HD      PHE  51 -10.999   0.728   2.756
  392    HE1  PHE  51           1HE      PHE  51 -11.612   0.520  -2.156
  393    HE2  PHE  51           2HE      PHE  51 -13.244   1.103   1.772
  394    HZ   PHE  51           HZ       PHE  51 -13.551   1.001  -0.684
  395    H    ALA  52           H        ALA  52 -10.653  -1.732   2.427
  396    HA   ALA  52           HA       ALA  52 -12.028  -2.618   0.043
  397   1HB   ALA  52          1HB       ALA  52 -10.627  -4.586   0.405
  398   2HB   ALA  52          2HB       ALA  52 -12.306  -4.989   0.764
  399   3HB   ALA  52          3HB       ALA  52 -11.171  -4.692   2.080
  400    H    LYS  53           H        LYS  53 -14.279  -3.068   0.447
  401    HA   LYS  53           HA       LYS  53 -15.237  -2.043   3.096
  402   1HB   LYS  53          2HB       LYS  53 -16.170  -2.010   0.250
  403   2HB   LYS  53          1HB       LYS  53 -17.391  -1.943   1.522
  404   1HG   LYS  53          2HG       LYS  53 -15.674  -0.115   2.493
  405   2HG   LYS  53          1HG       LYS  53 -15.326   0.063   0.773
  406   1HD   LYS  53          2HD       LYS  53 -17.786   0.303   0.357
  407   2HD   LYS  53          1HD       LYS  53 -18.039   0.293   2.102
  408   1HE   LYS  53          2HE       LYS  53 -17.322   2.447   2.327
  409   2HE   LYS  53          1HE       LYS  53 -15.974   2.205   1.198
  410   1HZ   LYS  53          1HZ       LYS  53 -17.653   3.668   0.239
  411   2HZ   LYS  53          2HZ       LYS  53 -18.838   2.468   0.444
  412   3HZ   LYS  53          3HZ       LYS  53 -17.551   2.217  -0.634
  413    H    SER  54           H        SER  54 -14.422  -4.740   3.133
  414    HA   SER  54           HA       SER  54 -16.976  -6.092   3.717
  415   1HB   SER  54          2HB       SER  54 -15.317  -6.560   1.300
  416   2HB   SER  54          1HB       SER  54 -15.888  -8.006   2.126
  417    HG   SER  54           HG       SER  54 -17.241  -6.275   0.575
  418    H    THR  55           H        THR  55 -15.469  -5.696   5.753
  419    HA   THR  55           HA       THR  55 -14.328  -8.276   6.507
  420    HB   THR  55           HB       THR  55 -12.280  -6.207   6.817
  421    HG1  THR  55           1HG      THR  55 -11.756  -6.024   4.684
  422   1HG2  THR  55          1HG2      THR  55 -11.922  -8.737   5.274
  423   2HG2  THR  55          2HG2      THR  55 -12.269  -8.844   7.000
  424   3HG2  THR  55          3HG2      THR  55 -10.841  -7.974   6.440
  425    H    GLY  56           H        GLY  56 -12.595  -6.850   8.568
  426   1HA   GLY  56          2HA       GLY  56 -14.388  -6.644  10.715
  427   2HA   GLY  56          1HA       GLY  56 -12.853  -5.770  10.656
  428    H    ASP  57           H        ASP  57 -13.583  -4.339   8.219
  429    HA   ASP  57           HA       ASP  57 -15.591  -2.405   9.316
  430   1HB   ASP  57          2HB       ASP  57 -12.937  -2.026   8.870
  431   2HB   ASP  57          1HB       ASP  57 -13.579  -1.619   7.279
  432    HA   PRO  58           HA       PRO  58 -17.309  -4.554   5.540
  433   1HB   PRO  58          2HB       PRO  58 -19.821  -3.458   6.427
  434   2HB   PRO  58          1HB       PRO  58 -19.310  -5.148   6.389
  435   1HG   PRO  58          2HG       PRO  58 -19.568  -3.398   8.676
  436   2HG   PRO  58          1HG       PRO  58 -19.185  -5.122   8.650
  437   1HD   PRO  58          2HD       PRO  58 -17.415  -3.015   9.319
  438   2HD   PRO  58          1HD       PRO  58 -16.968  -4.713   9.015
  439    H    GLN  59           H        GLN  59 -17.438  -1.286   6.725
  440    HA   GLN  59           HA       GLN  59 -18.331  -0.338   4.032
  441   1HB   GLN  59          2HB       GLN  59 -18.809   1.783   5.374
  442   2HB   GLN  59          1HB       GLN  59 -19.783   0.374   5.798
  443   1HG   GLN  59          2HG       GLN  59 -18.716   0.065   7.817
  444   2HG   GLN  59          1HG       GLN  59 -17.199   0.756   7.241
  445   1HE2  GLN  59          1HE2      GLN  59 -17.008   3.125   7.212
  446   2HE2  GLN  59          2HE2      GLN  59 -18.079   4.099   8.099
  447    H    GLY  60           H        GLY  60 -15.424  -0.913   5.390
  448   1HA   GLY  60          2HA       GLY  60 -13.913   0.650   3.695
  449   2HA   GLY  60          1HA       GLY  60 -14.201   1.696   5.075
  450    H    VAL  61           H        VAL  61 -12.383  -0.980   3.882
  451    HA   VAL  61           HA       VAL  61 -10.972  -1.206   6.525
  452    HB   VAL  61           HB       VAL  61 -11.279  -3.214   4.261
  453   1HG1  VAL  61          1HG1      VAL  61 -10.362  -4.083   6.934
  454   2HG1  VAL  61          2HG1      VAL  61  -9.217  -3.087   6.038
  455   3HG1  VAL  61          3HG1      VAL  61  -9.817  -4.588   5.335
  456   1HG2  VAL  61          1HG2      VAL  61 -12.773  -4.409   5.721
  457   2HG2  VAL  61          2HG2      VAL  61 -13.333  -2.741   5.622
  458   3HG2  VAL  61          3HG2      VAL  61 -12.448  -3.290   7.044
  459    H    ILE  62           H        ILE  62  -8.736  -1.024   6.455
  460    HA   ILE  62           HA       ILE  62  -7.438  -0.682   3.797
  461    HB   ILE  62           HB       ILE  62  -6.704   1.326   5.832
  462   1HG1  ILE  62          2HG1      ILE  62  -9.493   1.238   4.639
  463   2HG1  ILE  62          1HG1      ILE  62  -9.089   1.169   6.344
  464   1HG2  ILE  62          1HG2      ILE  62  -6.795   0.971   2.968
  465   2HG2  ILE  62          2HG2      ILE  62  -5.943   2.196   3.903
  466   3HG2  ILE  62          3HG2      ILE  62  -7.612   2.470   3.409
  467   1HD1  ILE  62          1HD1      ILE  62  -8.100   3.429   6.183
  468   2HD1  ILE  62          2HD1      ILE  62  -9.815   3.412   5.774
  469   3HD1  ILE  62          3HD1      ILE  62  -8.604   3.505   4.495
  470    H    ARG  63           H        ARG  63  -5.116  -0.798   3.878
  471    HA   ARG  63           HA       ARG  63  -3.667  -1.357   6.342
  472   1HB   ARG  63          2HB       ARG  63  -5.127  -3.449   5.124
  473   2HB   ARG  63          1HB       ARG  63  -3.444  -3.735   4.687
  474   1HG   ARG  63          2HG       ARG  63  -4.452  -3.256   7.508
  475   2HG   ARG  63          1HG       ARG  63  -4.036  -4.833   6.834
  476   1HD   ARG  63          2HD       ARG  63  -1.779  -3.323   6.266
  477   2HD   ARG  63          1HD       ARG  63  -2.260  -2.740   7.871
  478    HE   ARG  63           HE       ARG  63  -2.551  -5.463   8.115
  479   1HH1  ARG  63          1HH2      ARG  63  -0.105  -3.247   8.417
  480   2HH1  ARG  63          2HH2      ARG  63   1.202  -4.372   8.252
  481   1HH2  ARG  63          1HH1      ARG  63  -0.834  -7.002   7.277
  482   2HH2  ARG  63          2HH1      ARG  63   0.789  -6.497   7.608
  483    H    HIS  64           H        HIS  64  -1.840  -0.191   5.750
  484    HA   HIS  64           HA       HIS  64  -0.933  -0.268   2.926
  485   1HB   HIS  64          2HB       HIS  64   0.351   1.305   5.146
  486   2HB   HIS  64          1HB       HIS  64   0.207   1.717   3.438
  487    HD1  HIS  64           1HD      HIS  64  -2.153   2.544   2.604
  488    HD2  HIS  64           2HD      HIS  64  -1.856   2.059   6.733
  489    HE1  HIS  64           1HE      HIS  64  -4.167   3.704   3.607
  490    H    TYR  65           H        TYR  65   0.269  -2.110   2.559
  491    HA   TYR  65           HA       TYR  65   2.170  -3.161   4.546
  492   1HB   TYR  65          2HB       TYR  65   1.934  -3.792   1.599
  493   2HB   TYR  65          1HB       TYR  65   2.547  -4.834   2.876
  494    HD1  TYR  65           1HD      TYR  65   0.379  -4.190   4.953
  495    HD2  TYR  65           2HD      TYR  65   0.160  -5.201   0.783
  496    HE1  TYR  65           1HE      TYR  65  -1.887  -5.129   5.299
  497    HE2  TYR  65           2HE      TYR  65  -2.105  -6.139   1.130
  498    HH   TYR  65           HH       TYR  65  -3.466  -7.037   2.935
  499    H    VAL  66           H        VAL  66   4.234  -2.341   4.723
  500    HA   VAL  66           HA       VAL  66   5.269  -0.744   2.409
  501    HB   VAL  66           HB       VAL  66   6.035  -0.609   5.342
  502   1HG1  VAL  66          1HG1      VAL  66   6.871   1.683   4.529
  503   2HG1  VAL  66          2HG1      VAL  66   6.670   1.052   2.894
  504   3HG1  VAL  66          3HG1      VAL  66   7.798   0.277   4.005
  505   1HG2  VAL  66          1HG2      VAL  66   4.638   1.719   4.396
  506   2HG2  VAL  66          2HG2      VAL  66   4.173   0.619   5.694
  507   3HG2  VAL  66          3HG2      VAL  66   3.657   0.298   4.040
  508    H    VAL  67           H        VAL  67   7.709  -0.789   2.238
  509    HA   VAL  67           HA       VAL  67   8.706  -3.546   2.843
  510    HB   VAL  67           HB       VAL  67   9.348  -1.582   0.624
  511   1HG1  VAL  67          1HG1      VAL  67  10.239  -4.287   0.171
  512   2HG1  VAL  67          2HG1      VAL  67  10.913  -3.691   1.687
  513   3HG1  VAL  67          3HG1      VAL  67  11.185  -2.799   0.190
  514   1HG2  VAL  67          1HG2      VAL  67   8.363  -3.627  -0.695
  515   2HG2  VAL  67          2HG2      VAL  67   7.256  -2.501   0.090
  516   3HG2  VAL  67          3HG2      VAL  67   7.631  -4.045   0.854
  517    H    CYS  68           H        CYS  68  10.389  -3.638   4.234
  518    HA   CYS  68           HA       CYS  68  11.807  -1.159   5.011
  519   1HB   CYS  68          2HB       CYS  68  10.896  -2.753   6.688
  520   2HB   CYS  68          1HB       CYS  68  11.916  -4.025   6.017
  521    HG   CYS  68           HG       CYS  68  12.963  -1.569   7.627
  522    H    SER  69           H        SER  69  14.049  -0.886   4.602
  523    HA   SER  69           HA       SER  69  15.288  -2.953   2.819
  524   1HB   SER  69          2HB       SER  69  16.477  -0.833   1.916
  525   2HB   SER  69          1HB       SER  69  14.779  -1.065   1.498
  526    HG   SER  69           HG       SER  69  15.810   1.006   2.653
  527    H    THR  70           H        THR  70  17.307  -3.643   3.360
  528    HA   THR  70           HA       THR  70  18.596  -2.460   5.782
  529    HB   THR  70           HB       THR  70  18.010  -4.881   5.722
  530    HG1  THR  70           1HG      THR  70  20.811  -4.657   5.501
  531   1HG2  THR  70          1HG2      THR  70  18.414  -6.174   3.931
  532   2HG2  THR  70          2HG2      THR  70  20.102  -5.677   3.870
  533   3HG2  THR  70          3HG2      THR  70  18.869  -4.705   3.069
  534    HA   PRO  71           HA       PRO  71  21.776  -0.638   3.369
  535   1HB   PRO  71          2HB       PRO  71  23.941  -1.496   5.057
  536   2HB   PRO  71          1HB       PRO  71  23.149   0.081   5.013
  537   1HG   PRO  71          2HG       PRO  71  22.953  -1.900   7.059
  538   2HG   PRO  71          1HG       PRO  71  22.094  -0.361   6.966
  539   1HD   PRO  71          2HD       PRO  71  21.040  -3.034   6.570
  540   2HD   PRO  71          1HD       PRO  71  20.151  -1.495   6.592
  541    H    GLN  72           H        GLN  72  21.492  -3.952   3.502
  542    HA   GLN  72           HA       GLN  72  24.021  -4.484   2.030
  543   1HB   GLN  72          2HB       GLN  72  23.303  -5.999   3.826
  544   2HB   GLN  72          1HB       GLN  72  21.748  -6.229   3.038
  545   1HG   GLN  72          2HG       GLN  72  23.359  -8.107   2.636
  546   2HG   GLN  72          1HG       GLN  72  22.802  -7.341   1.153
  547   1HE2  GLN  72          1HE2      GLN  72  25.608  -8.017   3.105
  548   2HE2  GLN  72          2HE2      GLN  72  26.739  -7.222   2.120
  549    H    SER  73           H        SER  73  21.637  -2.854   0.995
  550    HA   SER  73           HA       SER  73  20.537  -2.579  -1.078
  551   1HB   SER  73          2HB       SER  73  22.983  -3.739  -1.558
  552   2HB   SER  73          1HB       SER  73  21.895  -4.917  -2.286
  553    HG   SER  73           HG       SER  73  21.258  -3.461  -3.720
  554    H    GLN  74           H        GLN  74  19.179  -4.027   0.856
  555    HA   GLN  74           HA       GLN  74  17.781  -6.109  -0.779
  556   1HB   GLN  74          2HB       GLN  74  18.042  -6.527   2.144
  557   2HB   GLN  74          1HB       GLN  74  18.146  -7.700   0.838
  558   1HG   GLN  74          2HG       GLN  74  20.387  -6.552   0.254
  559   2HG   GLN  74          1HG       GLN  74  20.290  -5.839   1.862
  560   1HE2  GLN  74          1HE2      GLN  74  20.819  -8.837   0.090
  561   2HE2  GLN  74          2HE2      GLN  74  21.217  -9.786   1.439
  562    H    TYR  75           H        TYR  75  15.573  -6.622   0.229
  563    HA   TYR  75           HA       TYR  75  14.420  -4.359   1.811
  564   1HB   TYR  75          2HB       TYR  75  13.292  -5.341  -0.821
  565   2HB   TYR  75          1HB       TYR  75  12.728  -3.969   0.123
  566    HD1  TYR  75           1HD      TYR  75  15.570  -5.267  -1.872
  567    HD2  TYR  75           2HD      TYR  75  13.782  -1.836  -0.021
  568    HE1  TYR  75           1HE      TYR  75  17.189  -3.805  -3.035
  569    HE2  TYR  75           2HE      TYR  75  15.397  -0.368  -1.184
  570    HH   TYR  75           HH       TYR  75  17.300  -1.400  -3.766
  571    H    TYR  76           H        TYR  76  12.235  -4.868   2.641
  572    HA   TYR  76           HA       TYR  76  10.887  -7.370   2.306
  573   1HB   TYR  76          2HB       TYR  76  11.617  -8.481   4.418
  574   2HB   TYR  76          1HB       TYR  76  12.968  -8.265   3.313
  575    HD1  TYR  76           1HD      TYR  76  11.314  -6.912   6.337
  576    HD2  TYR  76           2HD      TYR  76  14.827  -6.825   3.878
  577    HE1  TYR  76           1HE      TYR  76  12.507  -5.662   8.102
  578    HE2  TYR  76           2HE      TYR  76  16.024  -5.570   5.641
  579    HH   TYR  76           HH       TYR  76  15.347  -4.016   7.573
  580    H    LEU  77           H        LEU  77   9.123  -7.636   3.878
  581    HA   LEU  77           HA       LEU  77   8.386  -5.074   5.253
  582   1HB   LEU  77          2HB       LEU  77   6.939  -6.501   3.539
  583   2HB   LEU  77          1HB       LEU  77   6.632  -7.518   4.947
  584    HG   LEU  77           HG       LEU  77   6.327  -4.612   5.420
  585   1HD1  LEU  77          1HD1      LEU  77   4.340  -4.295   4.191
  586   2HD1  LEU  77          2HD1      LEU  77   4.135  -6.023   3.902
  587   3HD1  LEU  77          3HD1      LEU  77   5.391  -5.127   3.046
  588   1HD2  LEU  77          1HD2      LEU  77   4.085  -5.701   6.333
  589   2HD2  LEU  77          2HD2      LEU  77   5.602  -5.902   7.210
  590   3HD2  LEU  77          3HD2      LEU  77   5.006  -7.196   6.171
  591    H    ALA  78           H        ALA  78   9.808  -8.027   5.688
  592    HA   ALA  78           HA       ALA  78   9.790  -7.877   8.616
  593   1HB   ALA  78          1HB       ALA  78   9.178 -10.577   7.559
  594   2HB   ALA  78          2HB       ALA  78   7.870  -9.413   7.347
  595   3HB   ALA  78          3HB       ALA  78   8.498  -9.751   8.960
  596    H    GLU  79           H        GLU  79  11.976  -8.136   9.023
  597    HA   GLU  79           HA       GLU  79  13.973  -8.691   7.174
  598   1HB   GLU  79          2HB       GLU  79  13.662  -8.916  10.136
  599   2HB   GLU  79          1HB       GLU  79  15.121  -9.605   9.424
  600   1HG   GLU  79          2HG       GLU  79  15.417  -7.397   8.196
  601   2HG   GLU  79          1HG       GLU  79  14.143  -6.751   9.233
  602    H    LYS  80           H        LYS  80  11.790 -10.964   8.571
  603    HA   LYS  80           HA       LYS  80  13.062 -13.423   8.640
  604   1HB   LYS  80          2HB       LYS  80  10.406 -12.354   7.985
  605   2HB   LYS  80          1HB       LYS  80  10.713 -13.929   7.252
  606   1HG   LYS  80          2HG       LYS  80  11.031 -14.979   9.326
  607   2HG   LYS  80          1HG       LYS  80  11.376 -13.457  10.150
  608   1HD   LYS  80          2HD       LYS  80   9.090 -12.793  10.102
  609   2HD   LYS  80          1HD       LYS  80   8.673 -14.045   8.932
  610   1HE   LYS  80          2HE       LYS  80   9.153 -15.793  10.615
  611   2HE   LYS  80          1HE       LYS  80   9.573 -14.535  11.796
  612   1HZ   LYS  80          1HZ       LYS  80   7.401 -13.616  11.641
  613   2HZ   LYS  80          2HZ       LYS  80   7.207 -15.284  11.897
  614   3HZ   LYS  80          3HZ       LYS  80   6.984 -14.629  10.346
  615    H    HIS  81           H        HIS  81  12.078 -11.630   5.723
  616    HA   HIS  81           HA       HIS  81  14.023 -13.184   4.111
  617   1HB   HIS  81          2HB       HIS  81  11.027 -13.090   3.613
  618   2HB   HIS  81          1HB       HIS  81  12.204 -13.723   2.461
  619    HD1  HIS  81           1HD      HIS  81  10.183 -14.702   5.339
  620    HD2  HIS  81           2HD      HIS  81  13.729 -16.023   3.589
  621    HE1  HIS  81           1HE      HIS  81  10.610 -17.025   6.252
  622    H    LEU  82           H        LEU  82  14.840 -11.843   2.446
  623    HA   LEU  82           HA       LEU  82  13.289  -9.416   1.763
  624   1HB   LEU  82          2HB       LEU  82  15.168  -7.981   2.393
  625   2HB   LEU  82          1HB       LEU  82  14.698  -8.968   3.773
  626    HG   LEU  82           HG       LEU  82  16.889  -9.779   1.875
  627   1HD1  LEU  82          1HD1      LEU  82  16.987  -7.508   3.424
  628   2HD1  LEU  82          2HD1      LEU  82  18.397  -8.446   2.938
  629   3HD1  LEU  82          3HD1      LEU  82  17.662  -8.718   4.515
  630   1HD2  LEU  82          1HD2      LEU  82  17.423 -10.737   4.424
  631   2HD2  LEU  82          2HD2      LEU  82  16.672 -11.666   3.128
  632   3HD2  LEU  82          3HD2      LEU  82  15.666 -10.849   4.324
  633    H    PHE  83           H        PHE  83  13.641  -8.732  -0.326
  634    HA   PHE  83           HA       PHE  83  15.606 -10.294  -1.950
  635   1HB   PHE  83          2HB       PHE  83  12.889  -9.114  -2.333
  636   2HB   PHE  83          1HB       PHE  83  13.949  -9.162  -3.746
  637    HD1  PHE  83           1HD      PHE  83  13.273 -11.439  -0.833
  638    HD2  PHE  83           2HD      PHE  83  13.584 -11.016  -5.095
  639    HE1  PHE  83           1HE      PHE  83  12.813 -13.861  -1.106
  640    HE2  PHE  83           2HE      PHE  83  13.122 -13.438  -5.371
  641    HZ   PHE  83           HZ       PHE  83  12.738 -14.861  -3.376
  642    H    SER  84           H        SER  84  15.611  -8.466  -4.168
  643    HA   SER  84           HA       SER  84  17.277  -6.290  -2.975
  644   1HB   SER  84          2HB       SER  84  17.093  -7.439  -5.779
  645   2HB   SER  84          1HB       SER  84  18.268  -6.240  -5.244
  646    HG   SER  84           HG       SER  84  19.391  -7.802  -4.417
  647    H    THR  85           H        THR  85  14.129  -6.533  -3.842
  648    HA   THR  85           HA       THR  85  13.871  -3.669  -4.368
  649    HB   THR  85           HB       THR  85  12.892  -5.495  -6.566
  650    HG1  THR  85           1HG      THR  85  15.414  -4.209  -6.454
  651   1HG2  THR  85          1HG2      THR  85  12.775  -2.714  -5.989
  652   2HG2  THR  85          2HG2      THR  85  12.186  -3.550  -7.427
  653   3HG2  THR  85          3HG2      THR  85  13.831  -2.916  -7.387
  654    H    ILE  86           H        ILE  86  11.525  -3.039  -4.476
  655    HA   ILE  86           HA       ILE  86   9.899  -4.632  -2.701
  656    HB   ILE  86           HB       ILE  86   9.579  -2.166  -4.381
  657   1HG1  ILE  86          2HG1      ILE  86   8.822  -1.626  -1.802
  658   2HG1  ILE  86          1HG1      ILE  86  10.003  -2.913  -1.568
  659   1HG2  ILE  86          1HG2      ILE  86   7.365  -3.527  -2.812
  660   2HG2  ILE  86          2HG2      ILE  86   7.400  -3.298  -4.560
  661   3HG2  ILE  86          3HG2      ILE  86   7.273  -1.903  -3.491
  662   1HD1  ILE  86          1HD1      ILE  86  11.288  -1.399  -3.426
  663   2HD1  ILE  86          2HD1      ILE  86  11.511  -1.212  -1.687
  664   3HD1  ILE  86          3HD1      ILE  86  10.398  -0.153  -2.552
  665    HA   PRO  87           HA       PRO  87   7.225  -5.548  -6.688
  666   1HB   PRO  87          2HB       PRO  87   9.056  -5.445  -8.908
  667   2HB   PRO  87          1HB       PRO  87   7.597  -4.483  -8.655
  668   1HG   PRO  87          2HG       PRO  87  10.352  -3.645  -8.431
  669   2HG   PRO  87          1HG       PRO  87   8.892  -2.664  -8.290
  670   1HD   PRO  87          2HD       PRO  87  10.668  -3.392  -6.191
  671   2HD   PRO  87          1HD       PRO  87   9.092  -2.584  -6.024
  672    H    GLU  88           H        GLU  88  10.725  -6.256  -6.831
  673    HA   GLU  88           HA       GLU  88  10.543  -8.945  -7.786
  674   1HB   GLU  88          2HB       GLU  88  12.581  -7.473  -7.606
  675   2HB   GLU  88          1HB       GLU  88  12.548  -7.721  -5.860
  676   1HG   GLU  88          2HG       GLU  88  14.010  -9.408  -6.490
  677   2HG   GLU  88          1HG       GLU  88  12.476 -10.277  -6.551
  678    H    LEU  89           H        LEU  89  10.523  -7.588  -4.493
  679    HA   LEU  89           HA       LEU  89  10.439 -10.058  -3.043
  680   1HB   LEU  89          2HB       LEU  89  10.579  -7.360  -2.515
  681   2HB   LEU  89          1HB       LEU  89   8.946  -7.741  -1.968
  682    HG   LEU  89           HG       LEU  89  11.210  -9.542  -1.173
  683   1HD1  LEU  89          1HD1      LEU  89  10.457  -6.971   0.257
  684   2HD1  LEU  89          2HD1      LEU  89  11.944  -7.211  -0.662
  685   3HD1  LEU  89          3HD1      LEU  89  11.642  -8.160   0.793
  686   1HD2  LEU  89          1HD2      LEU  89   8.825  -8.624   0.436
  687   2HD2  LEU  89          2HD2      LEU  89   9.764 -10.106   0.615
  688   3HD2  LEU  89          3HD2      LEU  89   8.675  -9.911  -0.760
  689    H    ILE  90           H        ILE  90   7.742  -7.805  -3.786
  690    HA   ILE  90           HA       ILE  90   5.626  -9.502  -2.951
  691    HB   ILE  90           HB       ILE  90   5.718  -7.423  -5.166
  692   1HG1  ILE  90          2HG1      ILE  90   6.564  -6.493  -3.075
  693   2HG1  ILE  90          1HG1      ILE  90   4.932  -5.885  -3.346
  694   1HG2  ILE  90          1HG2      ILE  90   3.272  -7.145  -4.293
  695   2HG2  ILE  90          2HG2      ILE  90   3.491  -8.776  -3.661
  696   3HG2  ILE  90          3HG2      ILE  90   3.634  -8.475  -5.392
  697   1HD1  ILE  90          1HD1      ILE  90   4.151  -7.888  -1.913
  698   2HD1  ILE  90          2HD1      ILE  90   4.929  -6.546  -1.075
  699   3HD1  ILE  90          3HD1      ILE  90   5.837  -8.018  -1.414
  700    H    ASN  91           H        ASN  91   7.403  -9.346  -6.006
  701    HA   ASN  91           HA       ASN  91   5.655 -10.974  -7.588
  702   1HB   ASN  91          2HB       ASN  91   7.503  -9.504  -8.392
  703   2HB   ASN  91          1HB       ASN  91   8.670 -10.634  -7.704
  704   1HD2  ASN  91          1HD2      ASN  91   9.579 -11.519  -9.614
  705   2HD2  ASN  91          2HD2      ASN  91   8.673 -12.325 -10.801
  706    H    TYR  92           H        TYR  92   8.843 -11.989  -6.272
  707    HA   TYR  92           HA       TYR  92   8.489 -14.758  -6.631
  708   1HB   TYR  92          2HB       TYR  92  10.504 -14.867  -5.522
  709   2HB   TYR  92          1HB       TYR  92  10.458 -13.128  -5.778
  710    HD1  TYR  92           1HD      TYR  92  10.219 -11.603  -3.940
  711    HD2  TYR  92           2HD      TYR  92   9.798 -15.826  -3.317
  712    HE1  TYR  92           1HE      TYR  92  10.278 -11.250  -1.485
  713    HE2  TYR  92           2HE      TYR  92   9.854 -15.476  -0.865
  714    HH   TYR  92           HH       TYR  92   9.452 -12.469   0.567
  715    H    HIS  93           H        HIS  93   7.117 -12.674  -4.186
  716    HA   HIS  93           HA       HIS  93   6.394 -14.846  -2.354
  717   1HB   HIS  93          2HB       HIS  93   6.822 -12.210  -2.077
  718   2HB   HIS  93          1HB       HIS  93   5.075 -12.167  -2.321
  719    HD1  HIS  93           1HD      HIS  93   4.227 -11.827   0.031
  720    HD2  HIS  93           2HD      HIS  93   7.016 -14.917  -0.204
  721    HE1  HIS  93           1HE      HIS  93   4.251 -12.945   2.304
  722    H    GLN  94           H        GLN  94   4.731 -12.852  -4.797
  723    HA   GLN  94           HA       GLN  94   2.088 -13.883  -4.325
  724   1HB   GLN  94          2HB       GLN  94   3.500 -12.561  -6.653
  725   2HB   GLN  94          1HB       GLN  94   1.778 -12.947  -6.693
  726   1HG   GLN  94          2HG       GLN  94   2.720 -11.530  -4.263
  727   2HG   GLN  94          1HG       GLN  94   2.750 -10.592  -5.756
  728   1HE2  GLN  94          1HE2      GLN  94   0.794  -9.611  -6.294
  729   2HE2  GLN  94          2HE2      GLN  94  -0.730 -10.103  -5.731
  730    H    HIS  95           H        HIS  95   4.427 -14.664  -6.948
  731    HA   HIS  95           HA       HIS  95   2.869 -17.135  -7.520
  732   1HB   HIS  95          2HB       HIS  95   3.991 -17.071  -9.631
  733   2HB   HIS  95          1HB       HIS  95   3.615 -15.393  -9.250
  734    HD1  HIS  95           1HD      HIS  95   5.590 -13.821  -8.675
  735    HD2  HIS  95           2HD      HIS  95   6.768 -17.738  -9.480
  736    HE1  HIS  95           1HE      HIS  95   8.111 -13.775  -8.920
  737    H    ASN  96           H        ASN  96   4.633 -16.846  -5.106
  738    HA   ASN  96           HA       ASN  96   7.131 -18.145  -5.355
  739   1HB   ASN  96          2HB       ASN  96   5.919 -17.021  -3.358
  740   2HB   ASN  96          1HB       ASN  96   5.187 -18.603  -3.090
  741   1HD2  ASN  96          1HD2      ASN  96   6.636 -20.402  -2.508
  742   2HD2  ASN  96          2HD2      ASN  96   8.199 -20.101  -1.921
  743    H    SER  97           H        SER  97   3.880 -19.471  -5.471
  744    HA   SER  97           HA       SER  97   5.009 -22.117  -6.213
  745   1HB   SER  97          2HB       SER  97   3.573 -21.394  -3.720
  746   2HB   SER  97          1HB       SER  97   3.038 -22.879  -4.500
  747    HG   SER  97           HG       SER  97   5.269 -23.513  -4.529
  748    H    ALA  98           H        ALA  98   4.086 -21.794  -8.309
  749    HA   ALA  98           HA       ALA  98   2.376 -21.811  -9.941
  750   1HB   ALA  98          1HB       ALA  98   0.565 -23.306  -9.379
  751   2HB   ALA  98          2HB       ALA  98   0.786 -23.011  -7.656
  752   3HB   ALA  98          3HB       ALA  98   2.005 -23.909  -8.560
  753    H    GLY  99           H        GLY  99   2.003 -19.539 -10.117
  754   1HA   GLY  99          2HA       GLY  99  -0.287 -18.510  -8.487
  755   2HA   GLY  99          1HA       GLY  99   1.024 -17.481  -9.063
  756    H    LEU 100           H        LEU 100  -2.095 -18.482  -9.732
  757    HA   LEU 100           HA       LEU 100  -1.882 -17.417 -12.516
  758   1HB   LEU 100          2HB       LEU 100  -2.244 -20.129 -11.746
  759   2HB   LEU 100          1HB       LEU 100  -3.802 -19.568 -12.355
  760    HG   LEU 100           HG       LEU 100  -1.194 -19.127 -13.830
  761   1HD1  LEU 100          1HD1      LEU 100  -1.407 -21.474 -13.851
  762   2HD1  LEU 100          2HD1      LEU 100  -2.224 -20.981 -15.334
  763   3HD1  LEU 100          3HD1      LEU 100  -3.168 -21.404 -13.906
  764   1HD2  LEU 100          1HD2      LEU 100  -2.741 -17.612 -14.698
  765   2HD2  LEU 100          2HD2      LEU 100  -4.113 -18.671 -14.373
  766   3HD2  LEU 100          3HD2      LEU 100  -3.032 -19.018 -15.722
  767    H    ILE 101           H        ILE 101  -2.861 -16.151 -10.081
  768    HA   ILE 101           HA       ILE 101  -5.758 -15.864 -10.808
  769    HB   ILE 101           HB       ILE 101  -6.144 -15.554  -8.360
  770   1HG1  ILE 101          2HG1      ILE 101  -3.348 -16.589  -7.916
  771   2HG1  ILE 101          1HG1      ILE 101  -3.641 -14.856  -8.055
  772   1HG2  ILE 101          1HG2      ILE 101  -6.168 -17.825  -9.602
  773   2HG2  ILE 101          2HG2      ILE 101  -6.095 -17.860  -7.840
  774   3HG2  ILE 101          3HG2      ILE 101  -4.633 -18.131  -8.789
  775   1HD1  ILE 101          1HD1      ILE 101  -4.601 -16.773  -5.953
  776   2HD1  ILE 101          2HD1      ILE 101  -5.547 -15.326  -6.304
  777   3HD1  ILE 101          3HD1      ILE 101  -3.876 -15.177  -5.757
  778    H    SER 102           H        SER 102  -6.493 -13.706  -9.438
  779    HA   SER 102           HA       SER 102  -5.139 -11.501 -10.720
  780   1HB   SER 102          2HB       SER 102  -6.789 -10.187  -9.434
  781   2HB   SER 102          1HB       SER 102  -7.550 -11.600 -10.157
  782    HG   SER 102           HG       SER 102  -7.835 -12.434  -8.231
  783    H    ARG 103           H        ARG 103  -3.006 -11.191 -10.034
  784    HA   ARG 103           HA       ARG 103  -2.032 -11.529  -7.366
  785   1HB   ARG 103          2HB       ARG 103  -1.106  -9.796  -9.682
  786   2HB   ARG 103          1HB       ARG 103  -0.127 -10.170  -8.263
  787   1HG   ARG 103          2HG       ARG 103  -0.855 -12.672  -8.949
  788   2HG   ARG 103          1HG       ARG 103  -0.901 -11.919 -10.543
  789   1HD   ARG 103          2HD       ARG 103   1.479 -11.171  -8.975
  790   2HD   ARG 103          1HD       ARG 103   1.388 -12.901  -9.362
  791    HE   ARG 103           HE       ARG 103   0.864 -10.932 -11.534
  792   1HH1  ARG 103          1HH1      ARG 103   3.626 -12.059 -10.153
  793   2HH1  ARG 103          2HH1      ARG 103   4.199 -12.948 -11.524
  794   1HH2  ARG 103          1HH2      ARG 103   1.228 -12.660 -13.288
  795   2HH2  ARG 103          2HH2      ARG 103   2.842 -13.289 -13.299
  796    H    LEU 104           H        LEU 104  -2.619  -8.437  -9.097
  797    HA   LEU 104           HA       LEU 104  -2.683  -6.951  -6.563
  798   1HB   LEU 104          2HB       LEU 104  -1.706  -6.177  -8.770
  799   2HB   LEU 104          1HB       LEU 104  -3.355  -6.067  -9.385
  800    HG   LEU 104           HG       LEU 104  -2.789  -4.724  -6.787
  801   1HD1  LEU 104          1HD1      LEU 104  -1.632  -3.913  -9.440
  802   2HD1  LEU 104          2HD1      LEU 104  -0.890  -3.854  -7.842
  803   3HD1  LEU 104          3HD1      LEU 104  -2.124  -2.675  -8.285
  804   1HD2  LEU 104          1HD2      LEU 104  -4.189  -2.996  -8.347
  805   2HD2  LEU 104          2HD2      LEU 104  -4.952  -4.263  -7.386
  806   3HD2  LEU 104          3HD2      LEU 104  -4.639  -4.525  -9.101
  807    H    LYS 105           H        LYS 105  -4.575  -5.860  -5.750
  808    HA   LYS 105           HA       LYS 105  -7.090  -7.271  -6.287
  809   1HB   LYS 105          2HB       LYS 105  -6.301  -4.988  -4.454
  810   2HB   LYS 105          1HB       LYS 105  -7.863  -5.808  -4.413
  811   1HG   LYS 105          2HG       LYS 105  -6.733  -7.950  -3.955
  812   2HG   LYS 105          1HG       LYS 105  -5.170  -7.136  -3.994
  813   1HD   LYS 105          2HD       LYS 105  -5.413  -6.342  -1.891
  814   2HD   LYS 105          1HD       LYS 105  -7.070  -5.820  -2.196
  815   1HE   LYS 105          2HE       LYS 105  -7.309  -7.521  -0.553
  816   2HE   LYS 105          1HE       LYS 105  -7.643  -8.373  -2.074
  817   1HZ   LYS 105          1HZ       LYS 105  -5.971  -9.521  -0.689
  818   2HZ   LYS 105          2HZ       LYS 105  -4.959  -8.162  -0.813
  819   3HZ   LYS 105          3HZ       LYS 105  -5.359  -9.056  -2.200
  820    H    TYR 106           H        TYR 106  -7.311  -3.795  -5.680
  821    HA   TYR 106           HA       TYR 106  -8.339  -3.492  -8.485
  822   1HB   TYR 106          2HB       TYR 106 -10.159  -3.521  -6.877
  823   2HB   TYR 106          1HB       TYR 106  -9.336  -2.334  -5.867
  824    HD1  TYR 106           1HD      TYR 106  -9.888  -0.088  -6.122
  825    HD2  TYR 106           2HD      TYR 106 -10.467  -2.773  -9.417
  826    HE1  TYR 106           1HE      TYR 106 -10.833   1.768  -7.465
  827    HE2  TYR 106           2HE      TYR 106 -11.419  -0.921 -10.760
  828    HH   TYR 106           HH       TYR 106 -11.020   2.205 -10.126
  829    HA   PRO 107           HA       PRO 107  -5.153  -0.340  -8.666
  830   1HB   PRO 107          2HB       PRO 107  -6.329   0.646 -11.093
  831   2HB   PRO 107          1HB       PRO 107  -4.888  -0.358 -10.908
  832   1HG   PRO 107          2HG       PRO 107  -7.415  -1.141 -11.969
  833   2HG   PRO 107          1HG       PRO 107  -6.005  -2.165 -11.687
  834   1HD   PRO 107          2HD       PRO 107  -8.503  -2.083 -10.202
  835   2HD   PRO 107          1HD       PRO 107  -7.140  -3.212 -10.015
  836    H    VAL 108           H        VAL 108  -5.309   1.481  -7.479
  837    HA   VAL 108           HA       VAL 108  -7.520   3.420  -8.000
  838    HB   VAL 108           HB       VAL 108  -6.496   2.364  -5.338
  839   1HG1  VAL 108          1HG1      VAL 108  -8.247   3.917  -4.376
  840   2HG1  VAL 108          2HG1      VAL 108  -8.373   4.657  -5.971
  841   3HG1  VAL 108          3HG1      VAL 108  -6.853   4.737  -5.080
  842   1HG2  VAL 108          1HG2      VAL 108  -8.214   1.036  -6.672
  843   2HG2  VAL 108          2HG2      VAL 108  -9.313   2.396  -6.437
  844   3HG2  VAL 108          3HG2      VAL 108  -8.706   1.499  -5.045
  845    H    SER 109           H        SER 109  -6.755   5.599  -7.946
  846    HA   SER 109           HA       SER 109  -3.811   5.908  -7.535
  847   1HB   SER 109          2HB       SER 109  -5.926   7.299  -9.171
  848   2HB   SER 109          1HB       SER 109  -4.390   8.096  -8.834
  849    HG   SER 109           HG       SER 109  -3.374   6.191  -9.701
  850    H    GLN 110           H        GLN 110  -6.407   8.329  -7.408
  851    HA   GLN 110           HA       GLN 110  -5.815   8.828  -4.555
  852   1HB   GLN 110          2HB       GLN 110  -5.785  10.992  -6.672
  853   2HB   GLN 110          1HB       GLN 110  -5.223  11.115  -5.004
  854   1HG   GLN 110          2HG       GLN 110  -3.533   9.277  -5.606
  855   2HG   GLN 110          1HG       GLN 110  -3.959   9.592  -7.288
  856   1HE2  GLN 110          1HE2      GLN 110  -2.506  11.072  -4.388
  857   2HE2  GLN 110          2HE2      GLN 110  -1.754  12.351  -5.213
  858    H    GLN 111           H        GLN 111  -7.291  11.538  -5.301
  859    HA   GLN 111           HA       GLN 111  -9.912  10.671  -4.484
  860   1HB   GLN 111          2HB       GLN 111 -10.435  13.085  -4.850
  861   2HB   GLN 111          1HB       GLN 111  -8.953  12.855  -3.918
  862   1HG   GLN 111          2HG       GLN 111  -7.600  13.602  -5.625
  863   2HG   GLN 111          1HG       GLN 111  -8.681  13.008  -6.886
  864   1HE2  GLN 111          1HE2      GLN 111 -10.799  14.287  -7.130
  865   2HE2  GLN 111          2HE2      GLN 111 -10.750  15.957  -6.830
  866    H    ASN 112           H        ASN 112  -9.690   9.080  -6.590
  867    HA   ASN 112           HA       ASN 112 -10.999  10.423  -8.893
  868   1HB   ASN 112          2HB       ASN 112  -8.793   9.198  -9.144
  869   2HB   ASN 112          1HB       ASN 112  -9.656   7.714  -8.737
  870   1HD2  ASN 112          1HD2      ASN 112  -8.731   9.669 -11.350
  871   2HD2  ASN 112          2HD2      ASN 112  -9.822   9.073 -12.504
  872    H    LYS 113           H        LYS 113 -11.115   7.539  -6.816
  873    HA   LYS 113           HA       LYS 113 -12.893   6.077  -6.292
  874   1HB   LYS 113          2HB       LYS 113 -14.667   8.415  -7.008
  875   2HB   LYS 113          1HB       LYS 113 -14.877   7.240  -5.713
  876   1HG   LYS 113          2HG       LYS 113 -12.711   9.366  -5.843
  877   2HG   LYS 113          1HG       LYS 113 -14.131   9.401  -4.800
  878   1HD   LYS 113          2HD       LYS 113 -13.270   7.864  -3.346
  879   2HD   LYS 113          1HD       LYS 113 -12.473   6.948  -4.620
  880   1HE   LYS 113          2HE       LYS 113 -10.744   7.989  -3.254
  881   2HE   LYS 113          1HE       LYS 113 -10.790   8.850  -4.804
  882   1HZ   LYS 113          1HZ       LYS 113 -10.864  10.320  -2.797
  883   2HZ   LYS 113          2HZ       LYS 113 -12.387   9.661  -2.438
  884   3HZ   LYS 113          3HZ       LYS 113 -12.155  10.534  -3.876
  885    H    ASN 114           H        ASN 114 -15.199   5.372  -7.244
  886    HA   ASN 114           HA       ASN 114 -14.815   5.065 -10.196
  887   1HB   ASN 114          2HB       ASN 114 -16.104   2.980  -9.845
  888   2HB   ASN 114          1HB       ASN 114 -14.715   3.046  -8.761
  889   1HD2  ASN 114          1HD2      ASN 114 -17.879   2.166  -8.721
  890   2HD2  ASN 114          2HD2      ASN 114 -18.278   2.545  -7.116
  891    H    ALA 115           H        ALA 115 -17.625   4.009 -10.362
  892    HA   ALA 115           HA       ALA 115 -19.780   4.840 -10.847
  893   1HB   ALA 115          1HB       ALA 115 -19.554   7.162  -9.069
  894   2HB   ALA 115          2HB       ALA 115 -19.023   5.666  -8.301
  895   3HB   ALA 115          3HB       ALA 115 -20.650   5.784  -8.972
  896    HA   PRO 116           HA       PRO 116 -19.500   8.078 -13.796
  897   1HB   PRO 116          2HB       PRO 116 -21.757   9.619 -12.894
  898   2HB   PRO 116          1HB       PRO 116 -21.691   8.462 -14.228
  899   1HG   PRO 116          2HG       PRO 116 -22.985   8.144 -11.685
  900   2HG   PRO 116          1HG       PRO 116 -22.916   6.991 -13.021
  901   1HD   PRO 116          2HD       PRO 116 -21.554   6.838 -10.484
  902   2HD   PRO 116          1HD       PRO 116 -21.473   5.684 -11.837
  903    H    SER 117           H        SER 117 -17.592   9.160 -13.058
  904    HA   SER 117           HA       SER 117 -16.330  10.943 -12.158
  905   1HB   SER 117          2HB       SER 117 -18.359  11.935 -13.566
  906   2HB   SER 117          1HB       SER 117 -18.875  12.515 -11.985
  907    HG   SER 117           HG       SER 117 -17.306  13.914 -12.018
  908    H    THR 118           H        THR 118 -16.422  12.634 -10.231
  909    HA   THR 118           HA       THR 118 -18.098  11.782  -7.955
  910    HB   THR 118           HB       THR 118 -15.076  11.547  -7.848
  911    HG1  THR 118           1HG      THR 118 -17.062   9.567  -8.263
  912   1HG2  THR 118          1HG2      THR 118 -15.348  10.947  -5.676
  913   2HG2  THR 118          2HG2      THR 118 -16.790   9.994  -6.026
  914   3HG2  THR 118          3HG2      THR 118 -16.917  11.740  -5.818
  Start of MODEL   18
    1    H    THR   1           1H       THR   1  23.032  -4.619  -8.527
    2    HA   THR   1           HA       THR   1  21.039  -5.287  -6.418
    3    HB   THR   1           HB       THR   1  21.355  -2.757  -8.037
    4    HG1  THR   1           1HG      THR   1  22.731  -1.997  -6.553
    5   1HG2  THR   1          1HG2      THR   1  19.299  -3.521  -6.540
    6   2HG2  THR   1          2HG2      THR   1  19.848  -1.846  -6.538
    7   3HG2  THR   1          3HG2      THR   1  20.328  -2.933  -5.235
    8    H    GLU   2           H        GLU   2  18.901  -5.520  -7.236
    9    HA   GLU   2           HA       GLU   2  18.710  -6.426 -10.021
   10   1HB   GLU   2          2HB       GLU   2  17.481  -6.966  -7.578
   11   2HB   GLU   2          1HB       GLU   2  16.231  -6.117  -8.488
   12   1HG   GLU   2          2HG       GLU   2  16.038  -7.784 -10.047
   13   2HG   GLU   2          1HG       GLU   2  17.753  -8.192  -9.974
   14    H    ALA   3           H        ALA   3  16.840  -4.032  -8.106
   15    HA   ALA   3           HA       ALA   3  15.839  -1.994  -8.755
   16   1HB   ALA   3          1HB       ALA   3  17.311  -0.674  -9.915
   17   2HB   ALA   3          2HB       ALA   3  17.432  -1.825 -11.247
   18   3HB   ALA   3          3HB       ALA   3  18.388  -2.065  -9.784
   19    H    GLU   4           H        GLU   4  13.867  -2.925  -9.213
   20    HA   GLU   4           HA       GLU   4  12.981  -4.409 -11.369
   21   1HB   GLU   4          2HB       GLU   4  10.808  -3.117 -10.925
   22   2HB   GLU   4          1HB       GLU   4  11.560  -3.892  -9.533
   23   1HG   GLU   4          2HG       GLU   4  11.622  -1.894  -8.496
   24   2HG   GLU   4          1HG       GLU   4  12.731  -1.315  -9.734
   25    H    ASP   5           H        ASP   5  13.626  -0.913 -11.323
   26    HA   ASP   5           HA       ASP   5  13.627   0.680 -13.068
   27   1HB   ASP   5          2HB       ASP   5  14.933  -1.765 -13.818
   28   2HB   ASP   5          1HB       ASP   5  14.193  -1.047 -15.247
   29    H    SER   6           H        SER   6  11.019  -0.095 -12.503
   30    HA   SER   6           HA       SER   6   9.793  -0.430 -15.224
   31   1HB   SER   6          2HB       SER   6   9.166  -1.490 -12.490
   32   2HB   SER   6          1HB       SER   6   7.838  -1.241 -13.621
   33    HG   SER   6           HG       SER   6   8.785  -2.651 -15.029
   34    H    ILE   7           H        ILE   7   7.626   0.669 -15.407
   35    HA   ILE   7           HA       ILE   7   7.563   3.204 -13.798
   36    HB   ILE   7           HB       ILE   7   6.728   2.626 -16.662
   37   1HG1  ILE   7          2HG1      ILE   7   9.175   2.607 -16.337
   38   2HG1  ILE   7          1HG1      ILE   7   8.679   4.035 -17.245
   39   1HG2  ILE   7          1HG2      ILE   7   6.754   5.243 -16.646
   40   2HG2  ILE   7          2HG2      ILE   7   6.566   5.062 -14.903
   41   3HG2  ILE   7          3HG2      ILE   7   5.350   4.399 -15.995
   42   1HD1  ILE   7          1HD1      ILE   7   8.662   5.312 -15.065
   43   2HD1  ILE   7          2HD1      ILE   7  10.259   4.755 -15.564
   44   3HD1  ILE   7          3HD1      ILE   7   9.381   3.894 -14.300
   45    H    GLU   8           H        GLU   8   5.302   1.444 -15.952
   46    HA   GLU   8           HA       GLU   8   3.014   0.923 -15.666
   47   1HB   GLU   8          2HB       GLU   8   4.068   0.634 -12.832
   48   2HB   GLU   8          1HB       GLU   8   2.557  -0.055 -13.426
   49   1HG   GLU   8          2HG       GLU   8   3.829  -1.341 -15.124
   50   2HG   GLU   8          1HG       GLU   8   5.332  -0.688 -14.473
   51    H    MET   9           H        MET   9   2.013   2.945 -16.079
   52    HA   MET   9           HA       MET   9   1.620   4.773 -13.776
   53   1HB   MET   9          2HB       MET   9   1.235   5.108 -16.764
   54   2HB   MET   9          1HB       MET   9   1.020   6.388 -15.571
   55   1HG   MET   9          2HG       MET   9   3.246   6.751 -15.410
   56   2HG   MET   9          1HG       MET   9   3.593   5.027 -15.276
   57   1HE   MET   9          1HE       MET   9   3.659   3.411 -17.095
   58   2HE   MET   9          2HE       MET   9   3.753   3.732 -18.825
   59   3HE   MET   9          3HE       MET   9   2.210   3.889 -17.991
   60    H    TYR  10           H        TYR  10   0.116   2.196 -14.297
   61    HA   TYR  10           HA       TYR  10  -2.466   2.591 -15.348
   62   1HB   TYR  10          2HB       TYR  10  -1.204   0.857 -13.254
   63   2HB   TYR  10          1HB       TYR  10  -2.959   0.816 -13.429
   64    HD1  TYR  10           1HD      TYR  10  -3.658   0.904 -16.104
   65    HD2  TYR  10           2HD      TYR  10  -0.088  -0.806 -14.434
   66    HE1  TYR  10           1HE      TYR  10  -3.428  -0.559 -18.093
   67    HE2  TYR  10           2HE      TYR  10   0.141  -2.268 -16.424
   68    HH   TYR  10           HH       TYR  10  -1.917  -3.163 -18.292
   69    H    GLU  11           H        GLU  11  -2.551   2.080 -11.880
   70    HA   GLU  11           HA       GLU  11  -3.548   4.835 -11.381
   71   1HB   GLU  11          2HB       GLU  11  -5.293   2.939 -12.195
   72   2HB   GLU  11          1HB       GLU  11  -5.279   2.597 -10.470
   73   1HG   GLU  11          2HG       GLU  11  -6.845   4.234 -10.355
   74   2HG   GLU  11          1HG       GLU  11  -5.461   5.318 -10.459
   75    H    TRP  12           H        TRP  12  -3.117   1.560  -9.989
   76    HA   TRP  12           HA       TRP  12  -3.138   2.247  -7.261
   77   1HB   TRP  12          2HB       TRP  12  -1.803   0.154  -7.023
   78   2HB   TRP  12          1HB       TRP  12  -3.164  -0.036  -8.128
   79    HD1  TRP  12           HD       TRP  12  -2.653  -0.556 -10.621
   80    HE1  TRP  12           1HE      TRP  12  -0.490  -1.041 -11.938
   81    HE3  TRP  12           3HE      TRP  12   0.821   0.789  -7.131
   82    HZ2  TRP  12           2HZ      TRP  12   2.342  -0.879 -11.558
   83    HZ3  TRP  12           3HZ      TRP  12   3.241   0.615  -7.632
   84    HH2  TRP  12           HH       TRP  12   4.006  -0.217  -9.839
   85    H    TYR  13           H        TYR  13  -0.718   3.004  -9.640
   86    HA   TYR  13           HA       TYR  13   1.465   3.323  -7.700
   87   1HB   TYR  13          2HB       TYR  13   1.618   2.670 -10.163
   88   2HB   TYR  13          1HB       TYR  13   1.238   4.350 -10.542
   89    HD1  TYR  13           1HD      TYR  13   3.422   2.643  -8.006
   90    HD2  TYR  13           2HD      TYR  13   3.125   5.571 -11.134
   91    HE1  TYR  13           1HE      TYR  13   5.794   3.263  -7.648
   92    HE2  TYR  13           2HE      TYR  13   5.498   6.192 -10.777
   93    HH   TYR  13           HH       TYR  13   7.580   5.026  -9.835
   94    H    SER  14           H        SER  14   1.967   5.219  -6.624
   95    HA   SER  14           HA       SER  14   0.750   7.776  -7.569
   96   1HB   SER  14          2HB       SER  14   0.663   6.978  -4.670
   97   2HB   SER  14          1HB       SER  14  -0.334   8.153  -5.520
   98    HG   SER  14           HG       SER  14  -1.432   6.499  -6.496
   99    H    LYS  15           H        LYS  15   2.232   9.398  -7.449
  100    HA   LYS  15           HA       LYS  15   4.868   8.900  -6.268
  101   1HB   LYS  15          2HB       LYS  15   3.591  10.629  -8.225
  102   2HB   LYS  15          1HB       LYS  15   4.644  11.558  -7.160
  103   1HG   LYS  15          2HG       LYS  15   5.790  10.614  -9.211
  104   2HG   LYS  15          1HG       LYS  15   6.535  10.160  -7.679
  105   1HD   LYS  15          2HD       LYS  15   4.437   8.287  -8.473
  106   2HD   LYS  15          1HD       LYS  15   5.715   8.404  -9.684
  107   1HE   LYS  15          2HE       LYS  15   7.144   7.235  -8.369
  108   2HE   LYS  15          1HE       LYS  15   6.836   8.313  -6.994
  109   1HZ   LYS  15          1HZ       LYS  15   5.116   7.041  -6.249
  110   2HZ   LYS  15          2HZ       LYS  15   6.043   5.814  -6.966
  111   3HZ   LYS  15          3HZ       LYS  15   4.707   6.463  -7.790
  112    H    HIS  16           H        HIS  16   5.154   9.223  -4.126
  113    HA   HIS  16           HA       HIS  16   5.074  10.214  -1.997
  114   1HB   HIS  16          2HB       HIS  16   4.458  12.590  -3.778
  115   2HB   HIS  16          1HB       HIS  16   4.943  12.701  -2.088
  116    HD1  HIS  16           1HD      HIS  16   6.943  10.082  -2.694
  117    HD2  HIS  16           2HD      HIS  16   7.011  13.891  -4.387
  118    HE1  HIS  16           1HE      HIS  16   9.291  10.433  -3.576
  119    H    MET  17           H        MET  17   2.657   8.907  -2.809
  120    HA   MET  17           HA       MET  17   0.390  10.670  -2.192
  121   1HB   MET  17          2HB       MET  17   0.113   8.843  -3.748
  122   2HB   MET  17          1HB       MET  17   0.763   7.684  -2.589
  123   1HG   MET  17          2HG       MET  17  -1.597   9.272  -1.710
  124   2HG   MET  17          1HG       MET  17  -1.885   8.045  -2.943
  125   1HE   MET  17          1HE       MET  17  -1.169   4.781  -1.596
  126   2HE   MET  17          2HE       MET  17   0.353   5.581  -1.975
  127   3HE   MET  17          3HE       MET  17  -1.069   5.898  -2.965
  128    H    THR  18           H        THR  18  -0.288  11.117  -0.138
  129    HA   THR  18           HA       THR  18   1.092  10.173   2.194
  130    HB   THR  18           HB       THR  18  -1.678  11.375   2.078
  131    HG1  THR  18           1HG      THR  18  -0.687  12.805   0.873
  132   1HG2  THR  18          1HG2      THR  18  -0.377  12.654   4.043
  133   2HG2  THR  18          2HG2      THR  18   0.533  11.144   4.055
  134   3HG2  THR  18          3HG2      THR  18  -1.212  11.124   4.311
  135    H    ARG  19           H        ARG  19   0.592   8.565   3.648
  136    HA   ARG  19           HA       ARG  19  -0.837   6.238   2.946
  137   1HB   ARG  19          2HB       ARG  19  -0.589   5.707   5.322
  138   2HB   ARG  19          1HB       ARG  19   0.849   6.577   4.786
  139   1HG   ARG  19          2HG       ARG  19  -0.271   8.717   5.615
  140   2HG   ARG  19          1HG       ARG  19  -1.497   7.690   6.364
  141   1HD   ARG  19          2HD       ARG  19   0.700   6.450   7.319
  142   2HD   ARG  19          1HD       ARG  19   1.359   8.088   7.137
  143    HE   ARG  19           HE       ARG  19  -0.714   8.853   8.429
  144   1HH1  ARG  19          1HH1      ARG  19   1.473   6.808   9.671
  145   2HH1  ARG  19          2HH1      ARG  19   0.428   6.004  10.795
  146   1HH2  ARG  19          1HH2      ARG  19  -2.480   7.320   9.441
  147   2HH2  ARG  19          2HH2      ARG  19  -1.810   6.293  10.664
  148    H    SER  20           H        SER  20  -1.877   9.081   4.749
  149    HA   SER  20           HA       SER  20  -4.488   8.152   5.469
  150   1HB   SER  20          2HB       SER  20  -4.060   9.990   6.711
  151   2HB   SER  20          1HB       SER  20  -2.770  10.484   5.624
  152    HG   SER  20           HG       SER  20  -5.354  11.364   5.815
  153    H    GLN  21           H        GLN  21  -3.240  10.019   2.695
  154    HA   GLN  21           HA       GLN  21  -5.734  10.596   1.444
  155   1HB   GLN  21          2HB       GLN  21  -2.918  10.109   0.452
  156   2HB   GLN  21          1HB       GLN  21  -4.219  10.606  -0.631
  157   1HG   GLN  21          2HG       GLN  21  -3.661  12.136   1.903
  158   2HG   GLN  21          1HG       GLN  21  -2.742  12.457   0.434
  159   1HE2  GLN  21          1HE2      GLN  21  -4.887  14.109   1.884
  160   2HE2  GLN  21          2HE2      GLN  21  -6.018  14.473   0.671
  161    H    ALA  22           H        ALA  22  -3.642   7.747   1.413
  162    HA   ALA  22           HA       ALA  22  -5.036   6.265  -0.604
  163   1HB   ALA  22          1HB       ALA  22  -3.394   4.766  -0.115
  164   2HB   ALA  22          2HB       ALA  22  -3.839   4.728   1.590
  165   3HB   ALA  22          3HB       ALA  22  -2.776   5.997   0.985
  166    H    GLU  23           H        GLU  23  -5.284   6.278   2.953
  167    HA   GLU  23           HA       GLU  23  -7.352   4.367   3.240
  168   1HB   GLU  23          2HB       GLU  23  -6.755   6.906   4.795
  169   2HB   GLU  23          1HB       GLU  23  -7.768   5.589   5.383
  170   1HG   GLU  23          2HG       GLU  23  -5.851   4.038   5.189
  171   2HG   GLU  23          1HG       GLU  23  -4.840   5.372   4.637
  172    H    GLN  24           H        GLN  24  -7.670   7.939   2.965
  173    HA   GLN  24           HA       GLN  24 -10.533   7.874   2.898
  174   1HB   GLN  24          2HB       GLN  24 -10.282  10.226   2.191
  175   2HB   GLN  24          1HB       GLN  24  -9.186   9.843   3.514
  176   1HG   GLN  24          2HG       GLN  24  -7.362   9.488   1.853
  177   2HG   GLN  24          1HG       GLN  24  -8.472   9.982   0.573
  178   1HE2  GLN  24          1HE2      GLN  24  -7.910  12.085  -0.012
  179   2HE2  GLN  24          2HE2      GLN  24  -7.594  13.343   1.082
  180    H    LEU  25           H        LEU  25  -8.110   8.089   0.232
  181    HA   LEU  25           HA       LEU  25 -10.138   8.165  -1.806
  182   1HB   LEU  25          2HB       LEU  25  -8.323   8.076  -3.294
  183   2HB   LEU  25          1HB       LEU  25  -7.586   8.748  -1.850
  184    HG   LEU  25           HG       LEU  25  -7.104   6.227  -1.268
  185   1HD1  LEU  25          1HD1      LEU  25  -8.304   6.035  -3.861
  186   2HD1  LEU  25          2HD1      LEU  25  -7.647   4.735  -2.867
  187   3HD1  LEU  25          3HD1      LEU  25  -6.607   5.582  -4.011
  188   1HD2  LEU  25          1HD2      LEU  25  -5.365   7.893  -1.686
  189   2HD2  LEU  25          2HD2      LEU  25  -5.648   7.780  -3.417
  190   3HD2  LEU  25          3HD2      LEU  25  -4.963   6.411  -2.553
  191    H    LEU  26           H        LEU  26  -8.622   5.582   0.019
  192    HA   LEU  26           HA       LEU  26  -9.525   3.417  -1.709
  193   1HB   LEU  26          2HB       LEU  26  -8.333   3.803   1.005
  194   2HB   LEU  26          1HB       LEU  26  -9.177   2.292   0.715
  195    HG   LEU  26           HG       LEU  26  -7.064   3.354  -1.167
  196   1HD1  LEU  26          1HD1      LEU  26  -6.558   2.556   1.427
  197   2HD1  LEU  26          2HD1      LEU  26  -5.401   2.472   0.102
  198   3HD1  LEU  26          3HD1      LEU  26  -6.358   1.054   0.527
  199   1HD2  LEU  26          1HD2      LEU  26  -7.288   1.346  -2.283
  200   2HD2  LEU  26          2HD2      LEU  26  -8.926   1.478  -1.644
  201   3HD2  LEU  26          3HD2      LEU  26  -7.738   0.466  -0.825
  202    H    LYS  27           H        LYS  27 -10.577   4.447   1.575
  203    HA   LYS  27           HA       LYS  27 -13.023   3.046   1.685
  204   1HB   LYS  27          2HB       LYS  27 -11.590   4.966   3.139
  205   2HB   LYS  27          1HB       LYS  27 -13.136   5.741   2.801
  206   1HG   LYS  27          2HG       LYS  27 -13.473   2.953   3.599
  207   2HG   LYS  27          1HG       LYS  27 -12.636   3.895   4.833
  208   1HD   LYS  27          2HD       LYS  27 -14.418   5.403   5.072
  209   2HD   LYS  27          1HD       LYS  27 -15.107   4.982   3.504
  210   1HE   LYS  27          2HE       LYS  27 -16.527   3.900   5.088
  211   2HE   LYS  27          1HE       LYS  27 -15.444   2.612   4.524
  212   1HZ   LYS  27          1HZ       LYS  27 -14.966   4.321   6.909
  213   2HZ   LYS  27          2HZ       LYS  27 -13.976   3.048   6.372
  214   3HZ   LYS  27          3HZ       LYS  27 -15.536   2.725   6.962
  215    H    GLN  28           H        GLN  28 -12.284   6.198   0.230
  216    HA   GLN  28           HA       GLN  28 -14.976   6.954  -0.414
  217   1HB   GLN  28          2HB       GLN  28 -12.980   8.437  -0.326
  218   2HB   GLN  28          1HB       GLN  28 -12.363   7.660  -1.784
  219   1HG   GLN  28          2HG       GLN  28 -14.098   8.524  -3.125
  220   2HG   GLN  28          1HG       GLN  28 -15.124   8.865  -1.732
  221   1HE2  GLN  28          1HE2      GLN  28 -15.272  11.145  -2.509
  222   2HE2  GLN  28          2HE2      GLN  28 -13.982  12.214  -2.236
  223    H    GLU  29           H        GLU  29 -12.454   5.411  -2.506
  224    HA   GLU  29           HA       GLU  29 -14.122   5.153  -4.813
  225   1HB   GLU  29          2HB       GLU  29 -11.510   4.652  -4.183
  226   2HB   GLU  29          1HB       GLU  29 -12.136   3.002  -4.267
  227   1HG   GLU  29          2HG       GLU  29 -12.269   5.131  -6.417
  228   2HG   GLU  29          1HG       GLU  29 -11.335   3.640  -6.462
  229    H    GLY  30           H        GLY  30 -13.692   3.129  -1.945
  230   1HA   GLY  30          2HA       GLY  30 -15.241   1.654  -0.981
  231   2HA   GLY  30          1HA       GLY  30 -16.327   2.017  -2.314
  232    H    LYS  31           H        LYS  31 -13.110   0.891  -3.060
  233    HA   LYS  31           HA       LYS  31 -14.284  -1.568  -4.233
  234   1HB   LYS  31          2HB       LYS  31 -11.449  -0.488  -4.260
  235   2HB   LYS  31          1HB       LYS  31 -12.129  -1.689  -5.358
  236   1HG   LYS  31          2HG       LYS  31 -12.871   1.242  -5.149
  237   2HG   LYS  31          1HG       LYS  31 -12.145   0.420  -6.526
  238   1HD   LYS  31          2HD       LYS  31 -14.920  -0.119  -5.421
  239   2HD   LYS  31          1HD       LYS  31 -14.562   0.788  -6.888
  240   1HE   LYS  31          2HE       LYS  31 -13.639  -1.170  -7.969
  241   2HE   LYS  31          1HE       LYS  31 -13.726  -2.101  -6.460
  242   1HZ   LYS  31          1HZ       LYS  31 -15.654  -2.479  -7.947
  243   2HZ   LYS  31          2HZ       LYS  31 -16.067  -0.840  -7.784
  244   3HZ   LYS  31          3HZ       LYS  31 -16.093  -1.863  -6.429
  245    H    GLU  32           H        GLU  32 -14.348  -3.398  -2.936
  246    HA   GLU  32           HA       GLU  32 -12.850  -3.608  -0.488
  247   1HB   GLU  32          2HB       GLU  32 -13.624  -6.021  -0.617
  248   2HB   GLU  32          1HB       GLU  32 -14.899  -4.805  -0.675
  249   1HG   GLU  32          2HG       GLU  32 -15.492  -5.363  -2.800
  250   2HG   GLU  32          1HG       GLU  32 -13.813  -5.497  -3.325
  251    H    GLY  33           H        GLY  33 -10.650  -3.579  -0.685
  252   1HA   GLY  33          2HA       GLY  33  -8.707  -5.049  -0.862
  253   2HA   GLY  33          1HA       GLY  33  -9.433  -5.718  -2.323
  254    H    GLY  34           H        GLY  34  -9.695  -2.281  -1.994
  255   1HA   GLY  34          2HA       GLY  34  -8.456  -1.646  -4.414
  256   2HA   GLY  34          1HA       GLY  34  -8.552  -0.517  -3.058
  257    H    PHE  35           H        PHE  35  -6.310  -0.957  -4.960
  258    HA   PHE  35           HA       PHE  35  -4.210  -1.595  -2.922
  259   1HB   PHE  35          2HB       PHE  35  -4.699  -3.532  -4.375
  260   2HB   PHE  35          1HB       PHE  35  -4.403  -2.537  -5.800
  261    HD1  PHE  35           1HD      PHE  35  -2.104  -1.490  -6.102
  262    HD2  PHE  35           2HD      PHE  35  -2.911  -4.566  -3.215
  263    HE1  PHE  35           1HE      PHE  35   0.322  -1.999  -5.965
  264    HE2  PHE  35           2HE      PHE  35  -0.486  -5.071  -3.075
  265    HZ   PHE  35           HZ       PHE  35   1.130  -3.788  -4.449
  266    H    ILE  36           H        ILE  36  -2.778   0.082  -2.791
  267    HA   ILE  36           HA       ILE  36  -2.168   1.653  -5.271
  268    HB   ILE  36           HB       ILE  36  -2.469   2.845  -2.502
  269   1HG1  ILE  36          2HG1      ILE  36  -4.552   2.684  -4.706
  270   2HG1  ILE  36          1HG1      ILE  36  -4.638   1.865  -3.147
  271   1HG2  ILE  36          1HG2      ILE  36  -2.464   4.007  -5.304
  272   2HG2  ILE  36          2HG2      ILE  36  -1.169   4.148  -4.114
  273   3HG2  ILE  36          3HG2      ILE  36  -2.721   4.937  -3.828
  274   1HD1  ILE  36          1HD1      ILE  36  -4.840   4.811  -3.741
  275   2HD1  ILE  36          2HD1      ILE  36  -4.343   4.256  -2.143
  276   3HD1  ILE  36          3HD1      ILE  36  -5.922   3.800  -2.784
  277    H    VAL  37           H        VAL  37  -0.031   2.795  -5.059
  278    HA   VAL  37           HA       VAL  37   1.745   1.803  -2.903
  279    HB   VAL  37           HB       VAL  37   2.232   1.346  -5.863
  280   1HG1  VAL  37          1HG1      VAL  37   3.826   0.400  -3.462
  281   2HG1  VAL  37          2HG1      VAL  37   4.261   1.803  -4.438
  282   3HG1  VAL  37          3HG1      VAL  37   4.246   0.196  -5.163
  283   1HG2  VAL  37          1HG2      VAL  37   2.118  -1.090  -5.112
  284   2HG2  VAL  37          2HG2      VAL  37   0.579  -0.228  -5.111
  285   3HG2  VAL  37          3HG2      VAL  37   1.438  -0.500  -3.595
  286    H    ARG  38           H        ARG  38   3.512   3.199  -2.545
  287    HA   ARG  38           HA       ARG  38   4.025   5.380  -4.498
  288   1HB   ARG  38          2HB       ARG  38   3.689   7.077  -2.708
  289   2HB   ARG  38          1HB       ARG  38   2.208   6.184  -3.048
  290   1HG   ARG  38          2HG       ARG  38   2.192   5.991  -0.756
  291   2HG   ARG  38          1HG       ARG  38   3.212   4.599  -1.119
  292   1HD   ARG  38          2HD       ARG  38   5.049   5.574  -0.189
  293   2HD   ARG  38          1HD       ARG  38   4.703   7.139  -0.952
  294    HE   ARG  38           HE       ARG  38   2.990   7.505   0.838
  295   1HH1  ARG  38          1HH1      ARG  38   5.941   6.880   1.837
  296   2HH1  ARG  38          2HH1      ARG  38   5.553   6.012   3.284
  297   1HH2  ARG  38          1HH2      ARG  38   2.216   5.580   2.448
  298   2HH2  ARG  38          2HH2      ARG  38   3.444   5.276   3.631
  299    H    ASP  39           H        ASP  39   6.032   6.558  -3.964
  300    HA   ASP  39           HA       ASP  39   8.095   4.788  -2.901
  301   1HB   ASP  39          2HB       ASP  39   8.182   6.472  -4.845
  302   2HB   ASP  39          1HB       ASP  39   8.334   7.718  -3.606
  303    H    SER  40           H        SER  40   9.718   5.715  -1.270
  304    HA   SER  40           HA       SER  40   8.246   7.086   0.959
  305   1HB   SER  40          2HB       SER  40   9.110   4.589   0.998
  306   2HB   SER  40          1HB       SER  40  10.670   5.341   1.310
  307    HG   SER  40           HG       SER  40   8.273   5.526   2.808
  308    H    SER  41           H        SER  41  10.920   7.219   2.396
  309    HA   SER  41           HA       SER  41  12.428   9.160   0.721
  310   1HB   SER  41          2HB       SER  41  10.655  10.448   1.811
  311   2HB   SER  41          1HB       SER  41  11.085   9.764   3.376
  312    HG   SER  41           HG       SER  41  12.631  11.173   3.518
  313    H    LYS  42           H        LYS  42  12.198   8.121   4.154
  314    HA   LYS  42           HA       LYS  42  14.911   8.335   4.847
  315   1HB   LYS  42          2HB       LYS  42  12.604   6.599   5.676
  316   2HB   LYS  42          1HB       LYS  42  14.193   6.307   6.383
  317   1HG   LYS  42          2HG       LYS  42  13.500   9.151   6.330
  318   2HG   LYS  42          1HG       LYS  42  12.352   8.193   7.264
  319   1HD   LYS  42          2HD       LYS  42  14.715   7.122   8.112
  320   2HD   LYS  42          1HD       LYS  42  15.194   8.794   7.818
  321   1HE   LYS  42          2HE       LYS  42  13.528   9.635   9.332
  322   2HE   LYS  42          1HE       LYS  42  12.743   8.046   9.446
  323   1HZ   LYS  42          1HZ       LYS  42  14.744   7.129  10.392
  324   2HZ   LYS  42          2HZ       LYS  42  14.258   8.467  11.320
  325   3HZ   LYS  42          3HZ       LYS  42  15.554   8.611  10.231
  326    H    ALA  43           H        ALA  43  13.381   5.182   4.117
  327    HA   ALA  43           HA       ALA  43  15.992   4.039   3.352
  328   1HB   ALA  43          1HB       ALA  43  13.792   2.312   2.791
  329   2HB   ALA  43          2HB       ALA  43  13.406   3.174   4.280
  330   3HB   ALA  43          3HB       ALA  43  14.894   2.234   4.166
  331    H    GLY  44           H        GLY  44  13.340   5.577   1.793
  332   1HA   GLY  44          2HA       GLY  44  12.986   6.022  -0.497
  333   2HA   GLY  44          1HA       GLY  44  14.525   5.213  -0.839
  334    H    LYS  45           H        LYS  45  12.061   3.693   1.100
  335    HA   LYS  45           HA       LYS  45  11.902   1.467  -0.814
  336   1HB   LYS  45          2HB       LYS  45  10.790   0.360   1.063
  337   2HB   LYS  45          1HB       LYS  45  12.234   1.189   1.643
  338   1HG   LYS  45          2HG       LYS  45  10.359   3.167   1.889
  339   2HG   LYS  45          1HG       LYS  45   9.387   1.735   2.222
  340   1HD   LYS  45          2HD       LYS  45  10.435   1.333   4.197
  341   2HD   LYS  45          1HD       LYS  45  12.022   1.738   3.544
  342   1HE   LYS  45          2HE       LYS  45  11.618   4.105   3.821
  343   2HE   LYS  45          1HE       LYS  45   9.916   3.816   4.234
  344   1HZ   LYS  45          1HZ       LYS  45  11.450   4.083   6.187
  345   2HZ   LYS  45          2HZ       LYS  45  12.174   2.613   5.736
  346   3HZ   LYS  45          3HZ       LYS  45  10.535   2.655   6.182
  347    H    TYR  46           H        TYR  46   9.362   0.525  -0.549
  348    HA   TYR  46           HA       TYR  46   7.647   2.774  -1.575
  349   1HB   TYR  46          2HB       TYR  46   7.737  -0.177  -2.266
  350   2HB   TYR  46          1HB       TYR  46   6.565   0.956  -2.919
  351    HD1  TYR  46           1HD      TYR  46  10.306   0.778  -2.463
  352    HD2  TYR  46           2HD      TYR  46   7.014   1.786  -5.030
  353    HE1  TYR  46           1HE      TYR  46  11.897   1.386  -4.256
  354    HE2  TYR  46           2HE      TYR  46   8.609   2.400  -6.824
  355    HH   TYR  46           HH       TYR  46  11.788   3.000  -6.333
  356    H    THR  47           H        THR  47   5.253   2.295  -1.255
  357    HA   THR  47           HA       THR  47   4.706   0.638   1.174
  358    HB   THR  47           HB       THR  47   3.837   3.500   0.633
  359    HG1  THR  47           1HG      THR  47   5.485   3.989   1.809
  360   1HG2  THR  47          1HG2      THR  47   2.037   2.817   1.872
  361   2HG2  THR  47          2HG2      THR  47   3.160   3.006   3.218
  362   3HG2  THR  47          3HG2      THR  47   2.886   1.412   2.515
  363    H    VAL  48           H        VAL  48   2.941  -0.664   0.831
  364    HA   VAL  48           HA       VAL  48   1.284  -0.130  -1.602
  365    HB   VAL  48           HB       VAL  48   1.663  -2.563   0.169
  366   1HG1  VAL  48          1HG1      VAL  48   0.157  -2.186  -2.434
  367   2HG1  VAL  48          2HG1      VAL  48  -0.534  -2.622  -0.871
  368   3HG1  VAL  48          3HG1      VAL  48   0.522  -3.755  -1.715
  369   1HG2  VAL  48          1HG2      VAL  48   3.668  -2.389  -0.996
  370   2HG2  VAL  48          2HG2      VAL  48   2.918  -1.572  -2.367
  371   3HG2  VAL  48          3HG2      VAL  48   2.706  -3.310  -2.152
  372    H    SER  49           H        SER  49  -0.541   1.038  -1.127
  373    HA   SER  49           HA       SER  49  -1.862   0.717   1.518
  374   1HB   SER  49          2HB       SER  49  -1.770   2.698  -0.712
  375   2HB   SER  49          1HB       SER  49  -3.224   2.661   0.282
  376    HG   SER  49           HG       SER  49  -2.105   3.702   1.714
  377    H    VAL  50           H        VAL  50  -3.384  -0.930   1.567
  378    HA   VAL  50           HA       VAL  50  -5.210  -1.142  -0.806
  379    HB   VAL  50           HB       VAL  50  -5.229  -3.602  -0.306
  380   1HG1  VAL  50          1HG1      VAL  50  -2.844  -2.051  -1.161
  381   2HG1  VAL  50          2HG1      VAL  50  -3.762  -3.281  -2.029
  382   3HG1  VAL  50          3HG1      VAL  50  -2.579  -3.759  -0.812
  383   1HG2  VAL  50          1HG2      VAL  50  -2.810  -3.134   1.420
  384   2HG2  VAL  50          2HG2      VAL  50  -3.862  -4.547   1.342
  385   3HG2  VAL  50          3HG2      VAL  50  -4.419  -3.077   2.137
  386    H    PHE  51           H        PHE  51  -7.451  -1.376  -0.293
  387    HA   PHE  51           HA       PHE  51  -8.119  -1.672   2.617
  388   1HB   PHE  51          2HB       PHE  51  -8.701   0.507   2.694
  389   2HB   PHE  51          1HB       PHE  51  -8.217   0.696   1.016
  390    HD1  PHE  51           1HD      PHE  51  -9.915   0.010  -0.803
  391    HD2  PHE  51           2HD      PHE  51 -10.981   0.649   3.307
  392    HE1  PHE  51           1HE      PHE  51 -12.284   0.285  -1.457
  393    HE2  PHE  51           2HE      PHE  51 -13.354   0.919   2.648
  394    HZ   PHE  51           HZ       PHE  51 -14.007   0.739   0.264
  395    H    ALA  52           H        ALA  52 -10.559  -2.045   2.892
  396    HA   ALA  52           HA       ALA  52 -12.045  -2.991   0.562
  397   1HB   ALA  52          1HB       ALA  52 -11.981  -5.305   1.015
  398   2HB   ALA  52          2HB       ALA  52 -11.364  -5.052   2.647
  399   3HB   ALA  52          3HB       ALA  52 -10.312  -4.787   1.256
  400    H    LYS  53           H        LYS  53 -14.198  -3.905   1.225
  401    HA   LYS  53           HA       LYS  53 -15.121  -2.711   3.827
  402   1HB   LYS  53          2HB       LYS  53 -16.268  -2.989   1.053
  403   2HB   LYS  53          1HB       LYS  53 -17.334  -2.742   2.436
  404   1HG   LYS  53          2HG       LYS  53 -15.489  -0.830   2.943
  405   2HG   LYS  53          1HG       LYS  53 -15.398  -0.870   1.182
  406   1HD   LYS  53          2HD       LYS  53 -17.709  -0.361   0.946
  407   2HD   LYS  53          1HD       LYS  53 -18.036  -0.704   2.646
  408   1HE   LYS  53          2HE       LYS  53 -16.176   1.236   2.950
  409   2HE   LYS  53          1HE       LYS  53 -16.884   1.744   1.404
  410   1HZ   LYS  53          1HZ       LYS  53 -19.051   1.691   2.329
  411   2HZ   LYS  53          2HZ       LYS  53 -18.090   2.571   3.419
  412   3HZ   LYS  53          3HZ       LYS  53 -18.509   0.960   3.760
  413    H    SER  54           H        SER  54 -14.103  -5.283   4.043
  414    HA   SER  54           HA       SER  54 -16.403  -6.833   4.903
  415   1HB   SER  54          2HB       SER  54 -16.159  -6.920   2.264
  416   2HB   SER  54          1HB       SER  54 -14.906  -8.102   2.631
  417    HG   SER  54           HG       SER  54 -17.638  -8.275   2.853
  418    H    THR  55           H        THR  55 -14.576  -6.391   6.619
  419    HA   THR  55           HA       THR  55 -13.356  -8.799   7.431
  420    HB   THR  55           HB       THR  55 -11.871  -7.216   5.423
  421    HG1  THR  55           1HG      THR  55 -11.889  -9.161   4.693
  422   1HG2  THR  55          1HG2      THR  55 -10.615  -8.143   7.989
  423   2HG2  THR  55          2HG2      THR  55 -10.342  -6.643   7.102
  424   3HG2  THR  55          3HG2      THR  55  -9.681  -8.161   6.494
  425    H    GLY  56           H        GLY  56 -13.753  -8.112   9.563
  426   1HA   GLY  56          2HA       GLY  56 -13.294  -6.951  11.566
  427   2HA   GLY  56          1HA       GLY  56 -12.004  -6.100  10.708
  428    H    ASP  57           H        ASP  57 -12.955  -4.626   8.869
  429    HA   ASP  57           HA       ASP  57 -15.206  -3.031  10.025
  430   1HB   ASP  57          2HB       ASP  57 -12.614  -2.333   9.473
  431   2HB   ASP  57          1HB       ASP  57 -13.408  -1.919   7.956
  432    HA   PRO  58           HA       PRO  58 -16.710  -5.355   6.236
  433   1HB   PRO  58          2HB       PRO  58 -19.315  -4.639   7.234
  434   2HB   PRO  58          1HB       PRO  58 -18.579  -6.240   7.130
  435   1HG   PRO  58          2HG       PRO  58 -18.968  -4.574   9.471
  436   2HG   PRO  58          1HG       PRO  58 -18.404  -6.246   9.389
  437   1HD   PRO  58          2HD       PRO  58 -16.839  -4.010  10.082
  438   2HD   PRO  58          1HD       PRO  58 -16.218  -5.618   9.629
  439    H    GLN  59           H        GLN  59 -17.236  -2.159   7.494
  440    HA   GLN  59           HA       GLN  59 -18.371  -1.306   4.863
  441   1HB   GLN  59          2HB       GLN  59 -19.032   0.731   6.266
  442   2HB   GLN  59          1HB       GLN  59 -19.810  -0.792   6.705
  443   1HG   GLN  59          2HG       GLN  59 -18.589  -1.019   8.655
  444   2HG   GLN  59          1HG       GLN  59 -17.219  -0.100   8.028
  445   1HE2  GLN  59          1HE2      GLN  59 -17.392   1.159  10.129
  446   2HE2  GLN  59          2HE2      GLN  59 -18.531   2.413  10.236
  447    H    GLY  60           H        GLY  60 -15.352  -1.552   5.996
  448   1HA   GLY  60          2HA       GLY  60 -14.134   0.201   4.278
  449   2HA   GLY  60          1HA       GLY  60 -14.476   1.199   5.682
  450    H    VAL  61           H        VAL  61 -12.355  -1.133   4.340
  451    HA   VAL  61           HA       VAL  61 -10.801  -1.199   6.907
  452    HB   VAL  61           HB       VAL  61 -11.150  -3.322   4.760
  453   1HG1  VAL  61          1HG1      VAL  61  -9.897  -4.355   7.094
  454   2HG1  VAL  61          2HG1      VAL  61  -9.022  -2.893   6.640
  455   3HG1  VAL  61          3HG1      VAL  61  -9.214  -4.205   5.476
  456   1HG2  VAL  61          1HG2      VAL  61 -12.339  -4.575   6.422
  457   2HG2  VAL  61          2HG2      VAL  61 -13.035  -2.958   6.384
  458   3HG2  VAL  61          3HG2      VAL  61 -11.927  -3.407   7.679
  459    H    ILE  62           H        ILE  62  -8.668  -0.718   6.712
  460    HA   ILE  62           HA       ILE  62  -7.473  -0.486   3.993
  461    HB   ILE  62           HB       ILE  62  -6.923   1.722   5.889
  462   1HG1  ILE  62          2HG1      ILE  62  -9.667   1.276   4.673
  463   2HG1  ILE  62          1HG1      ILE  62  -9.288   1.378   6.382
  464   1HG2  ILE  62          1HG2      ILE  62  -7.940   2.497   3.315
  465   2HG2  ILE  62          2HG2      ILE  62  -6.805   1.166   3.095
  466   3HG2  ILE  62          3HG2      ILE  62  -6.291   2.632   3.927
  467   1HD1  ILE  62          1HD1      ILE  62 -10.204   3.488   5.692
  468   2HD1  ILE  62          2HD1      ILE  62  -9.063   3.595   4.352
  469   3HD1  ILE  62          3HD1      ILE  62  -8.485   3.708   6.015
  470    H    ARG  63           H        ARG  63  -5.116  -0.303   4.060
  471    HA   ARG  63           HA       ARG  63  -3.590  -0.548   6.504
  472   1HB   ARG  63          2HB       ARG  63  -4.967  -2.827   5.768
  473   2HB   ARG  63          1HB       ARG  63  -3.389  -3.093   5.028
  474   1HG   ARG  63          2HG       ARG  63  -2.311  -3.237   7.047
  475   2HG   ARG  63          1HG       ARG  63  -3.383  -2.069   7.820
  476   1HD   ARG  63          2HD       ARG  63  -3.767  -4.324   8.755
  477   2HD   ARG  63          1HD       ARG  63  -5.195  -3.801   7.839
  478    HE   ARG  63           HE       ARG  63  -3.807  -5.043   5.886
  479   1HH1  ARG  63          1HH2      ARG  63  -2.117  -6.537   7.784
  480   2HH1  ARG  63          2HH2      ARG  63  -3.045  -7.966   8.091
  481   1HH2  ARG  63          1HH1      ARG  63  -6.004  -6.630   6.873
  482   2HH2  ARG  63          2HH1      ARG  63  -5.244  -8.018   7.577
  483    H    HIS  64           H        HIS  64  -1.694   0.422   5.848
  484    HA   HIS  64           HA       HIS  64  -0.900   0.199   2.989
  485   1HB   HIS  64          2HB       HIS  64   0.456   1.900   5.070
  486   2HB   HIS  64          1HB       HIS  64   0.282   2.200   3.343
  487    HD1  HIS  64           1HD      HIS  64  -2.664   1.993   2.866
  488    HD2  HIS  64           2HD      HIS  64  -1.126   3.813   6.286
  489    HE1  HIS  64           1HE      HIS  64  -4.482   3.519   3.742
  490    H    TYR  65           H        TYR  65   0.273  -1.667   2.707
  491    HA   TYR  65           HA       TYR  65   2.163  -2.655   4.726
  492   1HB   TYR  65          2HB       TYR  65   1.888  -3.409   1.813
  493   2HB   TYR  65          1HB       TYR  65   2.498  -4.407   3.126
  494    HD1  TYR  65           1HD      TYR  65   0.053  -4.767   1.068
  495    HD2  TYR  65           2HD      TYR  65   0.391  -3.679   5.212
  496    HE1  TYR  65           1HE      TYR  65  -2.226  -5.641   1.487
  497    HE2  TYR  65           2HE      TYR  65  -1.889  -4.553   5.627
  498    HH   TYR  65           HH       TYR  65  -3.431  -6.599   3.813
  499    H    VAL  66           H        VAL  66   4.203  -1.836   4.885
  500    HA   VAL  66           HA       VAL  66   5.305  -0.377   2.518
  501    HB   VAL  66           HB       VAL  66   5.976  -0.185   5.476
  502   1HG1  VAL  66          1HG1      VAL  66   6.922   1.287   3.014
  503   2HG1  VAL  66          2HG1      VAL  66   7.890   0.534   4.281
  504   3HG1  VAL  66          3HG1      VAL  66   7.009   2.026   4.612
  505   1HG2  VAL  66          1HG2      VAL  66   4.378   1.426   5.678
  506   2HG2  VAL  66          2HG2      VAL  66   3.685   0.707   4.225
  507   3HG2  VAL  66          3HG2      VAL  66   4.742   2.112   4.095
  508    H    VAL  67           H        VAL  67   7.770  -0.505   2.404
  509    HA   VAL  67           HA       VAL  67   8.667  -3.263   3.160
  510    HB   VAL  67           HB       VAL  67   9.240  -1.542   0.732
  511   1HG1  VAL  67          1HG1      VAL  67  10.615  -3.883   1.893
  512   2HG1  VAL  67          2HG1      VAL  67  11.207  -2.685   0.744
  513   3HG1  VAL  67          3HG1      VAL  67  10.225  -4.037   0.181
  514   1HG2  VAL  67          1HG2      VAL  67   8.250  -3.997  -0.079
  515   2HG2  VAL  67          2HG2      VAL  67   7.303  -2.516   0.056
  516   3HG2  VAL  67          3HG2      VAL  67   7.322  -3.673   1.386
  517    H    CYS  68           H        CYS  68  10.406  -3.288   4.484
  518    HA   CYS  68           HA       CYS  68  11.867  -0.792   5.052
  519   1HB   CYS  68          2HB       CYS  68  11.050  -2.377   6.807
  520   2HB   CYS  68          1HB       CYS  68  12.125  -3.611   6.153
  521    HG   CYS  68           HG       CYS  68  14.172  -2.137   6.852
  522    H    SER  69           H        SER  69  14.289  -0.827   4.989
  523    HA   SER  69           HA       SER  69  15.352  -2.714   2.924
  524   1HB   SER  69          2HB       SER  69  15.691   0.280   3.223
  525   2HB   SER  69          1HB       SER  69  16.582  -0.706   2.069
  526    HG   SER  69           HG       SER  69  14.758   0.132   1.068
  527    H    THR  70           H        THR  70  17.352  -3.547   3.388
  528    HA   THR  70           HA       THR  70  18.718  -2.594   5.875
  529    HB   THR  70           HB       THR  70  17.869  -4.958   5.707
  530    HG1  THR  70           1HG      THR  70  20.681  -5.003   5.686
  531   1HG2  THR  70          1HG2      THR  70  20.087  -5.626   3.839
  532   2HG2  THR  70          2HG2      THR  70  18.633  -4.916   3.142
  533   3HG2  THR  70          3HG2      THR  70  18.528  -6.416   4.063
  534    HA   PRO  71           HA       PRO  71  22.012  -0.984   3.478
  535   1HB   PRO  71          2HB       PRO  71  24.113  -2.041   5.134
  536   2HB   PRO  71          1HB       PRO  71  23.444  -0.406   5.127
  537   1HG   PRO  71          2HG       PRO  71  23.101  -2.414   7.130
  538   2HG   PRO  71          1HG       PRO  71  22.376  -0.805   7.080
  539   1HD   PRO  71          2HD       PRO  71  21.092  -3.366   6.642
  540   2HD   PRO  71          1HD       PRO  71  20.341  -1.754   6.688
  541    H    GLN  72           H        GLN  72  21.527  -4.290   3.596
  542    HA   GLN  72           HA       GLN  72  23.979  -4.947   2.050
  543   1HB   GLN  72          2HB       GLN  72  23.203  -6.438   3.843
  544   2HB   GLN  72          1HB       GLN  72  21.626  -6.568   3.079
  545   1HG   GLN  72          2HG       GLN  72  23.103  -8.534   2.620
  546   2HG   GLN  72          1HG       GLN  72  22.598  -7.702   1.154
  547   1HE2  GLN  72          1HE2      GLN  72  24.237  -6.749  -0.155
  548   2HE2  GLN  72          2HE2      GLN  72  25.887  -6.791   0.239
  549    H    SER  73           H        SER  73  21.661  -3.165   1.103
  550    HA   SER  73           HA       SER  73  20.523  -2.790  -0.932
  551   1HB   SER  73          2HB       SER  73  22.899  -3.973  -1.522
  552   2HB   SER  73          1HB       SER  73  21.793  -5.182  -2.170
  553    HG   SER  73           HG       SER  73  22.178  -2.501  -2.902
  554    H    GLN  74           H        GLN  74  19.131  -4.213   0.992
  555    HA   GLN  74           HA       GLN  74  17.623  -6.204  -0.655
  556   1HB   GLN  74          2HB       GLN  74  17.909  -6.643   2.270
  557   2HB   GLN  74          1HB       GLN  74  17.902  -7.821   0.962
  558   1HG   GLN  74          2HG       GLN  74  20.191  -6.785   0.314
  559   2HG   GLN  74          1HG       GLN  74  20.185  -6.113   1.941
  560   1HE2  GLN  74          1HE2      GLN  74  20.140  -7.696   3.770
  561   2HE2  GLN  74          2HE2      GLN  74  20.665  -9.291   3.524
  562    H    TYR  75           H        TYR  75  15.404  -6.640   0.392
  563    HA   TYR  75           HA       TYR  75  14.370  -4.310   1.963
  564   1HB   TYR  75          2HB       TYR  75  13.170  -5.277  -0.643
  565   2HB   TYR  75          1HB       TYR  75  12.659  -3.881   0.296
  566    HD1  TYR  75           1HD      TYR  75  15.454  -5.286  -1.702
  567    HD2  TYR  75           2HD      TYR  75  13.765  -1.785   0.111
  568    HE1  TYR  75           1HE      TYR  75  17.118  -3.884  -2.874
  569    HE2  TYR  75           2HE      TYR  75  15.426  -0.377  -1.062
  570    HH   TYR  75           HH       TYR  75  17.276  -1.465  -3.636
  571    H    TYR  76           H        TYR  76  12.206  -4.691   2.842
  572    HA   TYR  76           HA       TYR  76  10.690  -7.097   2.569
  573   1HB   TYR  76          2HB       TYR  76  11.397  -8.259   4.654
  574   2HB   TYR  76          1HB       TYR  76  12.746  -8.117   3.536
  575    HD1  TYR  76           1HD      TYR  76  14.710  -6.853   4.121
  576    HD2  TYR  76           2HD      TYR  76  11.188  -6.632   6.558
  577    HE1  TYR  76           1HE      TYR  76  15.996  -5.686   5.884
  578    HE2  TYR  76           2HE      TYR  76  12.467  -5.464   8.320
  579    HH   TYR  76           HH       TYR  76  15.483  -4.096   7.785
  580    H    LEU  77           H        LEU  77   8.934  -7.192   4.174
  581    HA   LEU  77           HA       LEU  77   8.454  -4.565   5.535
  582   1HB   LEU  77          2HB       LEU  77   6.687  -5.303   4.038
  583   2HB   LEU  77          1HB       LEU  77   6.726  -6.932   4.708
  584    HG   LEU  77           HG       LEU  77   5.951  -6.026   6.895
  585   1HD1  LEU  77          1HD1      LEU  77   6.866  -3.636   6.099
  586   2HD1  LEU  77          2HD1      LEU  77   5.563  -3.785   7.275
  587   3HD1  LEU  77          3HD1      LEU  77   5.190  -3.455   5.583
  588   1HD2  LEU  77          1HD2      LEU  77   3.664  -5.117   5.836
  589   2HD2  LEU  77          2HD2      LEU  77   4.111  -6.820   5.745
  590   3HD2  LEU  77          3HD2      LEU  77   4.388  -5.760   4.362
  591    H    ALA  78           H        ALA  78   9.554  -7.672   5.970
  592    HA   ALA  78           HA       ALA  78   9.618  -7.465   8.902
  593   1HB   ALA  78          1HB       ALA  78   7.494  -8.665   8.332
  594   2HB   ALA  78          2HB       ALA  78   8.646  -9.741   9.123
  595   3HB   ALA  78          3HB       ALA  78   8.423  -9.819   7.375
  596    H    GLU  79           H        GLU  79  11.774  -7.920   9.315
  597    HA   GLU  79           HA       GLU  79  13.697  -8.629   7.429
  598   1HB   GLU  79          2HB       GLU  79  13.418  -8.797  10.398
  599   2HB   GLU  79          1HB       GLU  79  14.808  -9.607   9.672
  600   1HG   GLU  79          2HG       GLU  79  15.268  -7.451   8.417
  601   2HG   GLU  79          1HG       GLU  79  14.049  -6.689   9.439
  602    H    LYS  80           H        LYS  80  11.336 -10.704   8.818
  603    HA   LYS  80           HA       LYS  80  12.372 -13.262   8.942
  604   1HB   LYS  80          2HB       LYS  80   9.864 -11.971   8.393
  605   2HB   LYS  80          1HB       LYS  80  10.017 -13.368   7.328
  606   1HG   LYS  80          2HG       LYS  80  10.856 -14.537   9.571
  607   2HG   LYS  80          1HG       LYS  80   9.886 -13.265  10.314
  608   1HD   LYS  80          2HD       LYS  80   7.905 -14.102   9.496
  609   2HD   LYS  80          1HD       LYS  80   8.660 -14.751   8.039
  610   1HE   LYS  80          2HE       LYS  80   9.659 -16.584   9.343
  611   2HE   LYS  80          1HE       LYS  80   8.953 -15.922  10.831
  612   1HZ   LYS  80          1HZ       LYS  80   7.393 -16.667   8.415
  613   2HZ   LYS  80          2HZ       LYS  80   6.766 -16.142   9.903
  614   3HZ   LYS  80          3HZ       LYS  80   7.546 -17.648   9.790
  615    H    HIS  81           H        HIS  81  11.706 -11.394   5.992
  616    HA   HIS  81           HA       HIS  81  13.617 -13.044   4.471
  617   1HB   HIS  81          2HB       HIS  81  10.637 -13.178   4.217
  618   2HB   HIS  81          1HB       HIS  81  11.595 -13.278   2.740
  619    HD1  HIS  81           1HD      HIS  81   9.965 -15.660   4.280
  620    HD2  HIS  81           2HD      HIS  81  14.092 -15.085   4.149
  621    HE1  HIS  81           1HE      HIS  81  11.018 -17.917   4.747
  622    H    LEU  82           H        LEU  82  14.408 -11.840   2.685
  623    HA   LEU  82           HA       LEU  82  12.984  -9.357   1.941
  624   1HB   LEU  82          2HB       LEU  82  14.925  -7.992   2.534
  625   2HB   LEU  82          1HB       LEU  82  14.428  -8.925   3.942
  626    HG   LEU  82           HG       LEU  82  16.553  -9.883   2.039
  627   1HD1  LEU  82          1HD1      LEU  82  16.770  -7.579   3.541
  628   2HD1  LEU  82          2HD1      LEU  82  18.126  -8.579   3.027
  629   3HD1  LEU  82          3HD1      LEU  82  17.432  -8.798   4.630
  630   1HD2  LEU  82          1HD2      LEU  82  15.323 -10.818   4.544
  631   2HD2  LEU  82          2HD2      LEU  82  17.085 -10.802   4.600
  632   3HD2  LEU  82          3HD2      LEU  82  16.252 -11.722   3.349
  633    H    PHE  83           H        PHE  83  13.547  -8.631  -0.147
  634    HA   PHE  83           HA       PHE  83  15.409 -10.425  -1.661
  635   1HB   PHE  83          2HB       PHE  83  12.784  -9.078  -2.298
  636   2HB   PHE  83          1HB       PHE  83  13.850  -9.626  -3.595
  637    HD1  PHE  83           1HD      PHE  83  14.832 -12.071  -3.277
  638    HD2  PHE  83           2HD      PHE  83  11.240 -10.618  -1.425
  639    HE1  PHE  83           1HE      PHE  83  14.051 -14.403  -2.960
  640    HE2  PHE  83           2HE      PHE  83  10.458 -12.948  -1.110
  641    HZ   PHE  83           HZ       PHE  83  11.863 -14.841  -1.877
  642    H    SER  84           H        SER  84  15.073  -8.403  -3.981
  643    HA   SER  84           HA       SER  84  17.037  -6.423  -2.870
  644   1HB   SER  84          2HB       SER  84  18.020  -7.926  -4.469
  645   2HB   SER  84          1HB       SER  84  16.677  -7.715  -5.587
  646    HG   SER  84           HG       SER  84  17.346  -5.650  -5.985
  647    H    THR  85           H        THR  85  13.845  -6.493  -3.681
  648    HA   THR  85           HA       THR  85  13.718  -3.609  -4.106
  649    HB   THR  85           HB       THR  85  12.607  -5.225  -6.383
  650    HG1  THR  85           1HG      THR  85  15.263  -4.255  -6.281
  651   1HG2  THR  85          1HG2      THR  85  12.170  -3.174  -7.161
  652   2HG2  THR  85          2HG2      THR  85  13.881  -2.756  -7.081
  653   3HG2  THR  85          3HG2      THR  85  12.841  -2.487  -5.683
  654    H    ILE  86           H        ILE  86  11.378  -2.893  -4.301
  655    HA   ILE  86           HA       ILE  86   9.686  -4.494  -2.570
  656    HB   ILE  86           HB       ILE  86   9.555  -1.902  -4.053
  657   1HG1  ILE  86          2HG1      ILE  86   8.704  -1.395  -1.586
  658   2HG1  ILE  86          1HG1      ILE  86   9.454  -2.952  -1.259
  659   1HG2  ILE  86          1HG2      ILE  86   7.345  -2.891  -4.527
  660   2HG2  ILE  86          2HG2      ILE  86   7.191  -1.594  -3.345
  661   3HG2  ILE  86          3HG2      ILE  86   7.141  -3.275  -2.818
  662   1HD1  ILE  86          1HD1      ILE  86  11.571  -2.182  -1.663
  663   2HD1  ILE  86          2HD1      ILE  86  10.839  -0.648  -1.193
  664   3HD1  ILE  86          3HD1      ILE  86  11.032  -1.047  -2.900
  665    HA   PRO  87           HA       PRO  87   7.033  -5.121  -6.617
  666   1HB   PRO  87          2HB       PRO  87   8.897  -4.987  -8.809
  667   2HB   PRO  87          1HB       PRO  87   7.468  -3.987  -8.534
  668   1HG   PRO  87          2HG       PRO  87  10.243  -3.252  -8.247
  669   2HG   PRO  87          1HG       PRO  87   8.816  -2.230  -8.065
  670   1HD   PRO  87          2HD       PRO  87  10.557  -3.133  -5.998
  671   2HD   PRO  87          1HD       PRO  87   9.021  -2.257  -5.795
  672    H    GLU  88           H        GLU  88  10.468  -5.947  -6.447
  673    HA   GLU  88           HA       GLU  88  10.296  -8.589  -7.595
  674   1HB   GLU  88          2HB       GLU  88  12.298  -6.983  -7.008
  675   2HB   GLU  88          1HB       GLU  88  12.218  -7.752  -5.424
  676   1HG   GLU  88          2HG       GLU  88  13.675  -9.209  -6.442
  677   2HG   GLU  88          1HG       GLU  88  12.158  -9.958  -6.941
  678    H    LEU  89           H        LEU  89  10.451  -7.462  -4.203
  679    HA   LEU  89           HA       LEU  89  10.050  -9.849  -2.797
  680   1HB   LEU  89          2HB       LEU  89   9.852  -7.009  -2.403
  681   2HB   LEU  89          1HB       LEU  89   8.450  -7.755  -1.644
  682    HG   LEU  89           HG       LEU  89  11.257  -8.775  -1.197
  683   1HD1  LEU  89          1HD1      LEU  89  11.323  -7.466   0.847
  684   2HD1  LEU  89          2HD1      LEU  89   9.709  -6.832   0.541
  685   3HD1  LEU  89          3HD1      LEU  89  11.051  -6.374  -0.508
  686   1HD2  LEU  89          1HD2      LEU  89  10.208  -9.767   0.808
  687   2HD2  LEU  89          2HD2      LEU  89   9.378 -10.292  -0.657
  688   3HD2  LEU  89          3HD2      LEU  89   8.664  -9.040   0.359
  689    H    ILE  90           H        ILE  90   7.447  -7.611  -3.868
  690    HA   ILE  90           HA       ILE  90   5.233  -9.213  -3.120
  691    HB   ILE  90           HB       ILE  90   5.601  -7.301  -5.455
  692   1HG1  ILE  90          2HG1      ILE  90   4.267  -6.555  -2.888
  693   2HG1  ILE  90          1HG1      ILE  90   6.026  -6.685  -2.880
  694   1HG2  ILE  90          1HG2      ILE  90   2.995  -7.666  -4.045
  695   2HG2  ILE  90          2HG2      ILE  90   3.483  -8.926  -5.178
  696   3HG2  ILE  90          3HG2      ILE  90   3.312  -7.261  -5.733
  697   1HD1  ILE  90          1HD1      ILE  90   4.815  -5.209  -5.161
  698   2HD1  ILE  90          2HD1      ILE  90   6.303  -4.883  -4.273
  699   3HD1  ILE  90          3HD1      ILE  90   4.746  -4.420  -3.585
  700    H    ASN  91           H        ASN  91   7.169  -9.229  -6.107
  701    HA   ASN  91           HA       ASN  91   5.579 -11.040  -7.632
  702   1HB   ASN  91          2HB       ASN  91   8.242  -9.850  -7.636
  703   2HB   ASN  91          1HB       ASN  91   8.275 -11.498  -8.261
  704   1HD2  ASN  91          1HD2      ASN  91   8.626 -10.694 -10.474
  705   2HD2  ASN  91          2HD2      ASN  91   7.361  -9.976 -11.347
  706    H    TYR  92           H        TYR  92   8.166 -11.620  -5.254
  707    HA   TYR  92           HA       TYR  92   8.449 -14.428  -5.575
  708   1HB   TYR  92          2HB       TYR  92   8.759 -12.489  -3.278
  709   2HB   TYR  92          1HB       TYR  92   9.138 -14.201  -3.088
  710    HD1  TYR  92           1HD      TYR  92  10.686 -15.244  -4.912
  711    HD2  TYR  92           2HD      TYR  92  10.399 -11.038  -4.124
  712    HE1  TYR  92           1HE      TYR  92  12.887 -14.895  -6.000
  713    HE2  TYR  92           2HE      TYR  92  12.600 -10.686  -5.206
  714    HH   TYR  92           HH       TYR  92  14.746 -12.344  -5.597
  715    H    HIS  93           H        HIS  93   5.843 -12.577  -4.197
  716    HA   HIS  93           HA       HIS  93   4.714 -14.988  -2.849
  717   1HB   HIS  93          2HB       HIS  93   4.200 -12.009  -2.777
  718   2HB   HIS  93          1HB       HIS  93   3.093 -13.156  -2.023
  719    HD1  HIS  93           1HD      HIS  93   3.578 -13.099   0.426
  720    HD2  HIS  93           2HD      HIS  93   7.080 -13.108  -1.836
  721    HE1  HIS  93           1HE      HIS  93   5.496 -13.240   2.074
  722    H    GLN  94           H        GLN  94   3.918 -12.518  -5.301
  723    HA   GLN  94           HA       GLN  94   1.427 -13.962  -6.015
  724   1HB   GLN  94          2HB       GLN  94   2.385 -11.288  -6.012
  725   2HB   GLN  94          1HB       GLN  94   2.095 -11.715  -7.698
  726   1HG   GLN  94          2HG       GLN  94  -0.179 -12.129  -7.341
  727   2HG   GLN  94          1HG       GLN  94   0.042 -12.406  -5.613
  728   1HE2  GLN  94          1HE2      GLN  94  -1.087 -10.740  -4.578
  729   2HE2  GLN  94          2HE2      GLN  94  -0.950  -9.094  -4.967
  730    H    HIS  95           H        HIS  95   4.226 -12.644  -7.845
  731    HA   HIS  95           HA       HIS  95   3.753 -14.075 -10.253
  732   1HB   HIS  95          2HB       HIS  95   5.983 -12.645  -8.910
  733   2HB   HIS  95          1HB       HIS  95   6.450 -13.742 -10.208
  734    HD1  HIS  95           1HD      HIS  95   3.554 -11.275  -9.802
  735    HD2  HIS  95           2HD      HIS  95   6.530 -12.283 -12.541
  736    HE1  HIS  95           1HE      HIS  95   3.227  -9.760 -11.805
  737    H    ASN  96           H        ASN  96   5.233 -15.102  -7.237
  738    HA   ASN  96           HA       ASN  96   6.532 -17.473  -8.328
  739   1HB   ASN  96          2HB       ASN  96   7.167 -16.206  -6.247
  740   2HB   ASN  96          1HB       ASN  96   5.688 -16.803  -5.490
  741   1HD2  ASN  96          1HD2      ASN  96   8.535 -17.428  -4.750
  742   2HD2  ASN  96          2HD2      ASN  96   8.669 -19.117  -4.854
  743    H    SER  97           H        SER  97   3.728 -17.109  -6.113
  744    HA   SER  97           HA       SER  97   2.708 -19.738  -7.123
  745   1HB   SER  97          2HB       SER  97   3.147 -19.758  -4.772
  746   2HB   SER  97          1HB       SER  97   2.412 -18.173  -4.550
  747    HG   SER  97           HG       SER  97   1.118 -20.591  -5.296
  748    H    ALA  98           H        ALA  98   1.542 -18.910  -8.953
  749    HA   ALA  98           HA       ALA  98  -0.293 -16.667  -8.759
  750   1HB   ALA  98          1HB       ALA  98   0.143 -18.936 -10.720
  751   2HB   ALA  98          2HB       ALA  98   0.695 -17.268 -10.869
  752   3HB   ALA  98          3HB       ALA  98  -1.023 -17.643 -11.001
  753    H    GLY  99           H        GLY  99  -2.550 -16.731  -8.468
  754   1HA   GLY  99          2HA       GLY  99  -3.887 -19.349  -8.156
  755   2HA   GLY  99          1HA       GLY  99  -3.859 -18.310  -6.732
  756    H    LEU 100           H        LEU 100  -4.458 -15.877  -7.452
  757    HA   LEU 100           HA       LEU 100  -7.219 -15.997  -8.354
  758   1HB   LEU 100          2HB       LEU 100  -5.272 -13.754  -7.735
  759   2HB   LEU 100          1HB       LEU 100  -6.986 -13.496  -8.062
  760    HG   LEU 100           HG       LEU 100  -6.569 -15.598  -6.079
  761   1HD1  LEU 100          1HD1      LEU 100  -5.395 -14.505  -4.436
  762   2HD1  LEU 100          2HD1      LEU 100  -5.919 -12.910  -4.976
  763   3HD1  LEU 100          3HD1      LEU 100  -4.625 -13.750  -5.832
  764   1HD2  LEU 100          1HD2      LEU 100  -7.899 -12.981  -5.506
  765   2HD2  LEU 100          2HD2      LEU 100  -8.432 -14.617  -5.120
  766   3HD2  LEU 100          3HD2      LEU 100  -8.600 -14.000  -6.763
  767    H    ILE 101           H        ILE 101  -7.610 -13.850  -9.978
  768    HA   ILE 101           HA       ILE 101  -6.473 -14.768 -12.548
  769    HB   ILE 101           HB       ILE 101  -8.524 -12.651 -11.813
  770   1HG1  ILE 101          2HG1      ILE 101  -9.914 -14.667 -12.973
  771   2HG1  ILE 101          1HG1      ILE 101  -8.621 -15.596 -12.214
  772   1HG2  ILE 101          1HG2      ILE 101  -9.178 -13.279 -14.305
  773   2HG2  ILE 101          2HG2      ILE 101  -7.473 -13.717 -14.410
  774   3HG2  ILE 101          3HG2      ILE 101  -7.935 -12.069 -13.983
  775   1HD1  ILE 101          1HD1      ILE 101  -9.956 -13.473 -10.588
  776   2HD1  ILE 101          2HD1      ILE 101  -9.267 -15.013 -10.072
  777   3HD1  ILE 101          3HD1      ILE 101 -10.838 -14.973 -10.873
  778    H    SER 102           H        SER 102  -6.949 -11.535 -11.061
  779    HA   SER 102           HA       SER 102  -4.622 -10.518 -12.610
  780   1HB   SER 102          2HB       SER 102  -5.542  -8.327 -11.805
  781   2HB   SER 102          1HB       SER 102  -6.729  -9.289 -12.681
  782    HG   SER 102           HG       SER 102  -6.458  -8.878  -9.896
  783    H    ARG 103           H        ARG 103  -2.739  -9.801 -11.596
  784    HA   ARG 103           HA       ARG 103  -2.028 -10.819  -9.016
  785   1HB   ARG 103          2HB       ARG 103  -0.859  -8.593 -10.722
  786   2HB   ARG 103          1HB       ARG 103  -0.023  -9.376  -9.380
  787   1HG   ARG 103          2HG       ARG 103  -1.149 -11.261 -11.344
  788   2HG   ARG 103          1HG       ARG 103   0.104 -10.207 -12.000
  789   1HD   ARG 103          2HD       ARG 103   1.614 -10.857 -10.130
  790   2HD   ARG 103          1HD       ARG 103   0.363 -11.966  -9.535
  791    HE   ARG 103           HE       ARG 103   1.952 -12.323 -11.995
  792   1HH1  ARG 103          1HH2      ARG 103   0.954 -14.252  -9.701
  793   2HH1  ARG 103          2HH2      ARG 103  -0.053 -15.302 -10.642
  794   1HH2  ARG 103          1HH1      ARG 103  -0.109 -13.207 -13.405
  795   2HH2  ARG 103          2HH1      ARG 103  -0.654 -14.711 -12.738
  796    H    LEU 104           H        LEU 104  -2.764  -7.468 -10.063
  797    HA   LEU 104           HA       LEU 104  -2.800  -6.517  -7.274
  798   1HB   LEU 104          2HB       LEU 104  -1.981  -5.345  -9.451
  799   2HB   LEU 104          1HB       LEU 104  -3.690  -5.021  -9.740
  800    HG   LEU 104           HG       LEU 104  -2.851  -4.406  -6.993
  801   1HD1  LEU 104          1HD1      LEU 104  -1.836  -2.164  -8.047
  802   2HD1  LEU 104          2HD1      LEU 104  -1.379  -3.279  -9.334
  803   3HD1  LEU 104          3HD1      LEU 104  -0.820  -3.559  -7.686
  804   1HD2  LEU 104          1HD2      LEU 104  -3.936  -2.169  -7.815
  805   2HD2  LEU 104          2HD2      LEU 104  -4.959  -3.595  -7.640
  806   3HD2  LEU 104          3HD2      LEU 104  -4.387  -3.110  -9.237
  807    H    LYS 105           H        LYS 105  -4.781  -5.247  -6.537
  808    HA   LYS 105           HA       LYS 105  -7.220  -6.837  -7.102
  809   1HB   LYS 105          2HB       LYS 105  -6.254  -4.928  -4.990
  810   2HB   LYS 105          1HB       LYS 105  -7.976  -5.290  -5.120
  811   1HG   LYS 105          2HG       LYS 105  -5.921  -7.497  -5.028
  812   2HG   LYS 105          1HG       LYS 105  -6.563  -6.781  -3.549
  813   1HD   LYS 105          2HD       LYS 105  -8.800  -7.431  -4.092
  814   2HD   LYS 105          1HD       LYS 105  -8.346  -7.856  -5.743
  815   1HE   LYS 105          2HE       LYS 105  -6.679  -9.522  -4.507
  816   2HE   LYS 105          1HE       LYS 105  -7.877  -9.378  -3.205
  817   1HZ   LYS 105          1HZ       LYS 105  -8.595 -11.106  -4.669
  818   2HZ   LYS 105          2HZ       LYS 105  -8.390 -10.119  -6.037
  819   3HZ   LYS 105          3HZ       LYS 105  -9.616  -9.773  -4.911
  820    H    TYR 106           H        TYR 106  -7.137  -3.367  -6.244
  821    HA   TYR 106           HA       TYR 106  -8.545  -2.819  -8.839
  822   1HB   TYR 106          2HB       TYR 106 -10.124  -2.925  -6.964
  823   2HB   TYR 106          1HB       TYR 106  -9.148  -1.769  -6.059
  824    HD1  TYR 106           1HD      TYR 106  -9.112   0.573  -6.619
  825    HD2  TYR 106           2HD      TYR 106 -11.366  -2.210  -8.983
  826    HE1  TYR 106           1HE      TYR 106 -10.236   2.464  -7.764
  827    HE2  TYR 106           2HE      TYR 106 -12.497  -0.322 -10.127
  828    HH   TYR 106           HH       TYR 106 -11.411   2.922  -9.830
  829    HA   PRO 107           HA       PRO 107  -5.103   0.083  -8.998
  830   1HB   PRO 107          2HB       PRO 107  -6.165   1.062 -11.480
  831   2HB   PRO 107          1HB       PRO 107  -4.782  -0.007 -11.234
  832   1HG   PRO 107          2HG       PRO 107  -7.314  -0.691 -12.349
  833   2HG   PRO 107          1HG       PRO 107  -5.970  -1.779 -11.993
  834   1HD   PRO 107          2HD       PRO 107  -8.505  -1.506 -10.580
  835   2HD   PRO 107          1HD       PRO 107  -7.223  -2.718 -10.336
  836    H    VAL 108           H        VAL 108  -5.540   1.720  -7.516
  837    HA   VAL 108           HA       VAL 108  -7.319   3.934  -8.423
  838    HB   VAL 108           HB       VAL 108  -8.323   2.229  -6.766
  839   1HG1  VAL 108          1HG1      VAL 108  -7.718   2.524  -4.419
  840   2HG1  VAL 108          2HG1      VAL 108  -6.512   3.731  -4.863
  841   3HG1  VAL 108          3HG1      VAL 108  -6.295   2.049  -5.346
  842   1HG2  VAL 108          1HG2      VAL 108  -9.508   3.982  -5.567
  843   2HG2  VAL 108          2HG2      VAL 108  -9.208   4.531  -7.217
  844   3HG2  VAL 108          3HG2      VAL 108  -8.208   5.128  -5.894
  845    H    SER 109           H        SER 109  -6.476   6.034  -7.768
  846    HA   SER 109           HA       SER 109  -3.820   5.914  -6.374
  847   1HB   SER 109          2HB       SER 109  -4.591   8.175  -8.171
  848   2HB   SER 109          1HB       SER 109  -3.010   7.435  -7.920
  849    HG   SER 109           HG       SER 109  -4.109   5.531  -8.980
  850    H    GLN 110           H        GLN 110  -3.422   8.507  -5.872
  851    HA   GLN 110           HA       GLN 110  -4.465   9.275  -3.507
  852   1HB   GLN 110          2HB       GLN 110  -4.245  11.648  -4.427
  853   2HB   GLN 110          1HB       GLN 110  -2.853  10.598  -4.695
  854   1HG   GLN 110          2HG       GLN 110  -3.897  10.018  -6.962
  855   2HG   GLN 110          1HG       GLN 110  -5.005  11.361  -6.682
  856   1HE2  GLN 110          1HE2      GLN 110  -1.468  10.964  -6.060
  857   2HE2  GLN 110          2HE2      GLN 110  -1.012  12.362  -6.910
  858    H    GLN 111           H        GLN 111  -6.183   9.718  -6.601
  859    HA   GLN 111           HA       GLN 111  -8.716   9.970  -5.108
  860   1HB   GLN 111          2HB       GLN 111  -9.260  12.036  -6.356
  861   2HB   GLN 111          1HB       GLN 111  -7.779  12.239  -5.415
  862   1HG   GLN 111          2HG       GLN 111  -6.551  12.597  -7.271
  863   2HG   GLN 111          1HG       GLN 111  -7.202  11.159  -8.055
  864   1HE2  GLN 111          1HE2      GLN 111  -6.779  13.960  -9.166
  865   2HE2  GLN 111          2HE2      GLN 111  -8.299  14.421  -9.764
  866    H    ASN 112           H        ASN 112  -9.767  10.977  -7.885
  867    HA   ASN 112           HA       ASN 112 -10.643  10.005  -9.847
  868   1HB   ASN 112          2HB       ASN 112  -8.053   9.268  -9.760
  869   2HB   ASN 112          1HB       ASN 112  -8.791   7.675  -9.585
  870   1HD2  ASN 112          1HD2      ASN 112  -7.323   8.659 -11.962
  871   2HD2  ASN 112          2HD2      ASN 112  -8.426   8.625 -13.253
  872    H    LYS 113           H        LYS 113 -12.197   9.599  -7.768
  873    HA   LYS 113           HA       LYS 113 -12.554   6.790  -7.055
  874   1HB   LYS 113          2HB       LYS 113 -14.390   9.179  -6.679
  875   2HB   LYS 113          1HB       LYS 113 -14.407   7.682  -5.748
  876   1HG   LYS 113          2HG       LYS 113 -12.058   9.598  -5.851
  877   2HG   LYS 113          1HG       LYS 113 -13.255   9.558  -4.558
  878   1HD   LYS 113          2HD       LYS 113 -12.467   7.577  -3.700
  879   2HD   LYS 113          1HD       LYS 113 -11.960   6.973  -5.274
  880   1HE   LYS 113          2HE       LYS 113 -10.024   7.528  -3.770
  881   2HE   LYS 113          1HE       LYS 113 -10.018   8.486  -5.261
  882   1HZ   LYS 113          1HZ       LYS 113 -10.997  10.310  -4.162
  883   2HZ   LYS 113          2HZ       LYS 113  -9.750   9.786  -3.134
  884   3HZ   LYS 113          3HZ       LYS 113 -11.366   9.394  -2.783
  885    H    ASN 114           H        ASN 114 -13.591   5.346  -8.382
  886    HA   ASN 114           HA       ASN 114 -16.098   5.970  -9.693
  887   1HB   ASN 114          2HB       ASN 114 -15.190   5.849 -12.014
  888   2HB   ASN 114          1HB       ASN 114 -14.569   7.235 -11.123
  889   1HD2  ASN 114          1HD2      ASN 114 -12.837   6.843 -12.996
  890   2HD2  ASN 114          2HD2      ASN 114 -11.523   5.859 -12.568
  891    H    ALA 115           H        ALA 115 -16.463   4.118 -11.471
  892    HA   ALA 115           HA       ALA 115 -15.095   1.639 -11.335
  893   1HB   ALA 115          1HB       ALA 115 -17.239   0.798  -9.753
  894   2HB   ALA 115          2HB       ALA 115 -16.738   2.321  -9.021
  895   3HB   ALA 115          3HB       ALA 115 -15.574   1.012  -9.214
  896    HA   PRO 116           HA       PRO 116 -19.612   0.767 -12.886
  897   1HB   PRO 116          2HB       PRO 116 -21.009   3.282 -12.951
  898   2HB   PRO 116          1HB       PRO 116 -21.414   1.836 -12.022
  899   1HG   PRO 116          2HG       PRO 116 -20.363   4.322 -11.045
  900   2HG   PRO 116          1HG       PRO 116 -20.777   2.878 -10.119
  901   1HD   PRO 116          2HD       PRO 116 -18.154   3.905 -10.699
  902   2HD   PRO 116          1HD       PRO 116 -18.572   2.431  -9.793
  903    H    SER 117           H        SER 117 -18.857   0.555 -14.983
  904    HA   SER 117           HA       SER 117 -17.866   2.868 -16.505
  905   1HB   SER 117          2HB       SER 117 -17.910  -0.076 -16.644
  906   2HB   SER 117          1HB       SER 117 -18.036   0.711 -18.215
  907    HG   SER 117           HG       SER 117 -16.077   1.521 -17.979
  908    H    THR 118           H        THR 118 -20.300   0.365 -17.328
  909    HA   THR 118           HA       THR 118 -21.999   2.535 -18.515
  910    HB   THR 118           HB       THR 118 -21.536  -0.248 -19.628
  911    HG1  THR 118           1HG      THR 118 -20.198   0.863 -21.129
  912   1HG2  THR 118          1HG2      THR 118 -22.599   2.231 -20.995
  913   2HG2  THR 118          2HG2      THR 118 -23.648   1.046 -20.216
  914   3HG2  THR 118          3HG2      THR 118 -22.643   0.569 -21.585
  Start of MODEL   19
    1    H    THR   1           1H       THR   1  19.906  -7.302  -9.413
    2    HA   THR   1           HA       THR   1  19.055  -5.640 -11.072
    3    HB   THR   1           HB       THR   1  17.938  -8.349 -11.666
    4    HG1  THR   1           1HG      THR   1  19.580  -9.301 -10.809
    5   1HG2  THR   1          1HG2      THR   1  19.348  -6.171 -13.016
    6   2HG2  THR   1          2HG2      THR   1  18.333  -7.444 -13.696
    7   3HG2  THR   1          3HG2      THR   1  20.039  -7.753 -13.376
    8    H    GLU   2           H        GLU   2  16.900  -6.269 -12.704
    9    HA   GLU   2           HA       GLU   2  14.595  -5.844 -12.976
   10   1HB   GLU   2          2HB       GLU   2  14.938  -7.818 -11.100
   11   2HB   GLU   2          1HB       GLU   2  13.972  -6.648 -10.200
   12   1HG   GLU   2          2HG       GLU   2  12.236  -6.675 -11.858
   13   2HG   GLU   2          1HG       GLU   2  13.240  -7.597 -12.979
   14    H    ALA   3           H        ALA   3  14.299  -3.629 -13.047
   15    HA   ALA   3           HA       ALA   3  14.252  -2.126 -10.452
   16   1HB   ALA   3          1HB       ALA   3  14.606  -1.210 -13.327
   17   2HB   ALA   3          2HB       ALA   3  15.912  -1.448 -12.166
   18   3HB   ALA   3          3HB       ALA   3  14.719  -0.178 -11.901
   19    H    GLU   4           H        GLU   4  12.814   0.083 -11.293
   20    HA   GLU   4           HA       GLU   4  10.336  -0.587 -12.636
   21   1HB   GLU   4          2HB       GLU   4   8.957  -0.593 -10.524
   22   2HB   GLU   4          1HB       GLU   4  10.062  -1.960 -10.641
   23   1HG   GLU   4          2HG       GLU   4  11.203  -1.317  -8.803
   24   2HG   GLU   4          1HG       GLU   4  11.338   0.342  -9.384
   25    H    ASP   5           H        ASP   5   8.916   1.231 -10.549
   26    HA   ASP   5           HA       ASP   5   8.510   3.536 -10.311
   27   1HB   ASP   5          2HB       ASP   5  11.274   2.996  -9.932
   28   2HB   ASP   5          1HB       ASP   5  11.155   4.506 -10.830
   29    H    SER   6           H        SER   6   7.282   3.956 -12.186
   30    HA   SER   6           HA       SER   6   8.824   5.030 -14.526
   31   1HB   SER   6          2HB       SER   6   6.801   4.060 -15.823
   32   2HB   SER   6          1HB       SER   6   7.987   2.917 -15.202
   33    HG   SER   6           HG       SER   6   6.625   2.385 -13.574
   34    H    ILE   7           H        ILE   7   6.692   6.013 -15.985
   35    HA   ILE   7           HA       ILE   7   5.523   8.053 -14.126
   36    HB   ILE   7           HB       ILE   7   7.222   8.776 -15.822
   37   1HG1  ILE   7          2HG1      ILE   7   5.411  10.410 -16.995
   38   2HG1  ILE   7          1HG1      ILE   7   4.427   9.779 -15.674
   39   1HG2  ILE   7          1HG2      ILE   7   6.613   8.763 -18.192
   40   2HG2  ILE   7          2HG2      ILE   7   5.080   7.978 -17.817
   41   3HG2  ILE   7          3HG2      ILE   7   6.596   7.114 -17.568
   42   1HD1  ILE   7          1HD1      ILE   7   6.491  11.769 -15.561
   43   2HD1  ILE   7          2HD1      ILE   7   6.994  10.381 -14.596
   44   3HD1  ILE   7          3HD1      ILE   7   5.462  11.184 -14.255
   45    H    GLU   8           H        GLU   8   4.838   5.956 -16.920
   46    HA   GLU   8           HA       GLU   8   2.136   6.787 -17.351
   47   1HB   GLU   8          2HB       GLU   8   3.717   4.265 -17.892
   48   2HB   GLU   8          1HB       GLU   8   2.050   4.458 -18.435
   49   1HG   GLU   8          2HG       GLU   8   2.749   6.588 -19.584
   50   2HG   GLU   8          1HG       GLU   8   4.420   6.193 -19.178
   51    H    MET   9           H        MET   9   2.766   3.465 -16.301
   52    HA   MET   9           HA       MET   9   1.688   2.124 -14.694
   53   1HB   MET   9          2HB       MET   9   1.686   4.829 -13.318
   54   2HB   MET   9          1HB       MET   9   1.414   3.287 -12.508
   55   1HG   MET   9          2HG       MET   9   3.906   3.931 -14.105
   56   2HG   MET   9          1HG       MET   9   3.790   4.107 -12.354
   57   1HE   MET   9          1HE       MET   9   3.244   0.847 -15.144
   58   2HE   MET   9          2HE       MET   9   4.981   0.860 -14.854
   59   3HE   MET   9          3HE       MET   9   4.161   2.350 -15.311
   60    H    TYR  10           H        TYR  10  -0.440   1.770 -13.598
   61    HA   TYR  10           HA       TYR  10  -2.626   2.863 -15.212
   62   1HB   TYR  10          2HB       TYR  10  -2.317   0.729 -13.096
   63   2HB   TYR  10          1HB       TYR  10  -3.891   1.147 -13.774
   64    HD1  TYR  10           1HD      TYR  10  -1.386  -1.175 -14.054
   65    HD2  TYR  10           2HD      TYR  10  -3.633   1.523 -16.528
   66    HE1  TYR  10           1HE      TYR  10  -0.913  -2.594 -16.032
   67    HE2  TYR  10           2HE      TYR  10  -3.160   0.104 -18.506
   68    HH   TYR  10           HH       TYR  10  -2.581  -2.440 -18.845
   69    H    GLU  11           H        GLU  11  -2.644   2.198 -11.712
   70    HA   GLU  11           HA       GLU  11  -3.315   5.040 -11.135
   71   1HB   GLU  11          2HB       GLU  11  -5.328   3.370 -11.727
   72   2HB   GLU  11          1HB       GLU  11  -5.108   2.917 -10.038
   73   1HG   GLU  11          2HG       GLU  11  -6.682   4.659  -9.944
   74   2HG   GLU  11          1HG       GLU  11  -5.154   5.447  -9.550
   75    H    TRP  12           H        TRP  12  -3.032   1.746  -9.788
   76    HA   TRP  12           HA       TRP  12  -2.784   2.238  -7.086
   77   1HB   TRP  12          2HB       TRP  12  -1.309   0.219  -7.082
   78   2HB   TRP  12          1HB       TRP  12  -2.772   0.024  -8.045
   79    HD1  TRP  12           HD       TRP  12  -2.520  -0.198 -10.649
   80    HE1  TRP  12           1HE      TRP  12  -0.489  -0.564 -12.195
   81    HE3  TRP  12           3HE      TRP  12   1.273   0.786  -7.374
   82    HZ2  TRP  12           2HZ      TRP  12   2.366  -0.454 -12.062
   83    HZ3  TRP  12           3HZ      TRP  12   3.636   0.647  -8.109
   84    HH2  TRP  12           HH       TRP  12   4.187   0.030 -10.446
   85    H    TYR  13           H        TYR  13  -0.463   3.111  -9.556
   86    HA   TYR  13           HA       TYR  13   1.733   3.495  -7.637
   87   1HB   TYR  13          2HB       TYR  13   1.882   2.843 -10.109
   88   2HB   TYR  13          1HB       TYR  13   1.506   4.530 -10.470
   89    HD1  TYR  13           1HD      TYR  13   3.700   2.674  -8.053
   90    HD2  TYR  13           2HD      TYR  13   3.353   5.878 -10.891
   91    HE1  TYR  13           1HE      TYR  13   6.061   3.300  -7.633
   92    HE2  TYR  13           2HE      TYR  13   5.715   6.503 -10.474
   93    HH   TYR  13           HH       TYR  13   7.781   5.427  -9.649
   94    H    SER  14           H        SER  14   2.257   5.403  -6.617
   95    HA   SER  14           HA       SER  14   1.004   7.945  -7.534
   96   1HB   SER  14          2HB       SER  14   0.871   6.983  -4.670
   97   2HB   SER  14          1HB       SER  14   0.011   8.340  -5.393
   98    HG   SER  14           HG       SER  14  -0.413   5.572  -5.680
   99    H    LYS  15           H        LYS  15   2.459   9.590  -7.358
  100    HA   LYS  15           HA       LYS  15   5.091   9.095  -6.161
  101   1HB   LYS  15          2HB       LYS  15   3.818  10.845  -8.106
  102   2HB   LYS  15          1HB       LYS  15   4.869  11.757  -7.023
  103   1HG   LYS  15          2HG       LYS  15   6.013  10.833  -9.090
  104   2HG   LYS  15          1HG       LYS  15   6.762  10.376  -7.560
  105   1HD   LYS  15          2HD       LYS  15   4.673   8.494  -8.358
  106   2HD   LYS  15          1HD       LYS  15   5.945   8.624  -9.572
  107   1HE   LYS  15          2HE       LYS  15   7.377   7.446  -8.270
  108   2HE   LYS  15          1HE       LYS  15   7.090   8.530  -6.898
  109   1HZ   LYS  15          1HZ       LYS  15   5.370   7.269  -6.127
  110   2HZ   LYS  15          2HZ       LYS  15   6.292   6.037  -6.841
  111   3HZ   LYS  15          3HZ       LYS  15   4.949   6.677  -7.660
  112    H    HIS  16           H        HIS  16   5.276   9.337  -3.992
  113    HA   HIS  16           HA       HIS  16   5.155  10.293  -1.849
  114   1HB   HIS  16          2HB       HIS  16   4.860  12.608  -3.757
  115   2HB   HIS  16          1HB       HIS  16   4.809  12.874  -2.015
  116    HD1  HIS  16           1HD      HIS  16   7.062  11.088  -4.532
  117    HD2  HIS  16           2HD      HIS  16   7.325  13.152  -0.920
  118    HE1  HIS  16           1HE      HIS  16   9.527  11.242  -3.973
  119    H    MET  17           H        MET  17   2.819   8.970  -2.546
  120    HA   MET  17           HA       MET  17   0.485  10.709  -2.181
  121   1HB   MET  17          2HB       MET  17   0.493   8.618  -3.516
  122   2HB   MET  17          1HB       MET  17   0.846   7.696  -2.056
  123   1HG   MET  17          2HG       MET  17  -1.343   9.154  -1.268
  124   2HG   MET  17          1HG       MET  17  -1.704   8.870  -2.970
  125   1HE   MET  17          1HE       MET  17  -0.588   7.569   0.298
  126   2HE   MET  17          2HE       MET  17   0.400   6.361  -0.517
  127   3HE   MET  17          3HE       MET  17  -1.029   5.858   0.383
  128    H    THR  18           H        THR  18  -0.732  10.904  -0.250
  129    HA   THR  18           HA       THR  18   0.748  10.397   2.244
  130    HB   THR  18           HB       THR  18  -2.042  11.508   1.949
  131    HG1  THR  18           1HG      THR  18   0.411  12.866   1.517
  132   1HG2  THR  18          1HG2      THR  18   0.212  11.667   3.904
  133   2HG2  THR  18          2HG2      THR  18  -1.519  11.509   4.200
  134   3HG2  THR  18          3HG2      THR  18  -0.844  13.070   3.735
  135    H    ARG  19           H        ARG  19   0.338   8.739   3.638
  136    HA   ARG  19           HA       ARG  19  -1.144   6.429   3.055
  137   1HB   ARG  19          2HB       ARG  19  -0.839   5.953   5.430
  138   2HB   ARG  19          1HB       ARG  19   0.587   6.810   4.846
  139   1HG   ARG  19          2HG       ARG  19  -0.514   8.966   5.656
  140   2HG   ARG  19          1HG       ARG  19  -1.723   7.956   6.453
  141   1HD   ARG  19          2HD       ARG  19  -0.278   7.345   8.116
  142   2HD   ARG  19          1HD       ARG  19   1.081   7.158   6.990
  143    HE   ARG  19           HE       ARG  19   0.187   9.931   7.434
  144   1HH1  ARG  19          1HH1      ARG  19   2.926   8.517   6.664
  145   2HH1  ARG  19          2HH1      ARG  19   3.881   9.035   8.012
  146   1HH2  ARG  19          1HH2      ARG  19   1.158  10.111   9.869
  147   2HH2  ARG  19          2HH2      ARG  19   2.881   9.937   9.827
  148    H    SER  20           H        SER  20  -2.148   9.316   4.831
  149    HA   SER  20           HA       SER  20  -4.743   8.379   5.612
  150   1HB   SER  20          2HB       SER  20  -4.287  10.215   6.845
  151   2HB   SER  20          1HB       SER  20  -3.030  10.718   5.726
  152    HG   SER  20           HG       SER  20  -4.386  12.208   5.132
  153    H    GLN  21           H        GLN  21  -3.549  10.187   2.788
  154    HA   GLN  21           HA       GLN  21  -6.103  10.769   1.625
  155   1HB   GLN  21          2HB       GLN  21  -3.279  10.432   0.605
  156   2HB   GLN  21          1HB       GLN  21  -4.605  10.846  -0.485
  157   1HG   GLN  21          2HG       GLN  21  -4.334  12.432   2.030
  158   2HG   GLN  21          1HG       GLN  21  -3.172  12.736   0.740
  159   1HE2  GLN  21          1HE2      GLN  21  -6.450  13.263   1.757
  160   2HE2  GLN  21          2HE2      GLN  21  -6.978  14.059   0.354
  161    H    ALA  22           H        ALA  22  -3.891   8.000   1.358
  162    HA   ALA  22           HA       ALA  22  -5.328   6.572  -0.657
  163   1HB   ALA  22          1HB       ALA  22  -3.769   4.916  -0.193
  164   2HB   ALA  22          2HB       ALA  22  -3.913   5.136   1.551
  165   3HB   ALA  22          3HB       ALA  22  -2.966   6.275   0.594
  166    H    GLU  23           H        GLU  23  -5.438   6.382   2.903
  167    HA   GLU  23           HA       GLU  23  -7.428   4.377   3.132
  168   1HB   GLU  23          2HB       GLU  23  -6.537   6.727   4.797
  169   2HB   GLU  23          1HB       GLU  23  -7.837   5.671   5.354
  170   1HG   GLU  23          2HG       GLU  23  -6.437   3.815   5.528
  171   2HG   GLU  23          1HG       GLU  23  -5.270   4.463   4.377
  172    H    GLN  24           H        GLN  24  -7.856   7.952   3.066
  173    HA   GLN  24           HA       GLN  24 -10.720   7.795   3.179
  174   1HB   GLN  24          2HB       GLN  24 -10.590  10.189   2.603
  175   2HB   GLN  24          1HB       GLN  24  -9.395   9.774   3.829
  176   1HG   GLN  24          2HG       GLN  24  -7.671   9.594   2.051
  177   2HG   GLN  24          1HG       GLN  24  -8.874  10.088   0.861
  178   1HE2  GLN  24          1HE2      GLN  24  -9.262  12.319   0.626
  179   2HE2  GLN  24          2HE2      GLN  24  -8.592  13.511   1.634
  180    H    LEU  25           H        LEU  25  -8.471   8.236   0.389
  181    HA   LEU  25           HA       LEU  25 -10.668   8.306  -1.488
  182   1HB   LEU  25          2HB       LEU  25  -8.932   8.240  -3.158
  183   2HB   LEU  25          1HB       LEU  25  -8.328   9.215  -1.825
  184    HG   LEU  25           HG       LEU  25  -7.330   6.942  -0.973
  185   1HD1  LEU  25          1HD1      LEU  25  -7.442   5.172  -2.371
  186   2HD1  LEU  25          2HD1      LEU  25  -6.841   6.135  -3.719
  187   3HD1  LEU  25          3HD1      LEU  25  -8.567   6.099  -3.362
  188   1HD2  LEU  25          1HD2      LEU  25  -5.540   7.450  -3.043
  189   2HD2  LEU  25          2HD2      LEU  25  -5.567   8.277  -1.490
  190   3HD2  LEU  25          3HD2      LEU  25  -6.407   8.975  -2.871
  191    H    LEU  26           H        LEU  26  -8.891   5.758   0.112
  192    HA   LEU  26           HA       LEU  26  -9.704   3.610  -1.685
  193   1HB   LEU  26          2HB       LEU  26  -8.426   3.959   0.987
  194   2HB   LEU  26          1HB       LEU  26  -9.225   2.426   0.704
  195    HG   LEU  26           HG       LEU  26  -7.187   3.615  -1.193
  196   1HD1  LEU  26          1HD1      LEU  26  -5.504   2.669  -0.001
  197   2HD1  LEU  26          2HD1      LEU  26  -6.436   1.206   0.315
  198   3HD1  LEU  26          3HD1      LEU  26  -6.650   2.626   1.338
  199   1HD2  LEU  26          1HD2      LEU  26  -7.895   0.708  -1.014
  200   2HD2  LEU  26          2HD2      LEU  26  -7.380   1.648  -2.412
  201   3HD2  LEU  26          3HD2      LEU  26  -9.032   1.792  -1.814
  202    H    LYS  27           H        LYS  27 -10.689   4.452   1.664
  203    HA   LYS  27           HA       LYS  27 -13.013   2.884   1.866
  204   1HB   LYS  27          2HB       LYS  27 -11.656   4.677   3.384
  205   2HB   LYS  27          1HB       LYS  27 -13.069   5.644   2.962
  206   1HG   LYS  27          2HG       LYS  27 -13.602   2.849   3.815
  207   2HG   LYS  27          1HG       LYS  27 -13.033   3.952   5.069
  208   1HD   LYS  27          2HD       LYS  27 -14.913   5.272   4.958
  209   2HD   LYS  27          1HD       LYS  27 -15.163   4.953   3.241
  210   1HE   LYS  27          2HE       LYS  27 -15.544   2.782   5.315
  211   2HE   LYS  27          1HE       LYS  27 -16.863   3.874   4.850
  212   1HZ   LYS  27          1HZ       LYS  27 -16.293   3.326   2.491
  213   2HZ   LYS  27          2HZ       LYS  27 -16.949   2.033   3.376
  214   3HZ   LYS  27          3HZ       LYS  27 -15.279   2.099   3.074
  215    H    GLN  28           H        GLN  28 -12.640   6.166   0.536
  216    HA   GLN  28           HA       GLN  28 -15.422   6.614  -0.033
  217   1HB   GLN  28          2HB       GLN  28 -13.526   8.279   0.153
  218   2HB   GLN  28          1HB       GLN  28 -12.995   7.751  -1.442
  219   1HG   GLN  28          2HG       GLN  28 -14.396   9.720  -1.706
  220   2HG   GLN  28          1HG       GLN  28 -15.271   8.321  -2.327
  221   1HE2  GLN  28          1HE2      GLN  28 -17.282   7.839  -1.371
  222   2HE2  GLN  28          2HE2      GLN  28 -17.894   8.625   0.004
  223    H    GLU  29           H        GLU  29 -12.764   5.329  -2.090
  224    HA   GLU  29           HA       GLU  29 -14.233   5.161  -4.529
  225   1HB   GLU  29          2HB       GLU  29 -11.702   4.746  -3.875
  226   2HB   GLU  29          1HB       GLU  29 -12.226   3.071  -3.705
  227   1HG   GLU  29          2HG       GLU  29 -11.749   2.994  -5.944
  228   2HG   GLU  29          1HG       GLU  29 -13.362   3.686  -6.094
  229    H    GLY  30           H        GLY  30 -14.009   2.982  -1.747
  230   1HA   GLY  30          2HA       GLY  30 -15.603   1.424  -1.005
  231   2HA   GLY  30          1HA       GLY  30 -16.576   1.839  -2.409
  232    H    LYS  31           H        LYS  31 -13.350   0.979  -3.195
  233    HA   LYS  31           HA       LYS  31 -14.297  -1.505  -4.478
  234   1HB   LYS  31          2HB       LYS  31 -11.533  -0.262  -4.330
  235   2HB   LYS  31          1HB       LYS  31 -12.094  -1.438  -5.516
  236   1HG   LYS  31          2HG       LYS  31 -12.963   1.447  -5.207
  237   2HG   LYS  31          1HG       LYS  31 -12.202   0.693  -6.603
  238   1HD   LYS  31          2HD       LYS  31 -14.968   0.010  -5.558
  239   2HD   LYS  31          1HD       LYS  31 -14.639   1.043  -6.946
  240   1HE   LYS  31          2HE       LYS  31 -14.141  -0.729  -8.305
  241   2HE   LYS  31          1HE       LYS  31 -13.318  -1.617  -7.009
  242   1HZ   LYS  31          1HZ       LYS  31 -16.254  -1.228  -7.260
  243   2HZ   LYS  31          2HZ       LYS  31 -15.475  -2.034  -5.984
  244   3HZ   LYS  31          3HZ       LYS  31 -15.421  -2.675  -7.555
  245    H    GLU  32           H        GLU  32 -14.295  -3.402  -3.289
  246    HA   GLU  32           HA       GLU  32 -12.844  -3.662  -0.808
  247   1HB   GLU  32          2HB       GLU  32 -13.557  -6.074  -1.033
  248   2HB   GLU  32          1HB       GLU  32 -14.867  -4.897  -1.107
  249   1HG   GLU  32          2HG       GLU  32 -15.390  -5.468  -3.238
  250   2HG   GLU  32          1HG       GLU  32 -13.701  -5.429  -3.741
  251    H    GLY  33           H        GLY  33 -10.631  -3.485  -1.044
  252   1HA   GLY  33          2HA       GLY  33  -8.638  -4.897  -1.230
  253   2HA   GLY  33          1HA       GLY  33  -9.339  -5.570  -2.699
  254    H    GLY  34           H        GLY  34  -9.599  -2.116  -2.221
  255   1HA   GLY  34          2HA       GLY  34  -8.366  -1.471  -4.681
  256   2HA   GLY  34          1HA       GLY  34  -8.531  -0.335  -3.337
  257    H    PHE  35           H        PHE  35  -6.215  -0.866  -5.213
  258    HA   PHE  35           HA       PHE  35  -4.177  -1.427  -3.075
  259   1HB   PHE  35          2HB       PHE  35  -4.629  -3.323  -4.626
  260   2HB   PHE  35          1HB       PHE  35  -4.167  -2.293  -5.978
  261    HD1  PHE  35           1HD      PHE  35  -1.823  -1.290  -5.995
  262    HD2  PHE  35           2HD      PHE  35  -3.000  -4.461  -3.352
  263    HE1  PHE  35           1HE      PHE  35   0.559  -1.897  -5.664
  264    HE2  PHE  35           2HE      PHE  35  -0.618  -5.064  -3.013
  265    HZ   PHE  35           HZ       PHE  35   1.163  -3.782  -4.169
  266    H    ILE  36           H        ILE  36  -2.798   0.280  -2.838
  267    HA   ILE  36           HA       ILE  36  -2.093   1.904  -5.266
  268    HB   ILE  36           HB       ILE  36  -2.581   2.910  -2.433
  269   1HG1  ILE  36          2HG1      ILE  36  -4.302   3.153  -4.925
  270   2HG1  ILE  36          1HG1      ILE  36  -4.701   2.232  -3.476
  271   1HG2  ILE  36          1HG2      ILE  36  -0.969   4.281  -3.587
  272   2HG2  ILE  36          2HG2      ILE  36  -2.505   5.145  -3.613
  273   3HG2  ILE  36          3HG2      ILE  36  -1.948   4.293  -5.053
  274   1HD1  ILE  36          1HD1      ILE  36  -4.246   5.237  -3.562
  275   2HD1  ILE  36          2HD1      ILE  36  -4.700   4.302  -2.137
  276   3HD1  ILE  36          3HD1      ILE  36  -5.824   4.451  -3.487
  277    H    VAL  37           H        VAL  37   0.039   3.073  -4.902
  278    HA   VAL  37           HA       VAL  37   1.761   2.011  -2.745
  279    HB   VAL  37           HB       VAL  37   2.304   1.563  -5.699
  280   1HG1  VAL  37          1HG1      VAL  37   4.209   0.148  -4.626
  281   2HG1  VAL  37          2HG1      VAL  37   3.926   1.133  -3.191
  282   3HG1  VAL  37          3HG1      VAL  37   4.416   1.898  -4.703
  283   1HG2  VAL  37          1HG2      VAL  37   1.519  -0.282  -3.430
  284   2HG2  VAL  37          2HG2      VAL  37   2.246  -0.872  -4.924
  285   3HG2  VAL  37          3HG2      VAL  37   0.688  -0.048  -4.967
  286    H    ARG  38           H        ARG  38   3.672   3.306  -2.465
  287    HA   ARG  38           HA       ARG  38   4.167   5.540  -4.341
  288   1HB   ARG  38          2HB       ARG  38   3.828   7.220  -2.541
  289   2HB   ARG  38          1HB       ARG  38   2.344   6.328  -2.876
  290   1HG   ARG  38          2HG       ARG  38   2.382   6.197  -0.562
  291   2HG   ARG  38          1HG       ARG  38   3.274   4.730  -0.966
  292   1HD   ARG  38          2HD       ARG  38   5.317   5.632  -0.319
  293   2HD   ARG  38          1HD       ARG  38   4.807   7.296  -0.669
  294    HE   ARG  38           HE       ARG  38   3.304   5.966   1.484
  295   1HH1  ARG  38          1HH1      ARG  38   4.508   8.877   0.614
  296   2HH1  ARG  38          2HH1      ARG  38   5.275   9.256   2.120
  297   1HH2  ARG  38          1HH2      ARG  38   4.907   6.062   3.418
  298   2HH2  ARG  38          2HH2      ARG  38   5.500   7.664   3.708
  299    H    ASP  39           H        ASP  39   6.184   6.693  -3.773
  300    HA   ASP  39           HA       ASP  39   8.221   4.882  -2.729
  301   1HB   ASP  39          2HB       ASP  39   8.432   6.495  -4.657
  302   2HB   ASP  39          1HB       ASP  39   8.393   7.813  -3.486
  303    H    SER  40           H        SER  40   9.773   5.611  -1.010
  304    HA   SER  40           HA       SER  40   8.323   7.008   1.210
  305   1HB   SER  40          2HB       SER  40   9.064   4.563   1.348
  306   2HB   SER  40          1HB       SER  40  10.721   5.160   1.354
  307    HG   SER  40           HG       SER  40   8.660   5.548   3.244
  308    H    SER  41           H        SER  41  10.986   7.146   2.653
  309    HA   SER  41           HA       SER  41  12.467   9.147   1.023
  310   1HB   SER  41          2HB       SER  41  10.716  10.403   2.155
  311   2HB   SER  41          1HB       SER  41  11.111   9.638   3.692
  312    HG   SER  41           HG       SER  41  12.731  10.966   3.918
  313    H    LYS  42           H        LYS  42  12.291   8.049   4.438
  314    HA   LYS  42           HA       LYS  42  15.028   8.231   5.061
  315   1HB   LYS  42          2HB       LYS  42  12.745   6.479   5.953
  316   2HB   LYS  42          1HB       LYS  42  14.348   6.281   6.664
  317   1HG   LYS  42          2HG       LYS  42  14.295   8.824   7.063
  318   2HG   LYS  42          1HG       LYS  42  12.567   8.718   6.726
  319   1HD   LYS  42          2HD       LYS  42  12.760   8.499   9.091
  320   2HD   LYS  42          1HD       LYS  42  12.486   6.864   8.489
  321   1HE   LYS  42          2HE       LYS  42  14.316   6.477   9.880
  322   2HE   LYS  42          1HE       LYS  42  15.169   6.869   8.374
  323   1HZ   LYS  42          1HZ       LYS  42  14.424   8.798  10.509
  324   2HZ   LYS  42          2HZ       LYS  42  15.179   9.203   9.042
  325   3HZ   LYS  42          3HZ       LYS  42  15.992   8.239  10.183
  326    H    ALA  43           H        ALA  43  13.425   5.101   4.394
  327    HA   ALA  43           HA       ALA  43  15.989   3.899   3.584
  328   1HB   ALA  43          1HB       ALA  43  14.780   2.251   4.597
  329   2HB   ALA  43          2HB       ALA  43  13.948   2.106   3.049
  330   3HB   ALA  43          3HB       ALA  43  13.257   3.100   4.332
  331    H    GLY  44           H        GLY  44  13.327   5.472   2.051
  332   1HA   GLY  44          2HA       GLY  44  12.967   5.927  -0.236
  333   2HA   GLY  44          1HA       GLY  44  14.498   5.107  -0.589
  334    H    LYS  45           H        LYS  45  12.022   3.605   1.356
  335    HA   LYS  45           HA       LYS  45  11.844   1.386  -0.566
  336   1HB   LYS  45          2HB       LYS  45  10.708   0.283   1.301
  337   2HB   LYS  45          1HB       LYS  45  12.167   1.081   1.885
  338   1HG   LYS  45          2HG       LYS  45  10.340   3.091   2.162
  339   2HG   LYS  45          1HG       LYS  45   9.328   1.680   2.465
  340   1HD   LYS  45          2HD       LYS  45  10.415   1.146   4.404
  341   2HD   LYS  45          1HD       LYS  45  11.982   1.672   3.788
  342   1HE   LYS  45          2HE       LYS  45  11.424   4.003   4.171
  343   2HE   LYS  45          1HE       LYS  45   9.756   3.575   4.601
  344   1HZ   LYS  45          1HZ       LYS  45  11.012   3.771   6.614
  345   2HZ   LYS  45          2HZ       LYS  45  12.234   2.750   6.019
  346   3HZ   LYS  45          3HZ       LYS  45  10.691   2.126   6.359
  347    H    TYR  46           H        TYR  46   9.342   0.453  -0.461
  348    HA   TYR  46           HA       TYR  46   7.658   2.725  -1.471
  349   1HB   TYR  46          2HB       TYR  46   7.787  -0.237  -2.078
  350   2HB   TYR  46          1HB       TYR  46   6.546   0.826  -2.732
  351    HD1  TYR  46           1HD      TYR  46  10.304   0.771  -2.367
  352    HD2  TYR  46           2HD      TYR  46   6.918   1.705  -4.843
  353    HE1  TYR  46           1HE      TYR  46  11.828   1.460  -4.192
  354    HE2  TYR  46           2HE      TYR  46   8.447   2.395  -6.668
  355    HH   TYR  46           HH       TYR  46  11.750   1.670  -6.670
  356    H    THR  47           H        THR  47   5.316   2.529  -1.034
  357    HA   THR  47           HA       THR  47   4.634   0.824   1.335
  358    HB   THR  47           HB       THR  47   3.942   3.746   0.856
  359    HG1  THR  47           1HG      THR  47   5.252   4.027   2.709
  360   1HG2  THR  47          1HG2      THR  47   2.740   1.693   2.535
  361   2HG2  THR  47          2HG2      THR  47   2.195   3.342   2.229
  362   3HG2  THR  47          3HG2      THR  47   3.369   3.024   3.506
  363    H    VAL  48           H        VAL  48   2.942  -0.474   0.747
  364    HA   VAL  48           HA       VAL  48   1.277   0.331  -1.584
  365    HB   VAL  48           HB       VAL  48   1.634  -2.229  -0.008
  366   1HG1  VAL  48          1HG1      VAL  48   0.089  -1.774  -2.575
  367   2HG1  VAL  48          2HG1      VAL  48  -0.646  -2.030  -0.993
  368   3HG1  VAL  48          3HG1      VAL  48   0.304  -3.313  -1.741
  369   1HG2  VAL  48          1HG2      VAL  48   3.187  -2.834  -1.575
  370   2HG2  VAL  48          2HG2      VAL  48   3.357  -1.091  -1.771
  371   3HG2  VAL  48          3HG2      VAL  48   2.338  -2.007  -2.881
  372    H    SER  49           H        SER  49  -0.637   1.347  -1.168
  373    HA   SER  49           HA       SER  49  -1.950   0.999   1.487
  374   1HB   SER  49          2HB       SER  49  -1.577   3.096  -0.465
  375   2HB   SER  49          1HB       SER  49  -3.299   2.858  -0.183
  376    HG   SER  49           HG       SER  49  -3.047   3.384   1.891
  377    H    VAL  50           H        VAL  50  -3.425  -0.703   1.497
  378    HA   VAL  50           HA       VAL  50  -5.202  -0.945  -0.911
  379    HB   VAL  50           HB       VAL  50  -5.157  -3.412  -0.406
  380   1HG1  VAL  50          1HG1      VAL  50  -2.845  -1.773  -1.276
  381   2HG1  VAL  50          2HG1      VAL  50  -3.700  -3.060  -2.124
  382   3HG1  VAL  50          3HG1      VAL  50  -2.494  -3.460  -0.902
  383   1HG2  VAL  50          1HG2      VAL  50  -2.700  -3.052   1.225
  384   2HG2  VAL  50          2HG2      VAL  50  -3.956  -4.285   1.339
  385   3HG2  VAL  50          3HG2      VAL  50  -4.223  -2.689   2.035
  386    H    PHE  51           H        PHE  51  -7.436  -1.174  -0.457
  387    HA   PHE  51           HA       PHE  51  -8.184  -1.581   2.420
  388   1HB   PHE  51          2HB       PHE  51  -8.831   0.580   2.538
  389   2HB   PHE  51          1HB       PHE  51  -8.290   0.828   0.883
  390    HD1  PHE  51           1HD      PHE  51  -9.885   0.232  -1.023
  391    HD2  PHE  51           2HD      PHE  51 -11.154   0.530   3.068
  392    HE1  PHE  51           1HE      PHE  51 -12.235   0.423  -1.763
  393    HE2  PHE  51           2HE      PHE  51 -13.507   0.716   2.321
  394    HZ   PHE  51           HZ       PHE  51 -14.049   0.664  -0.094
  395    H    ALA  52           H        ALA  52 -10.660  -1.908   2.571
  396    HA   ALA  52           HA       ALA  52 -12.029  -2.852   0.175
  397   1HB   ALA  52          1HB       ALA  52 -11.408  -4.904   2.301
  398   2HB   ALA  52          2HB       ALA  52 -10.377  -4.680   0.888
  399   3HB   ALA  52          3HB       ALA  52 -12.057  -5.179   0.684
  400    H    LYS  53           H        LYS  53 -14.065  -4.264   1.107
  401    HA   LYS  53           HA       LYS  53 -15.220  -2.672   3.388
  402   1HB   LYS  53          2HB       LYS  53 -16.199  -3.530   0.675
  403   2HB   LYS  53          1HB       LYS  53 -17.366  -3.267   1.972
  404   1HG   LYS  53          2HG       LYS  53 -15.256  -1.212   1.328
  405   2HG   LYS  53          1HG       LYS  53 -16.792  -1.249   0.460
  406   1HD   LYS  53          2HD       LYS  53 -16.925  -1.408   3.426
  407   2HD   LYS  53          1HD       LYS  53 -16.465   0.149   2.735
  408   1HE   LYS  53          2HE       LYS  53 -18.880  -1.376   1.733
  409   2HE   LYS  53          1HE       LYS  53 -18.985  -0.228   3.082
  410   1HZ   LYS  53          1HZ       LYS  53 -17.795   1.389   1.626
  411   2HZ   LYS  53          2HZ       LYS  53 -19.359   0.996   1.092
  412   3HZ   LYS  53          3HZ       LYS  53 -18.002   0.312   0.332
  413    H    SER  54           H        SER  54 -13.860  -5.258   3.714
  414    HA   SER  54           HA       SER  54 -15.966  -6.744   5.071
  415   1HB   SER  54          2HB       SER  54 -15.583  -8.779   3.519
  416   2HB   SER  54          1HB       SER  54 -16.578  -7.465   2.897
  417    HG   SER  54           HG       SER  54 -14.947  -6.822   1.620
  418    H    THR  55           H        THR  55 -14.220  -6.327   6.689
  419    HA   THR  55           HA       THR  55 -12.698  -8.551   7.431
  420    HB   THR  55           HB       THR  55 -11.452  -6.867   5.334
  421    HG1  THR  55           1HG      THR  55 -11.229  -8.791   4.584
  422   1HG2  THR  55          1HG2      THR  55  -9.151  -7.681   6.301
  423   2HG2  THR  55          2HG2      THR  55 -10.014  -7.683   7.840
  424   3HG2  THR  55          3HG2      THR  55  -9.867  -6.190   6.913
  425    H    GLY  56           H        GLY  56 -13.141  -7.809   9.551
  426   1HA   GLY  56          2HA       GLY  56 -12.689  -6.580  11.515
  427   2HA   GLY  56          1HA       GLY  56 -11.454  -5.699  10.610
  428    H    ASP  57           H        ASP  57 -12.552  -4.358   8.718
  429    HA   ASP  57           HA       ASP  57 -14.777  -2.762   9.921
  430   1HB   ASP  57          2HB       ASP  57 -12.245  -2.049   9.120
  431   2HB   ASP  57          1HB       ASP  57 -13.177  -1.733   7.662
  432    HA   PRO  58           HA       PRO  58 -16.453  -5.343   6.367
  433   1HB   PRO  58          2HB       PRO  58 -19.009  -4.663   7.514
  434   2HB   PRO  58          1HB       PRO  58 -18.225  -6.243   7.432
  435   1HG   PRO  58          2HG       PRO  58 -18.505  -4.474   9.715
  436   2HG   PRO  58          1HG       PRO  58 -17.898  -6.132   9.671
  437   1HD   PRO  58          2HD       PRO  58 -16.357  -3.828  10.150
  438   2HD   PRO  58          1HD       PRO  58 -15.720  -5.436   9.718
  439    H    GLN  59           H        GLN  59 -17.032  -2.119   7.537
  440    HA   GLN  59           HA       GLN  59 -18.324  -1.404   4.939
  441   1HB   GLN  59          2HB       GLN  59 -18.994   0.656   6.302
  442   2HB   GLN  59          1HB       GLN  59 -19.690  -0.875   6.836
  443   1HG   GLN  59          2HG       GLN  59 -18.288  -1.022   8.696
  444   2HG   GLN  59          1HG       GLN  59 -17.078   0.049   7.989
  445   1HE2  GLN  59          1HE2      GLN  59 -18.358   0.395  10.638
  446   2HE2  GLN  59          2HE2      GLN  59 -19.175   1.881  10.585
  447    H    GLY  60           H        GLY  60 -15.278  -1.589   5.767
  448   1HA   GLY  60          2HA       GLY  60 -14.169   0.139   4.005
  449   2HA   GLY  60          1HA       GLY  60 -14.463   1.185   5.384
  450    H    VAL  61           H        VAL  61 -12.554  -1.507   4.196
  451    HA   VAL  61           HA       VAL  61 -10.895  -1.411   6.690
  452    HB   VAL  61           HB       VAL  61 -10.938  -3.446   4.441
  453   1HG1  VAL  61          1HG1      VAL  61  -8.976  -3.070   6.223
  454   2HG1  VAL  61          2HG1      VAL  61  -9.443  -4.679   5.674
  455   3HG1  VAL  61          3HG1      VAL  61 -10.043  -4.064   7.214
  456   1HG2  VAL  61          1HG2      VAL  61 -12.213  -4.853   6.084
  457   2HG2  VAL  61          2HG2      VAL  61 -13.110  -3.459   5.483
  458   3HG2  VAL  61          3HG2      VAL  61 -12.389  -3.418   7.091
  459    H    ILE  62           H        ILE  62  -8.747  -0.931   6.538
  460    HA   ILE  62           HA       ILE  62  -7.534  -0.498   3.855
  461    HB   ILE  62           HB       ILE  62  -7.058   1.638   5.845
  462   1HG1  ILE  62          2HG1      ILE  62  -9.799   1.168   4.635
  463   2HG1  ILE  62          1HG1      ILE  62  -9.405   1.214   6.344
  464   1HG2  ILE  62          1HG2      ILE  62  -8.112   2.521   3.330
  465   2HG2  ILE  62          2HG2      ILE  62  -6.965   1.218   3.020
  466   3HG2  ILE  62          3HG2      ILE  62  -6.455   2.643   3.923
  467   1HD1  ILE  62          1HD1      ILE  62 -10.085   3.362   6.183
  468   2HD1  ILE  62          2HD1      ILE  62  -9.789   3.434   4.446
  469   3HD1  ILE  62          3HD1      ILE  62  -8.449   3.620   5.579
  470    H    ARG  63           H        ARG  63  -5.170  -0.244   3.981
  471    HA   ARG  63           HA       ARG  63  -3.686  -0.547   6.444
  472   1HB   ARG  63          2HB       ARG  63  -4.980  -2.841   5.549
  473   2HB   ARG  63          1HB       ARG  63  -3.344  -3.034   4.921
  474   1HG   ARG  63          2HG       ARG  63  -3.819  -2.213   7.782
  475   2HG   ARG  63          1HG       ARG  63  -3.829  -3.912   7.311
  476   1HD   ARG  63          2HD       ARG  63  -1.564  -3.959   7.215
  477   2HD   ARG  63          1HD       ARG  63  -1.532  -2.526   6.168
  478    HE   ARG  63           HE       ARG  63  -1.422  -1.134   8.124
  479   1HH1  ARG  63          1HH1      ARG  63   0.188  -3.754   8.848
  480   2HH1  ARG  63          2HH1      ARG  63  -0.286  -3.919  10.506
  481   1HH2  ARG  63          1HH2      ARG  63  -2.896  -1.649  10.261
  482   2HH2  ARG  63          2HH2      ARG  63  -2.032  -2.726  11.306
  483    H    HIS  64           H        HIS  64  -1.597   0.146   5.968
  484    HA   HIS  64           HA       HIS  64  -0.858   0.293   3.077
  485   1HB   HIS  64          2HB       HIS  64   0.681   1.641   5.270
  486   2HB   HIS  64          1HB       HIS  64   0.378   2.189   3.624
  487    HD1  HIS  64           1HD      HIS  64  -1.641   3.652   3.232
  488    HD2  HIS  64           2HD      HIS  64  -1.619   1.984   7.051
  489    HE1  HIS  64           1HE      HIS  64  -3.497   4.787   4.521
  490    H    TYR  65           H        TYR  65   0.247  -1.580   2.549
  491    HA   TYR  65           HA       TYR  65   2.104  -2.877   4.428
  492   1HB   TYR  65          2HB       TYR  65   1.772  -3.261   1.446
  493   2HB   TYR  65          1HB       TYR  65   2.399  -4.422   2.608
  494    HD1  TYR  65           1HD      TYR  65   0.033  -4.796   0.630
  495    HD2  TYR  65           2HD      TYR  65   0.215  -3.643   4.765
  496    HE1  TYR  65           1HE      TYR  65  -2.245  -5.702   0.984
  497    HE2  TYR  65           2HE      TYR  65  -2.064  -4.548   5.117
  498    HH   TYR  65           HH       TYR  65  -3.577  -6.600   2.971
  499    H    VAL  66           H        VAL  66   4.175  -2.137   4.664
  500    HA   VAL  66           HA       VAL  66   5.293  -0.431   2.472
  501    HB   VAL  66           HB       VAL  66   6.053  -0.554   5.410
  502   1HG1  VAL  66          1HG1      VAL  66   6.861   1.834   4.729
  503   2HG1  VAL  66          2HG1      VAL  66   6.780   1.214   3.080
  504   3HG1  VAL  66          3HG1      VAL  66   7.843   0.447   4.261
  505   1HG2  VAL  66          1HG2      VAL  66   3.887   0.882   3.952
  506   2HG2  VAL  66          2HG2      VAL  66   4.792   1.821   5.138
  507   3HG2  VAL  66          3HG2      VAL  66   3.949   0.353   5.632
  508    H    VAL  67           H        VAL  67   7.789  -0.526   2.448
  509    HA   VAL  67           HA       VAL  67   8.647  -3.380   2.747
  510    HB   VAL  67           HB       VAL  67   9.434  -1.227   0.760
  511   1HG1  VAL  67          1HG1      VAL  67  10.418  -3.446  -0.317
  512   2HG1  VAL  67          2HG1      VAL  67  10.469  -3.967   1.367
  513   3HG1  VAL  67          3HG1      VAL  67  11.348  -2.524   0.864
  514   1HG2  VAL  67          1HG2      VAL  67   8.005  -2.235  -0.753
  515   2HG2  VAL  67          2HG2      VAL  67   7.121  -2.573   0.734
  516   3HG2  VAL  67          3HG2      VAL  67   8.141  -3.817   0.012
  517    H    CYS  68           H        CYS  68  10.260  -3.660   4.204
  518    HA   CYS  68           HA       CYS  68  11.783  -1.313   5.186
  519   1HB   CYS  68          2HB       CYS  68  10.678  -2.919   6.738
  520   2HB   CYS  68          1HB       CYS  68  11.671  -4.216   6.076
  521    HG   CYS  68           HG       CYS  68  13.117  -3.471   8.011
  522    H    SER  69           H        SER  69  13.950  -1.049   4.692
  523    HA   SER  69           HA       SER  69  15.205  -3.138   2.961
  524   1HB   SER  69          2HB       SER  69  16.315  -1.291   1.892
  525   2HB   SER  69          1HB       SER  69  14.618  -0.847   2.056
  526    HG   SER  69           HG       SER  69  15.194   0.313   3.937
  527    H    THR  70           H        THR  70  17.267  -3.834   3.432
  528    HA   THR  70           HA       THR  70  18.435  -2.947   6.043
  529    HB   THR  70           HB       THR  70  17.717  -5.332   5.723
  530    HG1  THR  70           1HG      THR  70  19.303  -5.233   7.153
  531   1HG2  THR  70          1HG2      THR  70  20.026  -5.836   3.926
  532   2HG2  THR  70          2HG2      THR  70  18.602  -5.102   3.195
  533   3HG2  THR  70          3HG2      THR  70  18.471  -6.655   4.018
  534    HA   PRO  71           HA       PRO  71  21.832  -1.102   3.979
  535   1HB   PRO  71          2HB       PRO  71  23.874  -2.284   5.624
  536   2HB   PRO  71          1HB       PRO  71  23.182  -0.663   5.735
  537   1HG   PRO  71          2HG       PRO  71  22.779  -2.854   7.526
  538   2HG   PRO  71          1HG       PRO  71  22.042  -1.251   7.597
  539   1HD   PRO  71          2HD       PRO  71  20.797  -3.762   6.877
  540   2HD   PRO  71          1HD       PRO  71  20.033  -2.162   7.020
  541    H    GLN  72           H        GLN  72  21.425  -4.433   3.820
  542    HA   GLN  72           HA       GLN  72  23.930  -4.905   2.297
  543   1HB   GLN  72          2HB       GLN  72  23.140  -6.565   3.925
  544   2HB   GLN  72          1HB       GLN  72  21.579  -6.649   3.117
  545   1HG   GLN  72          2HG       GLN  72  23.107  -8.545   2.527
  546   2HG   GLN  72          1HG       GLN  72  22.598  -7.606   1.128
  547   1HE2  GLN  72          1HE2      GLN  72  25.259  -7.455   3.579
  548   2HE2  GLN  72          2HE2      GLN  72  26.474  -7.100   2.447
  549    H    SER  73           H        SER  73  21.621  -3.085   1.419
  550    HA   SER  73           HA       SER  73  20.546  -2.561  -0.617
  551   1HB   SER  73          2HB       SER  73  22.956  -3.802  -1.187
  552   2HB   SER  73          1HB       SER  73  21.805  -4.776  -2.098
  553    HG   SER  73           HG       SER  73  21.222  -3.026  -3.246
  554    H    GLN  74           H        GLN  74  19.100  -4.134   1.131
  555    HA   GLN  74           HA       GLN  74  17.693  -6.023  -0.714
  556   1HB   GLN  74          2HB       GLN  74  17.875  -6.663   2.182
  557   2HB   GLN  74          1HB       GLN  74  17.927  -7.746   0.797
  558   1HG   GLN  74          2HG       GLN  74  20.225  -6.659   0.299
  559   2HG   GLN  74          1HG       GLN  74  20.157  -6.081   1.961
  560   1HE2  GLN  74          1HE2      GLN  74  20.559  -8.937  -0.059
  561   2HE2  GLN  74          2HE2      GLN  74  20.900 -10.017   1.206
  562    H    TYR  75           H        TYR  75  15.449  -6.577   0.215
  563    HA   TYR  75           HA       TYR  75  14.288  -4.384   1.890
  564   1HB   TYR  75          2HB       TYR  75  13.212  -5.211  -0.814
  565   2HB   TYR  75          1HB       TYR  75  12.637  -3.888   0.190
  566    HD1  TYR  75           1HD      TYR  75  13.633  -1.750   0.092
  567    HD2  TYR  75           2HD      TYR  75  15.581  -5.111  -1.726
  568    HE1  TYR  75           1HE      TYR  75  15.268  -0.231  -0.969
  569    HE2  TYR  75           2HE      TYR  75  17.222  -3.599  -2.781
  570    HH   TYR  75           HH       TYR  75  16.814  -0.460  -3.216
  571    H    TYR  76           H        TYR  76  12.108  -4.883   2.665
  572    HA   TYR  76           HA       TYR  76  10.699  -7.327   2.138
  573   1HB   TYR  76          2HB       TYR  76  11.332  -8.564   4.212
  574   2HB   TYR  76          1HB       TYR  76  12.720  -8.327   3.160
  575    HD1  TYR  76           1HD      TYR  76  11.008  -7.083   6.199
  576    HD2  TYR  76           2HD      TYR  76  14.602  -6.980   3.861
  577    HE1  TYR  76           1HE      TYR  76  12.178  -5.967   8.065
  578    HE2  TYR  76           2HE      TYR  76  15.777  -5.857   5.726
  579    HH   TYR  76           HH       TYR  76  15.154  -4.431   7.701
  580    H    LEU  77           H        LEU  77   8.871  -7.613   3.645
  581    HA   LEU  77           HA       LEU  77   8.176  -5.098   5.120
  582   1HB   LEU  77          2HB       LEU  77   6.558  -5.895   3.455
  583   2HB   LEU  77          1HB       LEU  77   6.593  -7.515   4.149
  584    HG   LEU  77           HG       LEU  77   5.685  -6.572   6.284
  585   1HD1  LEU  77          1HD1      LEU  77   4.947  -4.082   4.785
  586   2HD1  LEU  77          2HD1      LEU  77   6.545  -4.184   5.522
  587   3HD1  LEU  77          3HD1      LEU  77   5.102  -4.333   6.523
  588   1HD2  LEU  77          1HD2      LEU  77   4.267  -7.487   4.336
  589   2HD2  LEU  77          2HD2      LEU  77   3.906  -5.802   3.964
  590   3HD2  LEU  77          3HD2      LEU  77   3.433  -6.482   5.521
  591    H    ALA  78           H        ALA  78   9.470  -8.122   5.451
  592    HA   ALA  78           HA       ALA  78   9.378  -8.099   8.381
  593   1HB   ALA  78          1HB       ALA  78   8.569 -10.616   6.920
  594   2HB   ALA  78          2HB       ALA  78   7.348  -9.393   7.278
  595   3HB   ALA  78          3HB       ALA  78   8.240 -10.162   8.592
  596    H    GLU  79           H        GLU  79  11.537  -8.451   8.836
  597    HA   GLU  79           HA       GLU  79  13.571  -8.990   7.027
  598   1HB   GLU  79          2HB       GLU  79  13.151  -9.330   9.961
  599   2HB   GLU  79          1HB       GLU  79  14.602 -10.062   9.273
  600   1HG   GLU  79          2HG       GLU  79  15.031  -7.819   8.138
  601   2HG   GLU  79          1HG       GLU  79  13.768  -7.158   9.178
  602    H    LYS  80           H        LYS  80  11.271 -11.248   8.252
  603    HA   LYS  80           HA       LYS  80  12.449 -13.752   8.232
  604   1HB   LYS  80          2HB       LYS  80   9.859 -12.553   7.634
  605   2HB   LYS  80          1HB       LYS  80  10.112 -14.032   6.707
  606   1HG   LYS  80          2HG       LYS  80  10.919 -14.170   9.555
  607   2HG   LYS  80          1HG       LYS  80   9.186 -14.004   9.267
  608   1HD   LYS  80          2HD       LYS  80   9.166 -15.963   7.851
  609   2HD   LYS  80          1HD       LYS  80  10.926 -16.071   7.895
  610   1HE   LYS  80          2HE       LYS  80  10.496 -16.162  10.533
  611   2HE   LYS  80          1HE       LYS  80   8.935 -16.814   9.999
  612   1HZ   LYS  80          1HZ       LYS  80  10.200 -18.302   8.488
  613   2HZ   LYS  80          2HZ       LYS  80  10.472 -18.621  10.135
  614   3HZ   LYS  80          3HZ       LYS  80  11.635 -17.780   9.226
  615    H    HIS  81           H        HIS  81  11.632 -11.773   5.385
  616    HA   HIS  81           HA       HIS  81  13.575 -13.306   3.757
  617   1HB   HIS  81          2HB       HIS  81  10.597 -13.124   3.190
  618   2HB   HIS  81          1HB       HIS  81  11.787 -13.699   2.022
  619    HD1  HIS  81           1HD      HIS  81   9.647 -14.863   4.712
  620    HD2  HIS  81           2HD      HIS  81  13.305 -16.057   3.108
  621    HE1  HIS  81           1HE      HIS  81  10.036 -17.237   5.505
  622    H    LEU  82           H        LEU  82  14.483 -11.917   2.197
  623    HA   LEU  82           HA       LEU  82  13.025  -9.421   1.550
  624   1HB   LEU  82          2HB       LEU  82  14.914  -8.068   2.302
  625   2HB   LEU  82          1HB       LEU  82  14.400  -9.112   3.624
  626    HG   LEU  82           HG       LEU  82  16.600  -9.886   1.722
  627   1HD1  LEU  82          1HD1      LEU  82  16.730  -7.685   3.365
  628   2HD1  LEU  82          2HD1      LEU  82  18.124  -8.636   2.860
  629   3HD1  LEU  82          3HD1      LEU  82  17.359  -8.953   4.414
  630   1HD2  LEU  82          1HD2      LEU  82  16.320 -11.818   2.892
  631   2HD2  LEU  82          2HD2      LEU  82  15.319 -11.026   4.108
  632   3HD2  LEU  82          3HD2      LEU  82  17.077 -10.964   4.236
  633    H    PHE  83           H        PHE  83  13.623  -8.545  -0.457
  634    HA   PHE  83           HA       PHE  83  15.563 -10.178  -2.055
  635   1HB   PHE  83          2HB       PHE  83  13.007  -8.701  -2.749
  636   2HB   PHE  83          1HB       PHE  83  14.086  -9.385  -3.970
  637    HD1  PHE  83           1HD      PHE  83  12.087 -10.260  -0.941
  638    HD2  PHE  83           2HD      PHE  83  14.028 -11.688  -4.497
  639    HE1  PHE  83           1HE      PHE  83  11.086 -12.501  -0.588
  640    HE2  PHE  83           2HE      PHE  83  13.025 -13.929  -4.144
  641    HZ   PHE  83           HZ       PHE  83  11.555 -14.336  -2.189
  642    H    SER  84           H        SER  84  15.414  -8.148  -4.241
  643    HA   SER  84           HA       SER  84  17.204  -6.119  -2.961
  644   1HB   SER  84          2HB       SER  84  18.060  -7.716  -4.718
  645   2HB   SER  84          1HB       SER  84  16.956  -6.963  -5.866
  646    HG   SER  84           HG       SER  84  19.271  -5.968  -4.659
  647    H    THR  85           H        THR  85  14.044  -6.334  -4.061
  648    HA   THR  85           HA       THR  85  13.704  -3.451  -4.121
  649    HB   THR  85           HB       THR  85  13.022  -4.660  -6.770
  650    HG1  THR  85           1HG      THR  85  15.641  -3.760  -6.235
  651   1HG2  THR  85          1HG2      THR  85  13.609  -2.413  -7.537
  652   2HG2  THR  85          2HG2      THR  85  14.214  -2.006  -5.931
  653   3HG2  THR  85          3HG2      THR  85  12.496  -2.318  -6.173
  654    H    ILE  86           H        ILE  86  11.368  -2.887  -4.684
  655    HA   ILE  86           HA       ILE  86   9.494  -4.537  -3.352
  656    HB   ILE  86           HB       ILE  86   9.536  -2.165  -5.110
  657   1HG1  ILE  86          2HG1      ILE  86   7.872  -1.457  -3.319
  658   2HG1  ILE  86          1HG1      ILE  86   8.159  -3.021  -2.560
  659   1HG2  ILE  86          1HG2      ILE  86   7.030  -2.170  -5.342
  660   2HG2  ILE  86          2HG2      ILE  86   7.033  -3.860  -4.836
  661   3HG2  ILE  86          3HG2      ILE  86   7.828  -3.387  -6.337
  662   1HD1  ILE  86          1HD1      ILE  86  10.487  -1.270  -3.306
  663   2HD1  ILE  86          2HD1      ILE  86  10.394  -2.523  -2.071
  664   3HD1  ILE  86          3HD1      ILE  86   9.603  -0.970  -1.810
  665    HA   PRO  87           HA       PRO  87   7.988  -5.966  -7.799
  666   1HB   PRO  87          2HB       PRO  87  10.398  -6.127  -9.371
  667   2HB   PRO  87          1HB       PRO  87   8.945  -5.175  -9.691
  668   1HG   PRO  87          2HG       PRO  87  11.524  -4.254  -8.765
  669   2HG   PRO  87          1HG       PRO  87  10.108  -3.296  -9.205
  670   1HD   PRO  87          2HD       PRO  87  11.153  -3.683  -6.594
  671   2HD   PRO  87          1HD       PRO  87   9.602  -2.915  -7.008
  672    H    GLU  88           H        GLU  88  11.332  -6.682  -6.760
  673    HA   GLU  88           HA       GLU  88  11.254  -9.494  -7.385
  674   1HB   GLU  88          2HB       GLU  88  13.190  -7.814  -6.763
  675   2HB   GLU  88          1HB       GLU  88  12.823  -8.302  -5.107
  676   1HG   GLU  88          2HG       GLU  88  14.523  -9.802  -5.859
  677   2HG   GLU  88          1HG       GLU  88  13.016 -10.716  -5.922
  678    H    LEU  89           H        LEU  89  10.438  -7.604  -4.485
  679    HA   LEU  89           HA       LEU  89   9.848  -9.884  -2.790
  680   1HB   LEU  89          2HB       LEU  89   9.629  -6.928  -2.782
  681   2HB   LEU  89          1HB       LEU  89   8.462  -7.762  -1.755
  682    HG   LEU  89           HG       LEU  89  11.356  -8.564  -1.668
  683   1HD1  LEU  89          1HD1      LEU  89  12.023  -6.746  -0.470
  684   2HD1  LEU  89          2HD1      LEU  89  10.469  -6.593   0.350
  685   3HD1  LEU  89          3HD1      LEU  89  10.677  -5.941  -1.276
  686   1HD2  LEU  89          1HD2      LEU  89   9.295  -9.714  -0.515
  687   2HD2  LEU  89          2HD2      LEU  89   9.414  -8.373   0.624
  688   3HD2  LEU  89          3HD2      LEU  89  10.775  -9.474   0.413
  689    H    ILE  90           H        ILE  90   7.678  -7.475  -4.347
  690    HA   ILE  90           HA       ILE  90   5.200  -8.639  -3.778
  691    HB   ILE  90           HB       ILE  90   6.166  -7.267  -6.311
  692   1HG1  ILE  90          2HG1      ILE  90   6.586  -5.917  -4.318
  693   2HG1  ILE  90          1HG1      ILE  90   5.216  -5.237  -5.191
  694   1HG2  ILE  90          1HG2      ILE  90   3.723  -6.560  -6.432
  695   2HG2  ILE  90          2HG2      ILE  90   3.395  -7.787  -5.209
  696   3HG2  ILE  90          3HG2      ILE  90   4.034  -8.260  -6.782
  697   1HD1  ILE  90          1HD1      ILE  90   5.290  -6.606  -2.555
  698   2HD1  ILE  90          2HD1      ILE  90   3.895  -6.948  -3.578
  699   3HD1  ILE  90          3HD1      ILE  90   4.260  -5.286  -3.110
  700    H    ASN  91           H        ASN  91   7.351  -9.393  -6.545
  701    HA   ASN  91           HA       ASN  91   5.630 -11.371  -7.729
  702   1HB   ASN  91          2HB       ASN  91   7.863 -10.064  -8.460
  703   2HB   ASN  91          1HB       ASN  91   8.604 -11.572  -7.921
  704   1HD2  ASN  91          1HD2      ASN  91   8.090 -10.397 -10.740
  705   2HD2  ASN  91          2HD2      ASN  91   7.323 -11.664 -11.569
  706    H    TYR  92           H        TYR  92   8.364 -11.616  -5.442
  707    HA   TYR  92           HA       TYR  92   8.461 -14.445  -5.209
  708   1HB   TYR  92          2HB       TYR  92  10.201 -13.686  -3.985
  709   2HB   TYR  92          1HB       TYR  92   9.501 -12.073  -3.928
  710    HD1  TYR  92           1HD      TYR  92   9.195 -15.449  -2.331
  711    HD2  TYR  92           2HD      TYR  92   8.751 -11.201  -1.891
  712    HE1  TYR  92           1HE      TYR  92   8.689 -15.749   0.077
  713    HE2  TYR  92           2HE      TYR  92   8.244 -11.499   0.514
  714    HH   TYR  92           HH       TYR  92   8.981 -13.937   2.257
  715    H    HIS  93           H        HIS  93   6.091 -12.184  -4.047
  716    HA   HIS  93           HA       HIS  93   5.028 -13.618  -1.819
  717   1HB   HIS  93          2HB       HIS  93   4.604 -11.229  -2.846
  718   2HB   HIS  93          1HB       HIS  93   3.338 -12.054  -3.754
  719    HD1  HIS  93           1HD      HIS  93   2.704  -9.949  -1.511
  720    HD2  HIS  93           2HD      HIS  93   2.752 -14.078  -0.946
  721    HE1  HIS  93           1HE      HIS  93   1.257 -10.411   0.515
  722    H    GLN  94           H        GLN  94   4.281 -13.813  -5.312
  723    HA   GLN  94           HA       GLN  94   3.001 -16.465  -4.802
  724   1HB   GLN  94          2HB       GLN  94   1.354 -14.532  -4.868
  725   2HB   GLN  94          1HB       GLN  94   1.826 -14.286  -6.549
  726   1HG   GLN  94          2HG       GLN  94   1.295 -17.064  -6.233
  727   2HG   GLN  94          1HG       GLN  94  -0.041 -16.192  -5.481
  728   1HE2  GLN  94          1HE2      GLN  94  -1.575 -16.599  -7.190
  729   2HE2  GLN  94          2HE2      GLN  94  -1.401 -15.933  -8.741
  730    H    HIS  95           H        HIS  95   4.093 -14.150  -7.295
  731    HA   HIS  95           HA       HIS  95   4.795 -14.559  -9.541
  732   1HB   HIS  95          2HB       HIS  95   6.912 -15.945  -9.413
  733   2HB   HIS  95          1HB       HIS  95   6.823 -14.632  -8.242
  734    HD1  HIS  95           1HD      HIS  95   6.325 -15.286  -5.754
  735    HD2  HIS  95           2HD      HIS  95   6.905 -18.540  -8.289
  736    HE1  HIS  95           1HE      HIS  95   6.636 -17.303  -4.264
  737    H    ASN  96           H        ASN  96   2.568 -15.790  -9.784
  738    HA   ASN  96           HA       ASN  96   3.118 -18.252 -11.248
  739   1HB   ASN  96          2HB       ASN  96   3.137 -18.832  -8.759
  740   2HB   ASN  96          1HB       ASN  96   1.420 -18.429  -8.747
  741   1HD2  ASN  96          1HD2      ASN  96   0.964 -20.750  -8.256
  742   2HD2  ASN  96          2HD2      ASN  96   1.025 -21.902  -9.502
  743    H    SER  97           H        SER  97   1.856 -15.723 -11.857
  744    HA   SER  97           HA       SER  97  -1.014 -16.533 -12.181
  745   1HB   SER  97          2HB       SER  97  -0.377 -14.475 -10.827
  746   2HB   SER  97          1HB       SER  97   0.223 -13.769 -12.326
  747    HG   SER  97           HG       SER  97  -2.344 -14.131 -11.437
  748    H    ALA  98           H        ALA  98  -1.740 -16.804 -14.265
  749    HA   ALA  98           HA       ALA  98   0.100 -16.004 -16.495
  750   1HB   ALA  98          1HB       ALA  98  -0.677 -17.957 -17.616
  751   2HB   ALA  98          2HB       ALA  98  -2.082 -18.097 -16.559
  752   3HB   ALA  98          3HB       ALA  98  -0.471 -18.462 -15.939
  753    H    GLY  99           H        GLY  99  -1.951 -14.263 -15.236
  754   1HA   GLY  99          2HA       GLY  99  -3.883 -14.029 -17.507
  755   2HA   GLY  99          1HA       GLY  99  -4.213 -13.456 -15.871
  756    H    LEU 100           H        LEU 100  -4.386 -11.258 -16.129
  757    HA   LEU 100           HA       LEU 100  -2.098  -9.859 -17.481
  758   1HB   LEU 100          2HB       LEU 100  -4.919  -9.850 -17.938
  759   2HB   LEU 100          1HB       LEU 100  -4.477  -8.259 -17.325
  760    HG   LEU 100           HG       LEU 100  -4.305  -8.359 -19.791
  761   1HD1  LEU 100          1HD1      LEU 100  -1.786  -8.031 -18.161
  762   2HD1  LEU 100          2HD1      LEU 100  -2.838  -6.779 -18.820
  763   3HD1  LEU 100          3HD1      LEU 100  -1.804  -7.718 -19.897
  764   1HD2  LEU 100          1HD2      LEU 100  -3.569 -10.281 -20.717
  765   2HD2  LEU 100          2HD2      LEU 100  -2.980 -10.864 -19.161
  766   3HD2  LEU 100          3HD2      LEU 100  -1.947  -9.854 -20.173
  767    H    ILE 101           H        ILE 101  -3.661 -10.380 -14.514
  768    HA   ILE 101           HA       ILE 101  -3.308  -7.707 -13.380
  769    HB   ILE 101           HB       ILE 101  -3.800 -10.431 -12.129
  770   1HG1  ILE 101          2HG1      ILE 101  -5.535  -9.835 -13.764
  771   2HG1  ILE 101          1HG1      ILE 101  -6.180  -9.707 -12.129
  772   1HG2  ILE 101          1HG2      ILE 101  -4.819  -7.980 -10.834
  773   2HG2  ILE 101          2HG2      ILE 101  -3.062  -8.129 -10.839
  774   3HG2  ILE 101          3HG2      ILE 101  -4.052  -9.398 -10.118
  775   1HD1  ILE 101          1HD1      ILE 101  -5.166  -7.182 -12.530
  776   2HD1  ILE 101          2HD1      ILE 101  -6.853  -7.634 -12.771
  777   3HD1  ILE 101          3HD1      ILE 101  -5.745  -7.602 -14.142
  778    H    SER 102           H        SER 102  -1.344  -6.934 -12.728
  779    HA   SER 102           HA       SER 102   0.973  -8.731 -12.477
  780   1HB   SER 102          2HB       SER 102   0.988  -6.476 -13.575
  781   2HB   SER 102          1HB       SER 102   0.660  -5.748 -12.006
  782    HG   SER 102           HG       SER 102   2.914  -5.833 -12.573
  783    H    ARG 103           H        ARG 103  -0.401  -9.753 -10.537
  784    HA   ARG 103           HA       ARG 103  -0.593 -10.094  -8.206
  785   1HB   ARG 103          2HB       ARG 103   2.053  -8.934  -8.845
  786   2HB   ARG 103          1HB       ARG 103   1.593  -8.832  -7.146
  787   1HG   ARG 103          2HG       ARG 103   0.866 -11.431  -8.014
  788   2HG   ARG 103          1HG       ARG 103   2.489 -11.134  -8.636
  789   1HD   ARG 103          2HD       ARG 103   3.155 -11.780  -6.540
  790   2HD   ARG 103          1HD       ARG 103   2.677 -10.137  -6.069
  791    HE   ARG 103           HE       ARG 103   1.174 -12.577  -5.496
  792   1HH1  ARG 103          1HH1      ARG 103   1.489  -9.795  -4.050
  793   2HH1  ARG 103          2HH1      ARG 103  -0.168  -9.288  -4.056
  794   1HH2  ARG 103          1HH2      ARG 103  -1.164 -11.666  -6.375
  795   2HH2  ARG 103          2HH2      ARG 103  -1.670 -10.347  -5.372
  796    H    LEU 104           H        LEU 104  -2.240  -8.021  -9.028
  797    HA   LEU 104           HA       LEU 104  -2.054  -6.146  -6.707
  798   1HB   LEU 104          2HB       LEU 104  -1.128  -5.251  -8.934
  799   2HB   LEU 104          1HB       LEU 104  -2.793  -5.291  -9.514
  800    HG   LEU 104           HG       LEU 104  -2.464  -4.022  -6.872
  801   1HD1  LEU 104          1HD1      LEU 104  -1.288  -2.755  -9.365
  802   2HD1  LEU 104          2HD1      LEU 104  -0.394  -3.236  -7.923
  803   3HD1  LEU 104          3HD1      LEU 104  -1.562  -1.918  -7.837
  804   1HD2  LEU 104          1HD2      LEU 104  -3.728  -2.249  -8.527
  805   2HD2  LEU 104          2HD2      LEU 104  -4.552  -3.550  -7.668
  806   3HD2  LEU 104          3HD2      LEU 104  -4.066  -3.772  -9.349
  807    H    LYS 105           H        LYS 105  -4.214  -5.008  -6.388
  808    HA   LYS 105           HA       LYS 105  -6.431  -6.915  -6.988
  809   1HB   LYS 105          2HB       LYS 105  -5.963  -4.776  -4.900
  810   2HB   LYS 105          1HB       LYS 105  -7.490  -5.645  -5.061
  811   1HG   LYS 105          2HG       LYS 105  -5.887  -7.766  -5.012
  812   2HG   LYS 105          1HG       LYS 105  -4.824  -6.651  -4.152
  813   1HD   LYS 105          2HD       LYS 105  -6.261  -6.449  -2.351
  814   2HD   LYS 105          1HD       LYS 105  -7.695  -6.773  -3.325
  815   1HE   LYS 105          2HE       LYS 105  -6.907  -9.167  -3.554
  816   2HE   LYS 105          1HE       LYS 105  -5.641  -8.793  -2.367
  817   1HZ   LYS 105          1HZ       LYS 105  -8.514  -8.213  -1.909
  818   2HZ   LYS 105          2HZ       LYS 105  -7.251  -8.162  -0.774
  819   3HZ   LYS 105          3HZ       LYS 105  -7.775  -9.653  -1.398
  820    H    TYR 106           H        TYR 106  -6.869  -3.481  -6.140
  821    HA   TYR 106           HA       TYR 106  -8.078  -3.096  -8.861
  822   1HB   TYR 106          2HB       TYR 106  -9.585  -3.341  -6.781
  823   2HB   TYR 106          1HB       TYR 106  -8.979  -1.750  -6.315
  824    HD1  TYR 106           1HD      TYR 106  -8.953   0.028  -8.322
  825    HD2  TYR 106           2HD      TYR 106 -11.514  -3.408  -8.064
  826    HE1  TYR 106           1HE      TYR 106 -10.534   1.091  -9.909
  827    HE2  TYR 106           2HE      TYR 106 -13.099  -2.343  -9.645
  828    HH   TYR 106           HH       TYR 106 -13.652   0.116 -10.322
  829    HA   PRO 107           HA       PRO 107  -4.944   0.150  -8.865
  830   1HB   PRO 107          2HB       PRO 107  -5.923   0.978 -11.429
  831   2HB   PRO 107          1HB       PRO 107  -4.458   0.061 -11.065
  832   1HG   PRO 107          2HG       PRO 107  -6.824  -0.900 -12.338
  833   2HG   PRO 107          1HG       PRO 107  -5.396  -1.833 -11.877
  834   1HD   PRO 107          2HD       PRO 107  -8.037  -1.827 -10.638
  835   2HD   PRO 107          1HD       PRO 107  -6.649  -2.886 -10.286
  836    H    VAL 108           H        VAL 108  -6.570   1.043  -7.173
  837    HA   VAL 108           HA       VAL 108  -7.976   3.431  -8.317
  838    HB   VAL 108           HB       VAL 108  -8.692   1.331  -6.353
  839   1HG1  VAL 108          1HG1      VAL 108  -9.253   4.257  -5.782
  840   2HG1  VAL 108          2HG1      VAL 108  -8.434   3.104  -4.728
  841   3HG1  VAL 108          3HG1      VAL 108 -10.154   2.928  -5.053
  842   1HG2  VAL 108          1HG2      VAL 108 -10.721   1.492  -7.410
  843   2HG2  VAL 108          2HG2      VAL 108  -9.738   2.261  -8.654
  844   3HG2  VAL 108          3HG2      VAL 108 -10.647   3.249  -7.513
  845    H    SER 109           H        SER 109  -6.492   5.100  -7.966
  846    HA   SER 109           HA       SER 109  -5.315   5.269  -5.222
  847   1HB   SER 109          2HB       SER 109  -4.090   5.719  -7.941
  848   2HB   SER 109          1HB       SER 109  -3.326   6.278  -6.452
  849    HG   SER 109           HG       SER 109  -4.164   3.607  -6.925
  850    H    GLN 110           H        GLN 110  -4.559   7.475  -4.700
  851    HA   GLN 110           HA       GLN 110  -5.153   9.693  -4.245
  852   1HB   GLN 110          2HB       GLN 110  -5.525   9.835  -7.240
  853   2HB   GLN 110          1HB       GLN 110  -4.829  11.050  -6.170
  854   1HG   GLN 110          2HG       GLN 110  -3.181   8.899  -5.715
  855   2HG   GLN 110          1HG       GLN 110  -3.562   8.704  -7.426
  856   1HE2  GLN 110          1HE2      GLN 110  -1.184   9.959  -5.626
  857   2HE2  GLN 110          2HE2      GLN 110  -0.774  11.332  -6.534
  858    H    GLN 111           H        GLN 111  -6.883  11.465  -5.507
  859    HA   GLN 111           HA       GLN 111  -9.438  10.717  -4.485
  860   1HB   GLN 111          2HB       GLN 111 -10.133  12.822  -5.592
  861   2HB   GLN 111          1HB       GLN 111  -8.588  13.019  -4.760
  862   1HG   GLN 111          2HG       GLN 111  -7.356  12.925  -6.789
  863   2HG   GLN 111          1HG       GLN 111  -8.731  12.281  -7.688
  864   1HE2  GLN 111          1HE2      GLN 111  -7.813  15.217  -5.797
  865   2HE2  GLN 111          2HE2      GLN 111  -8.694  16.294  -6.770
  866    H    ASN 112           H        ASN 112 -10.966  11.722  -6.896
  867    HA   ASN 112           HA       ASN 112 -12.069  10.826  -8.779
  868   1HB   ASN 112          2HB       ASN 112  -9.383  10.462  -9.176
  869   2HB   ASN 112          1HB       ASN 112  -9.957   8.795  -9.243
  870   1HD2  ASN 112          1HD2      ASN 112 -11.361   8.187 -11.013
  871   2HD2  ASN 112          2HD2      ASN 112 -11.643   9.214 -12.335
  872    H    LYS 113           H        LYS 113 -13.485   9.948  -7.003
  873    HA   LYS 113           HA       LYS 113 -13.109   7.147  -6.234
  874   1HB   LYS 113          2HB       LYS 113 -15.544   8.893  -5.824
  875   2HB   LYS 113          1HB       LYS 113 -14.987   7.562  -4.814
  876   1HG   LYS 113          2HG       LYS 113 -13.623  10.251  -5.165
  877   2HG   LYS 113          1HG       LYS 113 -14.441   9.670  -3.719
  878   1HD   LYS 113          2HD       LYS 113 -12.773   8.038  -3.294
  879   2HD   LYS 113          1HD       LYS 113 -12.110   8.171  -4.920
  880   1HE   LYS 113          2HE       LYS 113 -10.634   9.349  -3.353
  881   2HE   LYS 113          1HE       LYS 113 -11.441  10.543  -4.389
  882   1HZ   LYS 113          1HZ       LYS 113 -12.415   9.667  -1.721
  883   2HZ   LYS 113          2HZ       LYS 113 -13.131  10.846  -2.713
  884   3HZ   LYS 113          3HZ       LYS 113 -11.603  11.124  -2.023
  885    H    ASN 114           H        ASN 114 -13.167   6.997  -8.898
  886    HA   ASN 114           HA       ASN 114 -15.399   5.333  -9.533
  887   1HB   ASN 114          2HB       ASN 114 -15.879   8.130  -9.619
  888   2HB   ASN 114          1HB       ASN 114 -15.823   7.567 -11.283
  889   1HD2  ASN 114          1HD2      ASN 114 -18.173   8.352  -9.419
  890   2HD2  ASN 114          2HD2      ASN 114 -19.243   7.041  -9.553
  891    H    ALA 115           H        ALA 115 -15.550   5.649 -12.275
  892    HA   ALA 115           HA       ALA 115 -13.151   6.233 -13.677
  893   1HB   ALA 115          1HB       ALA 115 -11.868   4.624 -12.653
  894   2HB   ALA 115          2HB       ALA 115 -12.642   3.568 -13.834
  895   3HB   ALA 115          3HB       ALA 115 -13.272   3.663 -12.189
  896    HA   PRO 116           HA       PRO 116 -15.833   5.281 -17.045
  897   1HB   PRO 116          2HB       PRO 116 -13.724   4.285 -18.731
  898   2HB   PRO 116          1HB       PRO 116 -14.469   5.887 -18.753
  899   1HG   PRO 116          2HG       PRO 116 -11.835   5.194 -17.866
  900   2HG   PRO 116          1HG       PRO 116 -12.597   6.787 -17.858
  901   1HD   PRO 116          2HD       PRO 116 -12.015   5.080 -15.595
  902   2HD   PRO 116          1HD       PRO 116 -12.747   6.704 -15.585
  903    H    SER 117           H        SER 117 -13.372   2.850 -16.214
  904    HA   SER 117           HA       SER 117 -15.330   0.700 -16.965
  905   1HB   SER 117          2HB       SER 117 -13.234  -0.646 -17.351
  906   2HB   SER 117          1HB       SER 117 -13.383   0.746 -18.419
  907    HG   SER 117           HG       SER 117 -11.295   0.495 -17.388
  908    H    THR 118           H        THR 118 -16.140   0.964 -14.685
  909    HA   THR 118           HA       THR 118 -14.309   0.243 -12.494
  910    HB   THR 118           HB       THR 118 -16.597   0.378 -11.264
  911    HG1  THR 118           1HG      THR 118 -18.106   1.597 -12.579
  912   1HG2  THR 118          1HG2      THR 118 -16.196   2.608 -10.935
  913   2HG2  THR 118          2HG2      THR 118 -16.100   2.952 -12.662
  914   3HG2  THR 118          3HG2      THR 118 -14.722   2.233 -11.828
  Start of MODEL   20
    1    H    THR   1           1H       THR   1  20.110  -4.967 -11.581
    2    HA   THR   1           HA       THR   1  19.643  -4.184  -9.365
    3    HB   THR   1           HB       THR   1  19.279  -1.615  -9.258
    4    HG1  THR   1           1HG      THR   1  20.997  -1.743 -11.501
    5   1HG2  THR   1          1HG2      THR   1  22.144  -2.290  -9.801
    6   2HG2  THR   1          2HG2      THR   1  21.311  -3.122  -8.488
    7   3HG2  THR   1          3HG2      THR   1  21.447  -1.363  -8.472
    8    H    GLU   2           H        GLU   2  17.614  -5.121  -9.552
    9    HA   GLU   2           HA       GLU   2  15.651  -4.437 -11.541
   10   1HB   GLU   2          2HB       GLU   2  15.635  -5.860  -8.872
   11   2HB   GLU   2          1HB       GLU   2  14.171  -5.701  -9.842
   12   1HG   GLU   2          2HG       GLU   2  14.837  -7.316 -11.272
   13   2HG   GLU   2          1HG       GLU   2  16.435  -6.592 -11.452
   14    H    ALA   3           H        ALA   3  13.967  -2.943 -11.460
   15    HA   ALA   3           HA       ALA   3  13.309  -1.547  -8.941
   16   1HB   ALA   3          1HB       ALA   3  13.939   0.648  -9.867
   17   2HB   ALA   3          2HB       ALA   3  14.486  -0.126 -11.354
   18   3HB   ALA   3          3HB       ALA   3  15.339  -0.424  -9.840
   19    H    GLU   4           H        GLU   4  11.936   0.611 -10.061
   20    HA   GLU   4           HA       GLU   4  10.110  -0.486 -12.124
   21   1HB   GLU   4          2HB       GLU   4   8.231   0.282 -10.395
   22   2HB   GLU   4          1HB       GLU   4   8.936  -1.330 -10.311
   23   1HG   GLU   4          2HG       GLU   4  10.093  -0.873  -8.378
   24   2HG   GLU   4          1HG       GLU   4  10.348   0.819  -8.805
   25    H    ASP   5           H        ASP   5   9.288   2.120  -9.876
   26    HA   ASP   5           HA       ASP   5   8.991   4.428 -10.244
   27   1HB   ASP   5          2HB       ASP   5  11.514   3.598 -11.266
   28   2HB   ASP   5          1HB       ASP   5  10.854   4.786 -12.386
   29    H    SER   6           H        SER   6   7.034   4.846 -11.208
   30    HA   SER   6           HA       SER   6   6.893   5.265 -14.088
   31   1HB   SER   6          2HB       SER   6   5.814   2.794 -12.769
   32   2HB   SER   6          1HB       SER   6   4.941   3.474 -14.139
   33    HG   SER   6           HG       SER   6   6.785   3.259 -15.380
   34    H    ILE   7           H        ILE   7   6.291   7.321 -12.855
   35    HA   ILE   7           HA       ILE   7   3.732   7.403 -11.445
   36    HB   ILE   7           HB       ILE   7   5.634   8.872 -10.916
   37   1HG1  ILE   7          2HG1      ILE   7   3.352  10.466 -12.123
   38   2HG1  ILE   7          1HG1      ILE   7   3.285   9.671 -10.550
   39   1HG2  ILE   7          1HG2      ILE   7   6.773   9.235 -12.933
   40   2HG2  ILE   7          2HG2      ILE   7   5.989  10.790 -12.657
   41   3HG2  ILE   7          3HG2      ILE   7   5.296   9.646 -13.805
   42   1HD1  ILE   7          1HD1      ILE   7   5.249  11.006  -9.819
   43   2HD1  ILE   7          2HD1      ILE   7   3.886  12.030 -10.265
   44   3HD1  ILE   7          3HD1      ILE   7   5.243  11.835 -11.373
   45    H    GLU   8           H        GLU   8   4.439   7.124 -14.711
   46    HA   GLU   8           HA       GLU   8   2.451   9.005 -15.725
   47   1HB   GLU   8          2HB       GLU   8   4.168   6.817 -16.915
   48   2HB   GLU   8          1HB       GLU   8   3.077   7.809 -17.883
   49   1HG   GLU   8          2HG       GLU   8   4.486   9.660 -16.332
   50   2HG   GLU   8          1HG       GLU   8   5.703   8.473 -16.802
   51    H    MET   9           H        MET   9   2.648   5.518 -15.088
   52    HA   MET   9           HA       MET   9  -0.236   5.314 -15.802
   53   1HB   MET   9          2HB       MET   9   1.871   3.151 -15.993
   54   2HB   MET   9          1HB       MET   9   0.244   3.109 -16.664
   55   1HG   MET   9          2HG       MET   9   0.823   4.347 -18.486
   56   2HG   MET   9          1HG       MET   9   1.876   5.409 -17.558
   57   1HE   MET   9          1HE       MET   9   3.859   2.947 -16.137
   58   2HE   MET   9          2HE       MET   9   3.868   4.683 -16.435
   59   3HE   MET   9          3HE       MET   9   5.119   3.667 -17.146
   60    H    TYR  10           H        TYR  10  -0.285   2.543 -14.852
   61    HA   TYR  10           HA       TYR  10  -0.856   1.377 -12.906
   62   1HB   TYR  10          2HB       TYR  10   1.498   3.021 -11.930
   63   2HB   TYR  10          1HB       TYR  10   0.890   1.549 -11.172
   64    HD1  TYR  10           1HD      TYR  10   3.493   2.634 -13.067
   65    HD2  TYR  10           2HD      TYR  10   0.384  -0.327 -13.226
   66    HE1  TYR  10           1HE      TYR  10   4.874   1.266 -14.609
   67    HE2  TYR  10           2HE      TYR  10   1.765  -1.694 -14.767
   68    HH   TYR  10           HH       TYR  10   5.086  -1.028 -15.340
   69    H    GLU  11           H        GLU  11  -2.891   2.242 -12.348
   70    HA   GLU  11           HA       GLU  11  -3.389   4.805 -11.180
   71   1HB   GLU  11          2HB       GLU  11  -4.922   2.818 -12.101
   72   2HB   GLU  11          1HB       GLU  11  -4.949   2.365 -10.402
   73   1HG   GLU  11          2HG       GLU  11  -6.849   3.821 -10.909
   74   2HG   GLU  11          1HG       GLU  11  -5.734   4.636  -9.818
   75    H    TRP  12           H        TRP  12  -2.827   1.610  -9.713
   76    HA   TRP  12           HA       TRP  12  -3.022   2.404  -6.990
   77   1HB   TRP  12          2HB       TRP  12  -1.769   0.290  -6.617
   78   2HB   TRP  12          1HB       TRP  12  -3.059   0.081  -7.798
   79    HD1  TRP  12           HD       TRP  12  -2.390  -0.411 -10.288
   80    HE1  TRP  12           1HE      TRP  12  -0.163  -1.052 -11.416
   81    HE3  TRP  12           3HE      TRP  12   0.861   0.670  -6.502
   82    HZ2  TRP  12           2HZ      TRP  12   2.627  -1.103 -10.793
   83    HZ3  TRP  12           3HZ      TRP  12   3.295   0.313  -6.795
   84    HH2  TRP  12           HH       TRP  12   4.181  -0.572  -8.934
   85    H    TYR  13           H        TYR  13  -0.574   3.027  -9.356
   86    HA   TYR  13           HA       TYR  13   1.615   3.384  -7.436
   87   1HB   TYR  13          2HB       TYR  13   1.737   2.620  -9.873
   88   2HB   TYR  13          1HB       TYR  13   1.417   4.295 -10.322
   89    HD1  TYR  13           1HD      TYR  13   3.197   5.812 -10.476
   90    HD2  TYR  13           2HD      TYR  13   3.680   2.225  -8.170
   91    HE1  TYR  13           1HE      TYR  13   5.589   6.364 -10.117
   92    HE2  TYR  13           2HE      TYR  13   6.070   2.773  -7.810
   93    HH   TYR  13           HH       TYR  13   7.541   4.682  -7.840
   94    H    SER  14           H        SER  14   2.208   5.308  -6.480
   95    HA   SER  14           HA       SER  14   1.121   7.874  -7.524
   96   1HB   SER  14          2HB       SER  14   0.857   7.165  -4.607
   97   2HB   SER  14          1HB       SER  14  -0.016   8.389  -5.525
   98    HG   SER  14           HG       SER  14  -1.190   6.798  -6.512
   99    H    LYS  15           H        LYS  15   2.707   9.419  -7.373
  100    HA   LYS  15           HA       LYS  15   5.199   8.766  -5.946
  101   1HB   LYS  15          2HB       LYS  15   4.314  10.339  -8.203
  102   2HB   LYS  15          1HB       LYS  15   5.286  11.339  -7.124
  103   1HG   LYS  15          2HG       LYS  15   6.655  10.129  -8.844
  104   2HG   LYS  15          1HG       LYS  15   7.109   9.733  -7.189
  105   1HD   LYS  15          2HD       LYS  15   4.987   7.993  -8.206
  106   2HD   LYS  15          1HD       LYS  15   6.459   7.895  -9.171
  107   1HE   LYS  15          2HE       LYS  15   7.531   6.741  -7.539
  108   2HE   LYS  15          1HE       LYS  15   7.062   7.933  -6.314
  109   1HZ   LYS  15          1HZ       LYS  15   6.065   5.484  -6.352
  110   2HZ   LYS  15          2HZ       LYS  15   4.940   6.234  -7.379
  111   3HZ   LYS  15          3HZ       LYS  15   5.176   6.817  -5.801
  112    H    HIS  16           H        HIS  16   5.407   9.330  -3.862
  113    HA   HIS  16           HA       HIS  16   5.249  10.541  -1.856
  114   1HB   HIS  16          2HB       HIS  16   4.904  12.722  -3.934
  115   2HB   HIS  16          1HB       HIS  16   5.204  13.028  -2.224
  116    HD1  HIS  16           1HD      HIS  16   7.612  13.380  -1.728
  117    HD2  HIS  16           2HD      HIS  16   7.088  10.773  -4.938
  118    HE1  HIS  16           1HE      HIS  16   9.932  12.730  -2.509
  119    H    MET  17           H        MET  17   2.823   9.260  -2.714
  120    HA   MET  17           HA       MET  17   0.608  11.164  -2.433
  121   1HB   MET  17          2HB       MET  17   0.418   9.150  -3.802
  122   2HB   MET  17          1HB       MET  17   0.828   8.133  -2.422
  123   1HG   MET  17          2HG       MET  17  -1.220   9.012  -1.254
  124   2HG   MET  17          1HG       MET  17  -1.654   9.844  -2.747
  125   1HE   MET  17          1HE       MET  17  -1.082   6.716  -0.833
  126   2HE   MET  17          2HE       MET  17  -0.011   6.213  -2.138
  127   3HE   MET  17          3HE       MET  17  -1.530   5.360  -1.877
  128    H    THR  18           H        THR  18  -0.841  11.173  -0.567
  129    HA   THR  18           HA       THR  18   0.593  10.806   1.978
  130    HB   THR  18           HB       THR  18  -2.257  11.706   1.584
  131    HG1  THR  18           1HG      THR  18   0.138  13.144   1.109
  132   1HG2  THR  18          1HG2      THR  18  -1.189  13.374   3.381
  133   2HG2  THR  18          2HG2      THR  18  -0.098  12.008   3.616
  134   3HG2  THR  18          3HG2      THR  18  -1.835  11.800   3.843
  135    H    ARG  19           H        ARG  19   0.302   9.108   3.342
  136    HA   ARG  19           HA       ARG  19  -0.993   6.693   2.793
  137   1HB   ARG  19          2HB       ARG  19  -0.733   6.301   5.183
  138   2HB   ARG  19          1HB       ARG  19   0.627   7.286   4.643
  139   1HG   ARG  19          2HG       ARG  19  -0.695   9.337   5.360
  140   2HG   ARG  19          1HG       ARG  19  -1.865   8.241   6.097
  141   1HD   ARG  19          2HD       ARG  19  -0.050   7.268   7.502
  142   2HD   ARG  19          1HD       ARG  19   1.090   8.434   6.800
  143    HE   ARG  19           HE       ARG  19  -0.754  10.159   7.620
  144   1HH1  ARG  19          1HH1      ARG  19   1.529   8.883   9.413
  145   2HH1  ARG  19          2HH1      ARG  19   0.645   8.714  10.894
  146   1HH2  ARG  19          1HH2      ARG  19  -2.448   9.244   9.419
  147   2HH2  ARG  19          2HH2      ARG  19  -1.606   8.920  10.897
  148    H    SER  20           H        SER  20  -2.289   9.577   4.357
  149    HA   SER  20           HA       SER  20  -4.845   8.452   5.077
  150   1HB   SER  20          2HB       SER  20  -4.594  10.333   6.302
  151   2HB   SER  20          1HB       SER  20  -3.302  10.900   5.254
  152    HG   SER  20           HG       SER  20  -6.099  11.134   4.762
  153    H    GLN  21           H        GLN  21  -3.616  10.268   2.277
  154    HA   GLN  21           HA       GLN  21  -6.135  10.690   0.979
  155   1HB   GLN  21          2HB       GLN  21  -3.243  10.494   0.134
  156   2HB   GLN  21          1HB       GLN  21  -4.514  10.740  -1.066
  157   1HG   GLN  21          2HG       GLN  21  -4.524  12.486   1.359
  158   2HG   GLN  21          1HG       GLN  21  -3.318  12.806   0.114
  159   1HE2  GLN  21          1HE2      GLN  21  -6.772  12.858   0.824
  160   2HE2  GLN  21          2HE2      GLN  21  -7.241  13.639  -0.608
  161    H    ALA  22           H        ALA  22  -3.891   7.980   1.124
  162    HA   ALA  22           HA       ALA  22  -5.138   6.421  -0.963
  163   1HB   ALA  22          1HB       ALA  22  -3.070   5.536  -0.563
  164   2HB   ALA  22          2HB       ALA  22  -3.861   4.662   0.748
  165   3HB   ALA  22          3HB       ALA  22  -3.028   6.182   1.077
  166    H    GLU  23           H        GLU  23  -5.375   6.492   2.588
  167    HA   GLU  23           HA       GLU  23  -7.253   4.373   2.909
  168   1HB   GLU  23          2HB       GLU  23  -6.732   6.940   4.444
  169   2HB   GLU  23          1HB       GLU  23  -7.765   5.644   5.045
  170   1HG   GLU  23          2HG       GLU  23  -5.445   4.321   4.265
  171   2HG   GLU  23          1HG       GLU  23  -4.850   5.813   4.991
  172    H    GLN  24           H        GLN  24  -7.834   7.911   2.611
  173    HA   GLN  24           HA       GLN  24 -10.688   7.647   2.592
  174   1HB   GLN  24          2HB       GLN  24 -10.563  10.007   1.701
  175   2HB   GLN  24          1HB       GLN  24  -9.631   9.739   3.170
  176   1HG   GLN  24          2HG       GLN  24  -7.888  10.639   2.059
  177   2HG   GLN  24          1HG       GLN  24  -7.825   9.131   1.156
  178   1HE2  GLN  24          1HE2      GLN  24  -9.273  12.408   1.082
  179   2HE2  GLN  24          2HE2      GLN  24  -9.467  12.456  -0.604
  180    H    LEU  25           H        LEU  25  -8.349   8.023  -0.151
  181    HA   LEU  25           HA       LEU  25 -10.427   7.847  -2.131
  182   1HB   LEU  25          2HB       LEU  25  -8.649   7.807  -3.679
  183   2HB   LEU  25          1HB       LEU  25  -7.951   8.651  -2.305
  184    HG   LEU  25           HG       LEU  25  -7.177   6.256  -1.564
  185   1HD1  LEU  25          1HD1      LEU  25  -7.737   4.605  -2.999
  186   2HD1  LEU  25          2HD1      LEU  25  -6.678   5.355  -4.194
  187   3HD1  LEU  25          3HD1      LEU  25  -8.392   5.769  -4.150
  188   1HD2  LEU  25          1HD2      LEU  25  -5.104   6.562  -2.854
  189   2HD2  LEU  25          2HD2      LEU  25  -5.694   8.123  -2.287
  190   3HD2  LEU  25          3HD2      LEU  25  -5.944   7.642  -3.957
  191    H    LEU  26           H        LEU  26  -8.635   5.468  -0.268
  192    HA   LEU  26           HA       LEU  26  -9.378   3.151  -1.847
  193   1HB   LEU  26          2HB       LEU  26  -8.267   3.785   0.848
  194   2HB   LEU  26          1HB       LEU  26  -9.041   2.220   0.676
  195    HG   LEU  26           HG       LEU  26  -6.898   3.247  -1.202
  196   1HD1  LEU  26          1HD1      LEU  26  -5.282   2.356   0.130
  197   2HD1  LEU  26          2HD1      LEU  26  -6.284   0.979   0.585
  198   3HD1  LEU  26          3HD1      LEU  26  -6.479   2.523   1.413
  199   1HD2  LEU  26          1HD2      LEU  26  -7.506   0.357  -0.869
  200   2HD2  LEU  26          2HD2      LEU  26  -7.116   1.262  -2.330
  201   3HD2  LEU  26          3HD2      LEU  26  -8.749   1.318  -1.669
  202    H    LYS  27           H        LYS  27 -10.552   4.200   1.383
  203    HA   LYS  27           HA       LYS  27 -12.901   2.681   1.542
  204   1HB   LYS  27          2HB       LYS  27 -11.648   4.635   2.977
  205   2HB   LYS  27          1HB       LYS  27 -13.073   5.506   2.411
  206   1HG   LYS  27          2HG       LYS  27 -13.358   2.757   3.603
  207   2HG   LYS  27          1HG       LYS  27 -13.228   4.170   4.652
  208   1HD   LYS  27          2HD       LYS  27 -15.250   5.054   3.948
  209   2HD   LYS  27          1HD       LYS  27 -15.161   4.272   2.370
  210   1HE   LYS  27          2HE       LYS  27 -16.867   3.096   3.590
  211   2HE   LYS  27          1HE       LYS  27 -15.439   2.045   3.639
  212   1HZ   LYS  27          1HZ       LYS  27 -14.815   3.184   5.742
  213   2HZ   LYS  27          2HZ       LYS  27 -16.246   2.275   5.860
  214   3HZ   LYS  27          3HZ       LYS  27 -16.320   3.967   5.726
  215    H    GLN  28           H        GLN  28 -12.436   5.838  -0.045
  216    HA   GLN  28           HA       GLN  28 -15.182   6.203  -0.834
  217   1HB   GLN  28          2HB       GLN  28 -13.169   7.838  -0.678
  218   2HB   GLN  28          1HB       GLN  28 -12.779   7.278  -2.304
  219   1HG   GLN  28          2HG       GLN  28 -14.161   9.243  -2.534
  220   2HG   GLN  28          1HG       GLN  28 -15.153   7.851  -2.968
  221   1HE2  GLN  28          1HE2      GLN  28 -17.226   8.393  -2.215
  222   2HE2  GLN  28          2HE2      GLN  28 -17.567   8.903  -0.632
  223    H    GLU  29           H        GLU  29 -12.372   4.764  -2.549
  224    HA   GLU  29           HA       GLU  29 -13.610   4.360  -5.080
  225   1HB   GLU  29          2HB       GLU  29 -11.158   3.968  -4.147
  226   2HB   GLU  29          1HB       GLU  29 -11.740   2.327  -3.871
  227   1HG   GLU  29          2HG       GLU  29 -10.753   2.350  -6.056
  228   2HG   GLU  29          1HG       GLU  29 -12.500   2.323  -6.301
  229    H    GLY  30           H        GLY  30 -13.723   2.507  -2.073
  230   1HA   GLY  30          2HA       GLY  30 -15.386   1.043  -1.314
  231   2HA   GLY  30          1HA       GLY  30 -16.264   1.372  -2.803
  232    H    LYS  31           H        LYS  31 -13.030   0.336  -3.285
  233    HA   LYS  31           HA       LYS  31 -14.013  -2.243  -4.366
  234   1HB   LYS  31          2HB       LYS  31 -11.246  -0.999  -4.354
  235   2HB   LYS  31          1HB       LYS  31 -11.823  -2.275  -5.426
  236   1HG   LYS  31          2HG       LYS  31 -12.722   0.620  -5.351
  237   2HG   LYS  31          1HG       LYS  31 -11.922  -0.215  -6.678
  238   1HD   LYS  31          2HD       LYS  31 -14.700  -0.829  -5.624
  239   2HD   LYS  31          1HD       LYS  31 -14.333   0.017  -7.126
  240   1HE   LYS  31          2HE       LYS  31 -13.434  -1.935  -8.142
  241   2HE   LYS  31          1HE       LYS  31 -13.281  -2.772  -6.585
  242   1HZ   LYS  31          1HZ       LYS  31 -15.285  -3.420  -7.890
  243   2HZ   LYS  31          2HZ       LYS  31 -15.864  -1.834  -7.706
  244   3HZ   LYS  31          3HZ       LYS  31 -15.632  -2.822  -6.342
  245    H    GLU  32           H        GLU  32 -14.061  -3.963  -2.923
  246    HA   GLU  32           HA       GLU  32 -12.635  -3.973  -0.437
  247   1HB   GLU  32          2HB       GLU  32 -13.250  -6.441  -0.478
  248   2HB   GLU  32          1HB       GLU  32 -14.589  -5.304  -0.617
  249   1HG   GLU  32          2HG       GLU  32 -13.453  -5.968  -3.227
  250   2HG   GLU  32          1HG       GLU  32 -14.023  -7.403  -2.374
  251    H    GLY  33           H        GLY  33 -10.425  -3.725  -0.674
  252   1HA   GLY  33          2HA       GLY  33  -8.404  -5.136  -0.639
  253   2HA   GLY  33          1HA       GLY  33  -9.027  -5.916  -2.090
  254    H    GLY  34           H        GLY  34  -9.470  -2.484  -1.935
  255   1HA   GLY  34          2HA       GLY  34  -8.200  -1.886  -4.337
  256   2HA   GLY  34          1HA       GLY  34  -8.358  -0.715  -3.024
  257    H    PHE  35           H        PHE  35  -6.080  -1.087  -4.861
  258    HA   PHE  35           HA       PHE  35  -3.985  -1.639  -2.790
  259   1HB   PHE  35          2HB       PHE  35  -4.398  -3.569  -4.295
  260   2HB   PHE  35          1HB       PHE  35  -4.063  -2.539  -5.686
  261    HD1  PHE  35           1HD      PHE  35  -1.777  -1.415  -5.840
  262    HD2  PHE  35           2HD      PHE  35  -2.639  -4.606  -3.100
  263    HE1  PHE  35           1HE      PHE  35   0.651  -1.868  -5.607
  264    HE2  PHE  35           2HE      PHE  35  -0.211  -5.058  -2.863
  265    HZ   PHE  35           HZ       PHE  35   1.434  -3.688  -4.116
  266    H    ILE  36           H        ILE  36  -2.609   0.089  -2.628
  267    HA   ILE  36           HA       ILE  36  -2.025   1.711  -5.080
  268    HB   ILE  36           HB       ILE  36  -2.546   2.816  -2.302
  269   1HG1  ILE  36          2HG1      ILE  36  -4.384   2.731  -4.715
  270   2HG1  ILE  36          1HG1      ILE  36  -4.621   1.852  -3.206
  271   1HG2  ILE  36          1HG2      ILE  36  -2.683   4.966  -3.546
  272   2HG2  ILE  36          2HG2      ILE  36  -2.266   4.109  -5.030
  273   3HG2  ILE  36          3HG2      ILE  36  -1.101   4.203  -3.709
  274   1HD1  ILE  36          1HD1      ILE  36  -4.837   4.805  -3.725
  275   2HD1  ILE  36          2HD1      ILE  36  -4.437   4.230  -2.107
  276   3HD1  ILE  36          3HD1      ILE  36  -5.951   3.744  -2.865
  277    H    VAL  37           H        VAL  37   0.062   2.959  -4.786
  278    HA   VAL  37           HA       VAL  37   1.798   2.046  -2.569
  279    HB   VAL  37           HB       VAL  37   2.389   1.526  -5.499
  280   1HG1  VAL  37          1HG1      VAL  37   4.509   1.807  -4.628
  281   2HG1  VAL  37          2HG1      VAL  37   4.252   0.120  -4.184
  282   3HG1  VAL  37          3HG1      VAL  37   4.005   1.393  -2.990
  283   1HG2  VAL  37          1HG2      VAL  37   1.645  -0.301  -3.198
  284   2HG2  VAL  37          2HG2      VAL  37   2.355  -0.886  -4.701
  285   3HG2  VAL  37          3HG2      VAL  37   0.782  -0.092  -4.719
  286    H    ARG  38           H        ARG  38   3.706   3.370  -2.341
  287    HA   ARG  38           HA       ARG  38   4.210   5.531  -4.275
  288   1HB   ARG  38          2HB       ARG  38   3.714   7.320  -2.655
  289   2HB   ARG  38          1HB       ARG  38   2.280   6.334  -2.930
  290   1HG   ARG  38          2HG       ARG  38   2.159   5.966  -0.711
  291   2HG   ARG  38          1HG       ARG  38   3.692   5.098  -0.805
  292   1HD   ARG  38          2HD       ARG  38   4.740   7.522  -0.763
  293   2HD   ARG  38          1HD       ARG  38   3.186   7.955  -0.026
  294    HE   ARG  38           HE       ARG  38   4.468   5.557   1.099
  295   1HH1  ARG  38          1HH2      ARG  38   5.703   8.549   1.256
  296   2HH1  ARG  38          2HH2      ARG  38   5.341   8.865   2.920
  297   1HH2  ARG  38          1HH1      ARG  38   3.236   6.130   3.256
  298   2HH2  ARG  38          2HH1      ARG  38   3.944   7.496   4.052
  299    H    ASP  39           H        ASP  39   6.185   6.721  -3.728
  300    HA   ASP  39           HA       ASP  39   8.260   5.076  -2.623
  301   1HB   ASP  39          2HB       ASP  39   8.226   7.075  -4.329
  302   2HB   ASP  39          1HB       ASP  39   8.443   8.066  -2.886
  303    H    SER  40           H        SER  40   9.757   5.965  -0.834
  304    HA   SER  40           HA       SER  40   8.097   6.935   1.472
  305   1HB   SER  40          2HB       SER  40   8.937   4.550   1.475
  306   2HB   SER  40          1HB       SER  40  10.579   5.187   1.479
  307    HG   SER  40           HG       SER  40   8.622   5.209   3.470
  308    H    SER  41           H        SER  41  10.797   7.023   2.963
  309    HA   SER  41           HA       SER  41  12.158   9.286   1.613
  310   1HB   SER  41          2HB       SER  41  10.329   9.428   3.959
  311   2HB   SER  41          1HB       SER  41  11.794  10.402   4.043
  312    HG   SER  41           HG       SER  41  11.184  11.474   2.228
  313    H    LYS  42           H        LYS  42  11.920   7.695   4.826
  314    HA   LYS  42           HA       LYS  42  14.616   8.038   5.618
  315   1HB   LYS  42          2HB       LYS  42  12.498   5.952   6.177
  316   2HB   LYS  42          1HB       LYS  42  14.051   5.950   7.012
  317   1HG   LYS  42          2HG       LYS  42  13.646   8.208   7.850
  318   2HG   LYS  42          1HG       LYS  42  12.136   8.300   6.942
  319   1HD   LYS  42          2HD       LYS  42  11.626   7.736   9.254
  320   2HD   LYS  42          1HD       LYS  42  11.293   6.332   8.239
  321   1HE   LYS  42          2HE       LYS  42  13.094   5.129   9.074
  322   2HE   LYS  42          1HE       LYS  42  14.032   6.591   9.439
  323   1HZ   LYS  42          1HZ       LYS  42  12.448   7.138  11.178
  324   2HZ   LYS  42          2HZ       LYS  42  13.123   5.605  11.463
  325   3HZ   LYS  42          3HZ       LYS  42  11.550   5.741  10.837
  326    H    ALA  43           H        ALA  43  13.286   4.895   4.544
  327    HA   ALA  43           HA       ALA  43  15.960   3.994   3.696
  328   1HB   ALA  43          1HB       ALA  43  13.475   2.876   4.538
  329   2HB   ALA  43          2HB       ALA  43  14.974   2.016   4.192
  330   3HB   ALA  43          3HB       ALA  43  13.789   2.269   2.912
  331    H    GLY  44           H        GLY  44  13.239   5.541   2.256
  332   1HA   GLY  44          2HA       GLY  44  12.946   6.245   0.016
  333   2HA   GLY  44          1HA       GLY  44  14.491   5.473  -0.384
  334    H    LYS  45           H        LYS  45  12.075   3.727   1.396
  335    HA   LYS  45           HA       LYS  45  11.901   1.726  -0.752
  336   1HB   LYS  45          2HB       LYS  45  10.835   0.407   1.014
  337   2HB   LYS  45          1HB       LYS  45  12.284   1.181   1.653
  338   1HG   LYS  45          2HG       LYS  45  10.412   3.103   2.161
  339   2HG   LYS  45          1HG       LYS  45   9.441   1.642   2.334
  340   1HD   LYS  45          2HD       LYS  45  10.520   1.000   4.229
  341   2HD   LYS  45          1HD       LYS  45  12.095   1.496   3.613
  342   1HE   LYS  45          2HE       LYS  45  11.675   3.808   4.182
  343   2HE   LYS  45          1HE       LYS  45   9.983   3.453   4.581
  344   1HZ   LYS  45          1HZ       LYS  45  10.623   2.106   6.380
  345   2HZ   LYS  45          2HZ       LYS  45  11.595   3.495   6.516
  346   3HZ   LYS  45          3HZ       LYS  45  12.246   2.056   5.889
  347    H    TYR  46           H        TYR  46   9.422   0.739  -0.726
  348    HA   TYR  46           HA       TYR  46   7.661   3.082  -1.377
  349   1HB   TYR  46          2HB       TYR  46   7.496   0.225  -2.386
  350   2HB   TYR  46          1HB       TYR  46   6.634   1.620  -3.021
  351    HD1  TYR  46           1HD      TYR  46   9.279   3.422  -2.609
  352    HD2  TYR  46           2HD      TYR  46   8.386  -0.243  -4.657
  353    HE1  TYR  46           1HE      TYR  46  11.148   3.845  -4.176
  354    HE2  TYR  46           2HE      TYR  46  10.259   0.179  -6.223
  355    HH   TYR  46           HH       TYR  46  12.656   2.447  -5.655
  356    H    THR  47           H        THR  47   5.347   2.776  -0.884
  357    HA   THR  47           HA       THR  47   4.862   0.839   1.359
  358    HB   THR  47           HB       THR  47   3.847   3.674   0.955
  359    HG1  THR  47           1HG      THR  47   5.201   4.158   2.636
  360   1HG2  THR  47          1HG2      THR  47   2.113   2.801   2.184
  361   2HG2  THR  47          2HG2      THR  47   3.236   3.089   3.514
  362   3HG2  THR  47          3HG2      THR  47   3.092   1.475   2.815
  363    H    VAL  48           H        VAL  48   3.008  -0.417   1.113
  364    HA   VAL  48           HA       VAL  48   1.406   0.081  -1.362
  365    HB   VAL  48           HB       VAL  48   1.751  -2.348   0.420
  366   1HG1  VAL  48          1HG1      VAL  48   0.653  -3.549  -1.467
  367   2HG1  VAL  48          2HG1      VAL  48   0.344  -1.995  -2.241
  368   3HG1  VAL  48          3HG1      VAL  48  -0.420  -2.379  -0.699
  369   1HG2  VAL  48          1HG2      VAL  48   3.804  -1.911  -0.745
  370   2HG2  VAL  48          2HG2      VAL  48   2.946  -1.524  -2.236
  371   3HG2  VAL  48          3HG2      VAL  48   2.984  -3.187  -1.647
  372    H    SER  49           H        SER  49  -0.434   1.205  -0.960
  373    HA   SER  49           HA       SER  49  -1.812   0.962   1.664
  374   1HB   SER  49          2HB       SER  49  -1.755   2.825  -0.680
  375   2HB   SER  49          1HB       SER  49  -3.176   2.832   0.357
  376    HG   SER  49           HG       SER  49  -0.573   3.644   0.854
  377    H    VAL  50           H        VAL  50  -3.252  -0.782   1.700
  378    HA   VAL  50           HA       VAL  50  -5.022  -1.093  -0.706
  379    HB   VAL  50           HB       VAL  50  -4.967  -3.536  -0.160
  380   1HG1  VAL  50          1HG1      VAL  50  -2.203  -3.443  -0.467
  381   2HG1  VAL  50          2HG1      VAL  50  -2.744  -1.892  -1.108
  382   3HG1  VAL  50          3HG1      VAL  50  -3.391  -3.391  -1.767
  383   1HG2  VAL  50          1HG2      VAL  50  -2.608  -3.030   1.616
  384   2HG2  VAL  50          2HG2      VAL  50  -3.719  -4.399   1.594
  385   3HG2  VAL  50          3HG2      VAL  50  -4.221  -2.869   2.307
  386    H    PHE  51           H        PHE  51  -7.263  -1.468  -0.247
  387    HA   PHE  51           HA       PHE  51  -8.002  -1.648   2.650
  388   1HB   PHE  51          2HB       PHE  51  -8.728   0.491   2.594
  389   2HB   PHE  51          1HB       PHE  51  -8.169   0.626   0.934
  390    HD1  PHE  51           1HD      PHE  51  -9.717  -0.169  -0.940
  391    HD2  PHE  51           2HD      PHE  51 -11.053   0.429   3.098
  392    HE1  PHE  51           1HE      PHE  51 -12.060  -0.087  -1.725
  393    HE2  PHE  51           2HE      PHE  51 -13.400   0.507   2.307
  394    HZ   PHE  51           HZ       PHE  51 -13.905   0.250  -0.106
  395    H    ALA  52           H        ALA  52 -10.396  -2.177   2.891
  396    HA   ALA  52           HA       ALA  52 -11.823  -3.250   0.590
  397   1HB   ALA  52          1HB       ALA  52 -10.982  -5.276   2.648
  398   2HB   ALA  52          2HB       ALA  52  -9.949  -4.920   1.263
  399   3HB   ALA  52          3HB       ALA  52 -11.577  -5.552   1.012
  400    H    LYS  53           H        LYS  53 -13.986  -3.930   1.144
  401    HA   LYS  53           HA       LYS  53 -14.853  -3.035   3.854
  402   1HB   LYS  53          2HB       LYS  53 -16.024  -1.736   2.372
  403   2HB   LYS  53          1HB       LYS  53 -15.787  -2.864   1.044
  404   1HG   LYS  53          2HG       LYS  53 -17.719  -3.973   1.464
  405   2HG   LYS  53          1HG       LYS  53 -17.576  -3.780   3.209
  406   1HD   LYS  53          2HD       LYS  53 -17.965  -1.220   2.604
  407   2HD   LYS  53          1HD       LYS  53 -18.765  -1.924   1.199
  408   1HE   LYS  53          2HE       LYS  53 -19.481  -3.249   3.732
  409   2HE   LYS  53          1HE       LYS  53 -19.980  -1.548   3.644
  410   1HZ   LYS  53          1HZ       LYS  53 -20.960  -1.951   1.493
  411   2HZ   LYS  53          2HZ       LYS  53 -21.618  -3.046   2.614
  412   3HZ   LYS  53          3HZ       LYS  53 -20.437  -3.565   1.508
  413    H    SER  54           H        SER  54 -14.040  -5.290   4.534
  414    HA   SER  54           HA       SER  54 -16.200  -7.127   4.919
  415   1HB   SER  54          2HB       SER  54 -16.088  -7.654   2.604
  416   2HB   SER  54          1HB       SER  54 -14.327  -7.594   2.592
  417    HG   SER  54           HG       SER  54 -15.387  -9.742   2.634
  418    H    THR  55           H        THR  55 -14.633  -6.358   6.867
  419    HA   THR  55           HA       THR  55 -13.166  -8.717   7.735
  420    HB   THR  55           HB       THR  55 -11.313  -6.443   7.643
  421    HG1  THR  55           1HG      THR  55 -10.917  -6.600   5.445
  422   1HG2  THR  55          1HG2      THR  55 -10.861  -8.875   8.264
  423   2HG2  THR  55          2HG2      THR  55  -9.725  -8.134   7.136
  424   3HG2  THR  55          3HG2      THR  55 -10.975  -9.225   6.540
  425    H    GLY  56           H        GLY  56 -11.391  -6.934   9.469
  426   1HA   GLY  56          2HA       GLY  56 -12.953  -6.680  11.774
  427   2HA   GLY  56          1HA       GLY  56 -11.565  -5.635  11.442
  428    H    ASP  57           H        ASP  57 -12.661  -4.543   9.014
  429    HA   ASP  57           HA       ASP  57 -14.826  -2.790  10.113
  430   1HB   ASP  57          2HB       ASP  57 -12.306  -2.128   9.298
  431   2HB   ASP  57          1HB       ASP  57 -13.187  -1.982   7.777
  432    HA   PRO  58           HA       PRO  58 -16.588  -5.604   6.845
  433   1HB   PRO  58          2HB       PRO  58 -19.127  -4.709   7.863
  434   2HB   PRO  58          1HB       PRO  58 -18.399  -6.313   7.975
  435   1HG   PRO  58          2HG       PRO  58 -18.675  -4.319  10.046
  436   2HG   PRO  58          1HG       PRO  58 -18.060  -5.969  10.184
  437   1HD   PRO  58          2HD       PRO  58 -16.546  -3.582  10.387
  438   2HD   PRO  58          1HD       PRO  58 -15.900  -5.236  10.251
  439    H    GLN  59           H        GLN  59 -16.975  -2.236   7.577
  440    HA   GLN  59           HA       GLN  59 -18.159  -1.814   4.857
  441   1HB   GLN  59          2HB       GLN  59 -19.066   0.298   5.944
  442   2HB   GLN  59          1HB       GLN  59 -19.710  -1.210   6.592
  443   1HG   GLN  59          2HG       GLN  59 -18.431  -1.070   8.550
  444   2HG   GLN  59          1HG       GLN  59 -17.271   0.043   7.823
  445   1HE2  GLN  59          1HE2      GLN  59 -18.741   0.536  10.327
  446   2HE2  GLN  59          2HE2      GLN  59 -19.700   1.913  10.068
  447    H    GLY  60           H        GLY  60 -15.190  -1.824   5.810
  448   1HA   GLY  60          2HA       GLY  60 -14.064  -0.074   4.065
  449   2HA   GLY  60          1HA       GLY  60 -14.460   0.978   5.415
  450    H    VAL  61           H        VAL  61 -12.297  -1.487   4.270
  451    HA   VAL  61           HA       VAL  61 -10.752  -1.293   6.840
  452    HB   VAL  61           HB       VAL  61 -10.735  -3.470   4.722
  453   1HG1  VAL  61          1HG1      VAL  61  -9.196  -4.593   6.003
  454   2HG1  VAL  61          2HG1      VAL  61  -9.770  -3.878   7.510
  455   3HG1  VAL  61          3HG1      VAL  61  -8.746  -2.940   6.422
  456   1HG2  VAL  61          1HG2      VAL  61 -12.071  -4.793   6.237
  457   2HG2  VAL  61          2HG2      VAL  61 -12.897  -3.259   5.973
  458   3HG2  VAL  61          3HG2      VAL  61 -12.001  -3.532   7.466
  459    H    ILE  62           H        ILE  62  -8.602  -0.783   6.687
  460    HA   ILE  62           HA       ILE  62  -7.364  -0.476   4.002
  461    HB   ILE  62           HB       ILE  62  -6.982   1.802   5.848
  462   1HG1  ILE  62          2HG1      ILE  62  -9.691   1.171   4.638
  463   2HG1  ILE  62          1HG1      ILE  62  -9.326   1.342   6.343
  464   1HG2  ILE  62          1HG2      ILE  62  -6.511   2.805   3.881
  465   2HG2  ILE  62          2HG2      ILE  62  -8.057   2.320   3.187
  466   3HG2  ILE  62          3HG2      ILE  62  -6.680   1.220   3.127
  467   1HD1  ILE  62          1HD1      ILE  62  -9.822   3.507   6.184
  468   2HD1  ILE  62          2HD1      ILE  62  -9.999   3.378   4.434
  469   3HD1  ILE  62          3HD1      ILE  62  -8.416   3.708   5.138
  470    H    ARG  63           H        ARG  63  -5.013  -0.135   4.145
  471    HA   ARG  63           HA       ARG  63  -3.558  -0.234   6.639
  472   1HB   ARG  63          2HB       ARG  63  -4.781  -2.609   5.939
  473   2HB   ARG  63          1HB       ARG  63  -3.171  -2.809   5.251
  474   1HG   ARG  63          2HG       ARG  63  -3.750  -2.016   8.122
  475   2HG   ARG  63          1HG       ARG  63  -3.287  -3.633   7.592
  476   1HD   ARG  63          2HD       ARG  63  -1.129  -2.980   7.871
  477   2HD   ARG  63          1HD       ARG  63  -1.352  -1.927   6.459
  478    HE   ARG  63           HE       ARG  63  -2.469  -0.405   8.406
  479   1HH1  ARG  63          1HH1      ARG  63   0.621  -0.965   7.415
  480   2HH1  ARG  63          2HH1      ARG  63   1.400  -0.498   8.888
  481   1HH2  ARG  63          1HH2      ARG  63  -1.548  -0.340  10.707
  482   2HH2  ARG  63          2HH2      ARG  63   0.173  -0.143  10.753
  483    H    HIS  64           H        HIS  64  -1.528   0.567   6.119
  484    HA   HIS  64           HA       HIS  64  -0.718   0.503   3.246
  485   1HB   HIS  64          2HB       HIS  64   0.573   2.086   5.470
  486   2HB   HIS  64          1HB       HIS  64   0.549   2.444   3.745
  487    HD1  HIS  64           1HD      HIS  64  -1.642   3.439   2.753
  488    HD2  HIS  64           2HD      HIS  64  -1.757   2.904   6.885
  489    HE1  HIS  64           1HE      HIS  64  -3.662   4.712   3.581
  490    H    TYR  65           H        TYR  65   0.388  -1.432   2.946
  491    HA   TYR  65           HA       TYR  65   2.302  -2.468   4.924
  492   1HB   TYR  65          2HB       TYR  65   1.892  -3.199   2.015
  493   2HB   TYR  65          1HB       TYR  65   2.586  -4.208   3.276
  494    HD1  TYR  65           1HD      TYR  65   0.070  -4.656   1.388
  495    HD2  TYR  65           2HD      TYR  65   0.561  -3.417   5.473
  496    HE1  TYR  65           1HE      TYR  65  -2.174  -5.552   1.932
  497    HE2  TYR  65           2HE      TYR  65  -1.685  -4.311   6.013
  498    HH   TYR  65           HH       TYR  65  -3.974  -4.817   4.077
  499    H    VAL  66           H        VAL  66   4.427  -1.798   4.993
  500    HA   VAL  66           HA       VAL  66   5.456  -0.286   2.621
  501    HB   VAL  66           HB       VAL  66   6.335  -0.227   5.524
  502   1HG1  VAL  66          1HG1      VAL  66   8.178   0.483   4.233
  503   2HG1  VAL  66          2HG1      VAL  66   7.356   1.996   4.619
  504   3HG1  VAL  66          3HG1      VAL  66   7.151   1.261   3.029
  505   1HG2  VAL  66          1HG2      VAL  66   5.058   2.141   4.283
  506   2HG2  VAL  66          2HG2      VAL  66   4.846   1.470   5.900
  507   3HG2  VAL  66          3HG2      VAL  66   3.979   0.769   4.534
  508    H    VAL  67           H        VAL  67   7.833  -0.538   2.244
  509    HA   VAL  67           HA       VAL  67   8.677  -3.350   2.828
  510    HB   VAL  67           HB       VAL  67   9.291  -1.445   0.551
  511   1HG1  VAL  67          1HG1      VAL  67  10.568  -3.939   1.484
  512   2HG1  VAL  67          2HG1      VAL  67  11.201  -2.672   0.433
  513   3HG1  VAL  67          3HG1      VAL  67  10.153  -3.925  -0.230
  514   1HG2  VAL  67          1HG2      VAL  67   8.035  -4.113   0.148
  515   2HG2  VAL  67          2HG2      VAL  67   7.715  -2.584  -0.671
  516   3HG2  VAL  67          3HG2      VAL  67   7.030  -2.889   0.925
  517    H    CYS  68           H        CYS  68  10.394  -3.523   4.174
  518    HA   CYS  68           HA       CYS  68  11.997  -1.150   4.864
  519   1HB   CYS  68          2HB       CYS  68  11.145  -2.788   6.543
  520   2HB   CYS  68          1HB       CYS  68  12.104  -4.050   5.771
  521    HG   CYS  68           HG       CYS  68  13.452  -1.540   7.073
  522    H    SER  69           H        SER  69  14.365  -1.168   4.607
  523    HA   SER  69           HA       SER  69  15.321  -3.100   2.521
  524   1HB   SER  69          2HB       SER  69  16.685  -0.828   1.943
  525   2HB   SER  69          1HB       SER  69  15.132  -1.235   1.211
  526    HG   SER  69           HG       SER  69  14.222   0.309   2.324
  527    H    THR  70           H        THR  70  17.209  -4.074   3.042
  528    HA   THR  70           HA       THR  70  18.736  -3.097   5.407
  529    HB   THR  70           HB       THR  70  17.871  -5.452   5.232
  530    HG1  THR  70           1HG      THR  70  19.554  -5.471   6.516
  531   1HG2  THR  70          1HG2      THR  70  18.395  -6.854   3.509
  532   2HG2  THR  70          2HG2      THR  70  19.993  -6.146   3.280
  533   3HG2  THR  70          3HG2      THR  70  18.571  -5.336   2.628
  534    HA   PRO  71           HA       PRO  71  21.987  -1.509   2.929
  535   1HB   PRO  71          2HB       PRO  71  24.121  -2.631   4.498
  536   2HB   PRO  71          1HB       PRO  71  23.478  -0.986   4.544
  537   1HG   PRO  71          2HG       PRO  71  23.176  -3.016   6.524
  538   2HG   PRO  71          1HG       PRO  71  22.450  -1.405   6.516
  539   1HD   PRO  71          2HD       PRO  71  21.162  -3.970   6.056
  540   2HD   PRO  71          1HD       PRO  71  20.407  -2.365   6.192
  541    H    GLN  72           H        GLN  72  21.435  -4.803   2.989
  542    HA   GLN  72           HA       GLN  72  23.834  -5.484   1.374
  543   1HB   GLN  72          2HB       GLN  72  23.075  -6.999   3.154
  544   2HB   GLN  72          1HB       GLN  72  21.473  -7.077   2.433
  545   1HG   GLN  72          2HG       GLN  72  22.915  -9.060   1.897
  546   2HG   GLN  72          1HG       GLN  72  22.346  -8.205   0.469
  547   1HE2  GLN  72          1HE2      GLN  72  23.923  -7.169  -0.875
  548   2HE2  GLN  72          2HE2      GLN  72  25.591  -7.266  -0.580
  549    H    SER  73           H        SER  73  21.552  -3.627   0.508
  550    HA   SER  73           HA       SER  73  20.382  -3.188  -1.495
  551   1HB   SER  73          2HB       SER  73  22.702  -4.519  -2.133
  552   2HB   SER  73          1HB       SER  73  21.490  -5.578  -2.848
  553    HG   SER  73           HG       SER  73  22.377  -3.603  -4.047
  554    H    GLN  74           H        GLN  74  19.005  -4.606   0.454
  555    HA   GLN  74           HA       GLN  74  17.377  -6.509  -1.186
  556   1HB   GLN  74          2HB       GLN  74  17.736  -7.034   1.714
  557   2HB   GLN  74          1HB       GLN  74  17.667  -8.174   0.376
  558   1HG   GLN  74          2HG       GLN  74  19.962  -7.202  -0.307
  559   2HG   GLN  74          1HG       GLN  74  20.015  -6.535   1.323
  560   1HE2  GLN  74          1HE2      GLN  74  20.225  -9.496  -0.560
  561   2HE2  GLN  74          2HE2      GLN  74  20.596 -10.525   0.739
  562    H    TYR  75           H        TYR  75  15.180  -6.900  -0.063
  563    HA   TYR  75           HA       TYR  75  14.288  -4.591   1.610
  564   1HB   TYR  75          2HB       TYR  75  12.954  -5.408  -0.980
  565   2HB   TYR  75          1HB       TYR  75  12.557  -4.017   0.019
  566    HD1  TYR  75           1HD      TYR  75  13.777  -1.975  -0.146
  567    HD2  TYR  75           2HD      TYR  75  15.172  -5.504  -2.144
  568    HE1  TYR  75           1HE      TYR  75  15.449  -0.623  -1.369
  569    HE2  TYR  75           2HE      TYR  75  16.848  -4.159  -3.365
  570    HH   TYR  75           HH       TYR  75  18.066  -1.855  -2.878
  571    H    TYR  76           H        TYR  76  12.136  -4.932   2.550
  572    HA   TYR  76           HA       TYR  76  10.556  -7.306   2.215
  573   1HB   TYR  76          2HB       TYR  76  11.275  -8.499   4.293
  574   2HB   TYR  76          1HB       TYR  76  12.591  -8.387   3.131
  575    HD1  TYR  76           1HD      TYR  76  14.591  -7.129   3.631
  576    HD2  TYR  76           2HD      TYR  76  11.182  -6.915   6.224
  577    HE1  TYR  76           1HE      TYR  76  15.961  -5.984   5.344
  578    HE2  TYR  76           2HE      TYR  76  12.545  -5.770   7.936
  579    HH   TYR  76           HH       TYR  76  15.886  -5.693   7.869
  580    H    LEU  77           H        LEU  77   8.864  -7.459   3.923
  581    HA   LEU  77           HA       LEU  77   8.396  -4.835   5.298
  582   1HB   LEU  77          2HB       LEU  77   6.747  -6.189   3.705
  583   2HB   LEU  77          1HB       LEU  77   6.453  -7.143   5.160
  584    HG   LEU  77           HG       LEU  77   6.405  -4.220   5.583
  585   1HD1  LEU  77          1HD1      LEU  77   5.331  -4.572   3.289
  586   2HD1  LEU  77          2HD1      LEU  77   4.313  -3.803   4.506
  587   3HD1  LEU  77          3HD1      LEU  77   4.091  -5.510   4.122
  588   1HD2  LEU  77          1HD2      LEU  77   4.910  -6.671   6.441
  589   2HD2  LEU  77          2HD2      LEU  77   4.129  -5.101   6.624
  590   3HD2  LEU  77          3HD2      LEU  77   5.666  -5.421   7.429
  591    H    ALA  78           H        ALA  78   9.500  -7.971   5.681
  592    HA   ALA  78           HA       ALA  78   9.720  -7.745   8.608
  593   1HB   ALA  78          1HB       ALA  78   8.879 -10.421   7.718
  594   2HB   ALA  78          2HB       ALA  78   7.648  -9.197   7.408
  595   3HB   ALA  78          3HB       ALA  78   8.250  -9.448   9.047
  596    H    GLU  79           H        GLU  79  11.892  -8.200   8.915
  597    HA   GLU  79           HA       GLU  79  13.736  -8.896   6.956
  598   1HB   GLU  79          2HB       GLU  79  13.565  -9.116   9.930
  599   2HB   GLU  79          1HB       GLU  79  14.924  -9.916   9.141
  600   1HG   GLU  79          2HG       GLU  79  15.350  -7.739   7.911
  601   2HG   GLU  79          1HG       GLU  79  14.168  -6.992   8.988
  602    H    LYS  80           H        LYS  80  11.455 -11.001   8.463
  603    HA   LYS  80           HA       LYS  80  12.527 -13.551   8.455
  604   1HB   LYS  80          2HB       LYS  80   9.936 -12.272   7.940
  605   2HB   LYS  80          1HB       LYS  80  10.082 -13.858   7.179
  606   1HG   LYS  80          2HG       LYS  80  10.487 -14.941   9.245
  607   2HG   LYS  80          1HG       LYS  80  10.868 -13.424  10.061
  608   1HD   LYS  80          2HD       LYS  80   8.159 -13.633   8.849
  609   2HD   LYS  80          1HD       LYS  80   8.461 -14.619  10.280
  610   1HE   LYS  80          2HE       LYS  80   9.461 -12.415  11.288
  611   2HE   LYS  80          1HE       LYS  80   8.512 -11.619  10.017
  612   1HZ   LYS  80          1HZ       LYS  80   7.476 -13.596  11.981
  613   2HZ   LYS  80          2HZ       LYS  80   6.570 -12.881  10.734
  614   3HZ   LYS  80          3HZ       LYS  80   7.172 -11.928  12.005
  615    H    HIS  81           H        HIS  81  11.552 -11.663   5.592
  616    HA   HIS  81           HA       HIS  81  13.289 -13.358   3.889
  617   1HB   HIS  81          2HB       HIS  81  10.288 -13.041   3.542
  618   2HB   HIS  81          1HB       HIS  81  11.354 -13.745   2.327
  619    HD1  HIS  81           1HD      HIS  81  12.974 -15.766   3.490
  620    HD2  HIS  81           2HD      HIS  81   9.233 -15.000   5.163
  621    HE1  HIS  81           1HE      HIS  81  12.357 -17.820   4.838
  622    H    LEU  82           H        LEU  82  14.135 -12.093   2.199
  623    HA   LEU  82           HA       LEU  82  12.756  -9.561   1.524
  624   1HB   LEU  82          2HB       LEU  82  14.753  -8.266   2.078
  625   2HB   LEU  82          1HB       LEU  82  14.278  -9.213   3.485
  626    HG   LEU  82           HG       LEU  82  16.315 -10.185   1.494
  627   1HD1  LEU  82          1HD1      LEU  82  17.959  -8.957   2.475
  628   2HD1  LEU  82          2HD1      LEU  82  17.292  -9.189   4.089
  629   3HD1  LEU  82          3HD1      LEU  82  16.645  -7.927   3.041
  630   1HD2  LEU  82          1HD2      LEU  82  16.899 -11.183   4.014
  631   2HD2  LEU  82          2HD2      LEU  82  16.010 -12.050   2.763
  632   3HD2  LEU  82          3HD2      LEU  82  15.135 -11.158   4.006
  633    H    PHE  83           H        PHE  83  13.227  -8.850  -0.578
  634    HA   PHE  83           HA       PHE  83  14.987 -10.663  -2.189
  635   1HB   PHE  83          2HB       PHE  83  12.430  -9.144  -2.744
  636   2HB   PHE  83          1HB       PHE  83  13.415  -9.802  -4.054
  637    HD1  PHE  83           1HD      PHE  83  14.155 -12.307  -3.789
  638    HD2  PHE  83           2HD      PHE  83  10.833 -10.535  -1.723
  639    HE1  PHE  83           1HE      PHE  83  13.190 -14.559  -3.406
  640    HE2  PHE  83           2HE      PHE  83   9.869 -12.786  -1.341
  641    HZ   PHE  83           HZ       PHE  83  11.048 -14.798  -2.182
  642    H    SER  84           H        SER  84  14.574  -8.505  -4.417
  643    HA   SER  84           HA       SER  84  16.681  -6.647  -3.359
  644   1HB   SER  84          2HB       SER  84  17.490  -8.245  -5.017
  645   2HB   SER  84          1HB       SER  84  16.192  -7.805  -6.122
  646    HG   SER  84           HG       SER  84  17.153  -5.917  -6.518
  647    H    THR  85           H        THR  85  13.461  -6.585  -4.070
  648    HA   THR  85           HA       THR  85  13.449  -3.697  -4.484
  649    HB   THR  85           HB       THR  85  12.203  -5.253  -6.736
  650    HG1  THR  85           1HG      THR  85  14.054  -5.586  -7.682
  651   1HG2  THR  85          1HG2      THR  85  11.888  -3.195  -7.577
  652   2HG2  THR  85          2HG2      THR  85  13.588  -2.782  -7.353
  653   3HG2  THR  85          3HG2      THR  85  12.444  -2.555  -6.030
  654    H    ILE  86           H        ILE  86  11.194  -2.838  -4.519
  655    HA   ILE  86           HA       ILE  86   9.435  -4.292  -2.764
  656    HB   ILE  86           HB       ILE  86   9.331  -1.798  -4.432
  657   1HG1  ILE  86          2HG1      ILE  86   8.676  -1.192  -1.839
  658   2HG1  ILE  86          1HG1      ILE  86   9.725  -2.591  -1.622
  659   1HG2  ILE  86          1HG2      ILE  86   7.023  -3.300  -3.325
  660   2HG2  ILE  86          2HG2      ILE  86   7.069  -2.109  -4.624
  661   3HG2  ILE  86          3HG2      ILE  86   7.063  -1.579  -2.943
  662   1HD1  ILE  86          1HD1      ILE  86  10.432   0.119  -2.372
  663   2HD1  ILE  86          2HD1      ILE  86  10.990  -1.032  -3.587
  664   3HD1  ILE  86          3HD1      ILE  86  11.485  -1.217  -1.905
  665    HA   PRO  87           HA       PRO  87   6.690  -4.908  -6.772
  666   1HB   PRO  87          2HB       PRO  87   8.556  -5.058  -8.961
  667   2HB   PRO  87          1HB       PRO  87   7.216  -3.927  -8.749
  668   1HG   PRO  87          2HG       PRO  87  10.049  -3.420  -8.482
  669   2HG   PRO  87          1HG       PRO  87   8.713  -2.269  -8.392
  670   1HD   PRO  87          2HD       PRO  87  10.344  -3.149  -6.239
  671   2HD   PRO  87          1HD       PRO  87   8.862  -2.171  -6.119
  672    H    GLU  88           H        GLU  88  10.030  -6.017  -6.481
  673    HA   GLU  88           HA       GLU  88   9.668  -8.672  -7.540
  674   1HB   GLU  88          2HB       GLU  88  11.759  -7.153  -6.775
  675   2HB   GLU  88          1HB       GLU  88  11.575  -8.111  -5.307
  676   1HG   GLU  88          2HG       GLU  88  12.955  -9.530  -6.482
  677   2HG   GLU  88          1HG       GLU  88  11.400 -10.099  -7.090
  678    H    LEU  89           H        LEU  89   9.924  -7.557  -4.139
  679    HA   LEU  89           HA       LEU  89   9.178  -9.878  -2.773
  680   1HB   LEU  89          2HB       LEU  89   8.891  -6.926  -2.380
  681   2HB   LEU  89          1HB       LEU  89   7.989  -7.966  -1.281
  682    HG   LEU  89           HG       LEU  89  10.860  -8.619  -1.786
  683   1HD1  LEU  89          1HD1      LEU  89  10.249  -6.689   0.405
  684   2HD1  LEU  89          2HD1      LEU  89  10.360  -6.042  -1.231
  685   3HD1  LEU  89          3HD1      LEU  89  11.731  -6.897  -0.528
  686   1HD2  LEU  89          1HD2      LEU  89  10.723  -9.402   0.513
  687   2HD2  LEU  89          2HD2      LEU  89   9.322 -10.013  -0.366
  688   3HD2  LEU  89          3HD2      LEU  89   9.149  -8.634   0.718
  689    H    ILE  90           H        ILE  90   6.914  -7.293  -3.828
  690    HA   ILE  90           HA       ILE  90   4.490  -8.564  -3.126
  691    HB   ILE  90           HB       ILE  90   5.138  -6.755  -5.480
  692   1HG1  ILE  90          2HG1      ILE  90   5.894  -5.773  -3.373
  693   2HG1  ILE  90          1HG1      ILE  90   4.430  -4.945  -3.900
  694   1HG2  ILE  90          1HG2      ILE  90   2.885  -7.903  -5.515
  695   2HG2  ILE  90          2HG2      ILE  90   2.808  -6.142  -5.452
  696   3HG2  ILE  90          3HG2      ILE  90   2.520  -7.090  -3.993
  697   1HD1  ILE  90          1HD1      ILE  90   4.853  -6.744  -1.573
  698   2HD1  ILE  90          2HD1      ILE  90   3.314  -6.908  -2.420
  699   3HD1  ILE  90          3HD1      ILE  90   3.784  -5.351  -1.740
  700    H    ASN  91           H        ASN  91   6.430  -8.855  -6.097
  701    HA   ASN  91           HA       ASN  91   4.622 -10.446  -7.626
  702   1HB   ASN  91          2HB       ASN  91   7.418  -9.610  -7.621
  703   2HB   ASN  91          1HB       ASN  91   7.244 -11.254  -8.234
  704   1HD2  ASN  91          1HD2      ASN  91   7.449  -8.223  -9.398
  705   2HD2  ASN  91          2HD2      ASN  91   6.402  -8.323 -10.731
  706    H    TYR  92           H        TYR  92   7.092 -11.343  -5.227
  707    HA   TYR  92           HA       TYR  92   6.979 -14.174  -5.539
  708   1HB   TYR  92          2HB       TYR  92   7.621 -12.291  -3.262
  709   2HB   TYR  92          1HB       TYR  92   7.782 -14.039  -3.090
  710    HD1  TYR  92           1HD      TYR  92   9.122 -15.259  -4.969
  711    HD2  TYR  92           2HD      TYR  92   9.406 -11.056  -4.160
  712    HE1  TYR  92           1HE      TYR  92  11.308 -15.187  -6.137
  713    HE2  TYR  92           2HE      TYR  92  11.592 -10.980  -5.326
  714    HH   TYR  92           HH       TYR  92  13.415 -13.610  -5.989
  715    H    HIS  93           H        HIS  93   4.665 -11.969  -4.201
  716    HA   HIS  93           HA       HIS  93   3.354 -13.515  -2.236
  717   1HB   HIS  93          2HB       HIS  93   3.000 -11.098  -3.035
  718   2HB   HIS  93          1HB       HIS  93   1.987 -11.784  -4.306
  719    HD1  HIS  93           1HD      HIS  93  -0.099 -13.263  -3.444
  720    HD2  HIS  93           2HD      HIS  93   1.732 -10.867  -0.566
  721    HE1  HIS  93           1HE      HIS  93  -1.721 -13.107  -1.505
  722    H    GLN  94           H        GLN  94   2.764 -13.460  -5.774
  723    HA   GLN  94           HA       GLN  94   1.992 -16.273  -5.785
  724   1HB   GLN  94          2HB       GLN  94   0.073 -14.691  -4.824
  725   2HB   GLN  94          1HB       GLN  94  -0.227 -14.410  -6.540
  726   1HG   GLN  94          2HG       GLN  94   0.052 -17.199  -5.416
  727   2HG   GLN  94          1HG       GLN  94  -1.500 -16.362  -5.446
  728   1HE2  GLN  94          1HE2      GLN  94   0.575 -18.329  -7.303
  729   2HE2  GLN  94          2HE2      GLN  94  -0.147 -18.074  -8.818
  730    H    HIS  95           H        HIS  95   1.625 -13.159  -7.511
  731    HA   HIS  95           HA       HIS  95   1.891 -14.547 -10.119
  732   1HB   HIS  95          2HB       HIS  95   1.315 -12.297 -10.988
  733   2HB   HIS  95          1HB       HIS  95   0.166 -12.817  -9.757
  734    HD1  HIS  95           1HD      HIS  95   0.144 -11.540  -7.521
  735    HD2  HIS  95           2HD      HIS  95   3.078 -10.185 -10.154
  736    HE1  HIS  95           1HE      HIS  95   1.034  -9.376  -6.550
  737    H    ASN  96           H        ASN  96   3.825 -14.626 -11.193
  738    HA   ASN  96           HA       ASN  96   5.814 -12.512 -11.051
  739   1HB   ASN  96          2HB       ASN  96   6.064 -13.558  -8.825
  740   2HB   ASN  96          1HB       ASN  96   6.308 -15.129  -9.588
  741   1HD2  ASN  96          1HD2      ASN  96   7.641 -11.916 -10.522
  742   2HD2  ASN  96          2HD2      ASN  96   9.267 -12.388 -10.395
  743    H    SER  97           H        SER  97   5.474 -16.047 -11.553
  744    HA   SER  97           HA       SER  97   7.369 -15.996 -13.806
  745   1HB   SER  97          2HB       SER  97   7.365 -17.875 -12.288
  746   2HB   SER  97          1HB       SER  97   5.629 -18.097 -12.485
  747    HG   SER  97           HG       SER  97   6.421 -19.515 -13.895
  748    H    ALA  98           H        ALA  98   3.894 -15.935 -13.316
  749    HA   ALA  98           HA       ALA  98   3.026 -16.863 -15.873
  750   1HB   ALA  98          1HB       ALA  98   1.275 -16.659 -14.404
  751   2HB   ALA  98          2HB       ALA  98   1.135 -15.056 -15.124
  752   3HB   ALA  98          3HB       ALA  98   1.990 -15.263 -13.595
  753    H    GLY  99           H        GLY  99   2.533 -13.452 -15.028
  754   1HA   GLY  99          2HA       GLY  99   3.410 -11.519 -16.144
  755   2HA   GLY  99          1HA       GLY  99   4.151 -12.576 -17.343
  756    H    LEU 100           H        LEU 100   1.373 -14.000 -17.415
  757    HA   LEU 100           HA       LEU 100   0.396 -12.783 -19.797
  758   1HB   LEU 100          2HB       LEU 100   0.027 -15.115 -18.592
  759   2HB   LEU 100          1HB       LEU 100  -1.383 -14.301 -17.914
  760    HG   LEU 100           HG       LEU 100  -1.651 -13.571 -20.502
  761   1HD1  LEU 100          1HD1      LEU 100   0.428 -14.998 -20.992
  762   2HD1  LEU 100          2HD1      LEU 100  -0.989 -15.301 -21.997
  763   3HD1  LEU 100          3HD1      LEU 100  -0.596 -16.398 -20.674
  764   1HD2  LEU 100          1HD2      LEU 100  -3.134 -14.952 -18.797
  765   2HD2  LEU 100          2HD2      LEU 100  -2.577 -16.325 -19.752
  766   3HD2  LEU 100          3HD2      LEU 100  -3.475 -15.019 -20.527
  767    H    ILE 101           H        ILE 101  -1.247 -12.800 -16.604
  768    HA   ILE 101           HA       ILE 101  -2.297 -10.062 -17.249
  769    HB   ILE 101           HB       ILE 101  -4.388 -10.831 -16.123
  770   1HG1  ILE 101          2HG1      ILE 101  -3.057 -13.558 -16.156
  771   2HG1  ILE 101          1HG1      ILE 101  -3.233 -12.566 -14.708
  772   1HG2  ILE 101          1HG2      ILE 101  -4.994 -12.560 -17.907
  773   2HG2  ILE 101          2HG2      ILE 101  -3.327 -12.425 -18.463
  774   3HG2  ILE 101          3HG2      ILE 101  -4.385 -11.016 -18.503
  775   1HD1  ILE 101          1HD1      ILE 101  -5.200 -13.691 -14.471
  776   2HD1  ILE 101          2HD1      ILE 101  -5.264 -14.135 -16.177
  777   3HD1  ILE 101          3HD1      ILE 101  -5.789 -12.532 -15.662
  778    H    SER 102           H        SER 102  -2.336  -8.605 -15.505
  779    HA   SER 102           HA       SER 102  -0.520  -9.054 -13.313
  780   1HB   SER 102          2HB       SER 102  -2.708  -6.975 -13.477
  781   2HB   SER 102          1HB       SER 102  -1.123  -6.822 -12.725
  782    HG   SER 102           HG       SER 102  -0.280  -6.401 -14.614
  783    H    ARG 103           H        ARG 103  -1.071  -9.212 -11.034
  784    HA   ARG 103           HA       ARG 103  -3.760 -10.448 -10.554
  785   1HB   ARG 103          2HB       ARG 103  -1.253 -11.486 -10.235
  786   2HB   ARG 103          1HB       ARG 103  -1.547 -10.832  -8.624
  787   1HG   ARG 103          2HG       ARG 103  -3.011 -12.477  -8.138
  788   2HG   ARG 103          1HG       ARG 103  -3.902 -12.207  -9.637
  789   1HD   ARG 103          2HD       ARG 103  -1.789 -13.428 -10.713
  790   2HD   ARG 103          1HD       ARG 103  -1.666 -14.124  -9.085
  791    HE   ARG 103           HE       ARG 103  -4.215 -14.609  -9.422
  792   1HH1  ARG 103          1HH1      ARG 103  -3.451 -13.570 -12.355
  793   2HH1  ARG 103          2HH1      ARG 103  -3.567 -15.080 -13.196
  794   1HH2  ARG 103          1HH2      ARG 103  -3.666 -16.987 -10.302
  795   2HH2  ARG 103          2HH2      ARG 103  -3.687 -17.015 -12.033
  796    H    LEU 104           H        LEU 104  -2.738  -7.500 -10.354
  797    HA   LEU 104           HA       LEU 104  -2.751  -6.787  -7.557
  798   1HB   LEU 104          2HB       LEU 104  -1.893  -5.474  -9.562
  799   2HB   LEU 104          1HB       LEU 104  -3.576  -5.110  -9.944
  800    HG   LEU 104           HG       LEU 104  -2.732  -4.610  -7.139
  801   1HD1  LEU 104          1HD1      LEU 104  -1.774  -2.963  -9.496
  802   2HD1  LEU 104          2HD1      LEU 104  -0.782  -3.729  -8.254
  803   3HD1  LEU 104          3HD1      LEU 104  -1.814  -2.360  -7.839
  804   1HD2  LEU 104          1HD2      LEU 104  -4.651  -3.591  -9.167
  805   2HD2  LEU 104          2HD2      LEU 104  -4.027  -2.398  -8.026
  806   3HD2  LEU 104          3HD2      LEU 104  -4.868  -3.830  -7.433
  807    H    LYS 105           H        LYS 105  -4.520  -5.771  -6.380
  808    HA   LYS 105           HA       LYS 105  -7.102  -7.015  -6.844
  809   1HB   LYS 105          2HB       LYS 105  -5.951  -4.983  -4.934
  810   2HB   LYS 105          1HB       LYS 105  -7.665  -5.400  -4.896
  811   1HG   LYS 105          2HG       LYS 105  -6.955  -7.037  -3.467
  812   2HG   LYS 105          1HG       LYS 105  -6.584  -7.886  -4.969
  813   1HD   LYS 105          2HD       LYS 105  -4.316  -7.544  -4.767
  814   2HD   LYS 105          1HD       LYS 105  -4.517  -6.013  -3.913
  815   1HE   LYS 105          2HE       LYS 105  -3.656  -7.676  -2.338
  816   2HE   LYS 105          1HE       LYS 105  -5.345  -7.329  -1.914
  817   1HZ   LYS 105          1HZ       LYS 105  -4.906  -9.730  -2.071
  818   2HZ   LYS 105          2HZ       LYS 105  -4.458  -9.535  -3.699
  819   3HZ   LYS 105          3HZ       LYS 105  -6.054  -9.216  -3.210
  820    H    TYR 106           H        TYR 106  -6.794  -3.514  -6.194
  821    HA   TYR 106           HA       TYR 106  -8.247  -3.002  -8.766
  822   1HB   TYR 106          2HB       TYR 106  -9.836  -3.178  -6.888
  823   2HB   TYR 106          1HB       TYR 106  -8.930  -1.950  -6.006
  824    HD1  TYR 106           1HD      TYR 106 -11.281  -2.583  -8.732
  825    HD2  TYR 106           2HD      TYR 106  -8.826   0.373  -6.823
  826    HE1  TYR 106           1HE      TYR 106 -12.514  -0.791  -9.925
  827    HE2  TYR 106           2HE      TYR 106 -10.058   2.170  -8.012
  828    HH   TYR 106           HH       TYR 106 -12.989   1.687  -9.529
  829    HA   PRO 107           HA       PRO 107  -4.782  -0.081  -8.745
  830   1HB   PRO 107          2HB       PRO 107  -5.618   0.734 -11.364
  831   2HB   PRO 107          1HB       PRO 107  -4.239  -0.275 -10.923
  832   1HG   PRO 107          2HG       PRO 107  -6.641  -1.097 -12.230
  833   2HG   PRO 107          1HG       PRO 107  -5.292  -2.114 -11.716
  834   1HD   PRO 107          2HD       PRO 107  -7.947  -1.916 -10.547
  835   2HD   PRO 107          1HD       PRO 107  -6.625  -3.025 -10.106
  836    H    VAL 108           H        VAL 108  -5.557   1.509  -7.305
  837    HA   VAL 108           HA       VAL 108  -7.315   3.612  -8.512
  838    HB   VAL 108           HB       VAL 108  -8.349   2.126  -6.752
  839   1HG1  VAL 108          1HG1      VAL 108  -7.613   2.324  -4.452
  840   2HG1  VAL 108          2HG1      VAL 108  -6.402   3.523  -4.906
  841   3HG1  VAL 108          3HG1      VAL 108  -6.229   1.851  -5.439
  842   1HG2  VAL 108          1HG2      VAL 108  -9.309   3.987  -5.463
  843   2HG2  VAL 108          2HG2      VAL 108  -9.135   4.446  -7.157
  844   3HG2  VAL 108          3HG2      VAL 108  -7.977   5.031  -5.963
  845    H    SER 109           H        SER 109  -6.460   5.769  -8.230
  846    HA   SER 109           HA       SER 109  -3.831   5.894  -6.808
  847   1HB   SER 109          2HB       SER 109  -4.826   7.952  -8.755
  848   2HB   SER 109          1HB       SER 109  -3.172   7.427  -8.439
  849    HG   SER 109           HG       SER 109  -3.993   6.632 -10.430
  850    H    GLN 110           H        GLN 110  -3.445   8.308  -6.164
  851    HA   GLN 110           HA       GLN 110  -4.565   9.172  -3.910
  852   1HB   GLN 110          2HB       GLN 110  -4.305  11.534  -4.906
  853   2HB   GLN 110          1HB       GLN 110  -2.905  10.464  -5.017
  854   1HG   GLN 110          2HG       GLN 110  -3.709   9.791  -7.324
  855   2HG   GLN 110          1HG       GLN 110  -4.918  11.068  -7.201
  856   1HE2  GLN 110          1HE2      GLN 110  -1.434  10.961  -6.248
  857   2HE2  GLN 110          2HE2      GLN 110  -0.997  12.341  -7.135
  858    H    GLN 111           H        GLN 111  -6.199   9.721  -7.057
  859    HA   GLN 111           HA       GLN 111  -8.774   9.885  -5.651
  860   1HB   GLN 111          2HB       GLN 111  -9.255  12.103  -6.646
  861   2HB   GLN 111          1HB       GLN 111  -7.835  12.166  -5.598
  862   1HG   GLN 111          2HG       GLN 111  -6.657  11.527  -7.962
  863   2HG   GLN 111          1HG       GLN 111  -8.026  12.475  -8.541
  864   1HE2  GLN 111          1HE2      GLN 111  -8.318  14.432  -6.596
  865   2HE2  GLN 111          2HE2      GLN 111  -6.905  15.365  -6.481
  866    H    ASN 112           H        ASN 112 -10.341   8.955  -6.891
  867    HA   ASN 112           HA       ASN 112 -10.477   9.134  -9.764
  868   1HB   ASN 112          2HB       ASN 112  -8.506   7.602  -9.360
  869   2HB   ASN 112          1HB       ASN 112  -9.616   6.475  -8.582
  870   1HD2  ASN 112          1HD2      ASN 112  -9.278   4.858 -10.285
  871   2HD2  ASN 112          2HD2      ASN 112  -9.944   5.064 -11.833
  872    H    LYS 113           H        LYS 113 -11.218   6.968  -7.026
  873    HA   LYS 113           HA       LYS 113 -13.247   5.953  -6.364
  874   1HB   LYS 113          2HB       LYS 113 -14.585   8.352  -7.600
  875   2HB   LYS 113          1HB       LYS 113 -14.933   7.562  -6.064
  876   1HG   LYS 113          2HG       LYS 113 -12.523   9.290  -6.714
  877   2HG   LYS 113          1HG       LYS 113 -13.834   9.679  -5.602
  878   1HD   LYS 113          2HD       LYS 113 -13.166   7.962  -4.071
  879   2HD   LYS 113          1HD       LYS 113 -12.045   7.263  -5.237
  880   1HE   LYS 113          2HE       LYS 113 -10.553   8.509  -3.951
  881   2HE   LYS 113          1HE       LYS 113 -11.006   9.739  -5.147
  882   1HZ   LYS 113          1HZ       LYS 113 -11.368  10.697  -3.025
  883   2HZ   LYS 113          2HZ       LYS 113 -12.177   9.318  -2.454
  884   3HZ   LYS 113          3HZ       LYS 113 -12.901  10.303  -3.634
  885    H    ASN 114           H        ASN 114 -15.743   5.795  -7.394
  886    HA   ASN 114           HA       ASN 114 -15.392   4.943 -10.246
  887   1HB   ASN 114          2HB       ASN 114 -15.837   3.400  -7.884
  888   2HB   ASN 114          1HB       ASN 114 -17.281   3.296  -8.888
  889   1HD2  ASN 114          1HD2      ASN 114 -16.975   1.202  -9.789
  890   2HD2  ASN 114          2HD2      ASN 114 -15.635   0.785 -10.745
  891    H    ALA 115           H        ALA 115 -17.784   5.678  -7.689
  892    HA   ALA 115           HA       ALA 115 -19.929   6.664  -7.832
  893   1HB   ALA 115          1HB       ALA 115 -18.795   8.632  -8.435
  894   2HB   ALA 115          2HB       ALA 115 -19.922   8.427  -9.777
  895   3HB   ALA 115          3HB       ALA 115 -18.235   7.951  -9.963
  896    HA   PRO 116           HA       PRO 116 -21.154   3.556 -11.081
  897   1HB   PRO 116          2HB       PRO 116 -23.335   2.905  -9.320
  898   2HB   PRO 116          1HB       PRO 116 -21.937   1.909  -9.736
  899   1HG   PRO 116          2HG       PRO 116 -22.483   3.218  -7.242
  900   2HG   PRO 116          1HG       PRO 116 -21.084   2.226  -7.665
  901   1HD   PRO 116          2HD       PRO 116 -21.175   5.086  -7.287
  902   2HD   PRO 116          1HD       PRO 116 -19.768   4.086  -7.721
  903    H    SER 117           H        SER 117 -23.520   3.344 -11.995
  904    HA   SER 117           HA       SER 117 -24.539   6.065 -12.454
  905   1HB   SER 117          2HB       SER 117 -25.452   3.344 -13.443
  906   2HB   SER 117          1HB       SER 117 -25.910   4.900 -14.129
  907    HG   SER 117           HG       SER 117 -23.677   5.244 -14.565
  908    H    THR 118           H        THR 118 -26.516   6.856 -11.704
  909    HA   THR 118           HA       THR 118 -27.813   5.339  -9.513
  910    HB   THR 118           HB       THR 118 -28.958   7.566  -9.208
  911    HG1  THR 118           1HG      THR 118 -28.705   9.068 -10.665
  912   1HG2  THR 118          1HG2      THR 118 -25.942   7.701  -9.476
  913   2HG2  THR 118          2HG2      THR 118 -26.804   7.022  -8.095
  914   3HG2  THR 118          3HG2      THR 118 -26.946   8.741  -8.465